Program PWSCF v.5.3.0 (svn rev. 11974) starts on 31Jan2017 at 21:35:26 This program is part of the open-source Quantum ESPRESSO suite for quantum simulation of materials; please cite "P. Giannozzi et al., J. Phys.:Condens. Matter 21 395502 (2009); URL http://www.quantum-espresso.org", in publications or presentations arising from this work. More details at http://www.quantum-espresso.org/quote Parallel version (MPI), running on 72 processors R & G space division: proc/nbgrp/npool/nimage = 72 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: ./ZrGePt.save/ file Pt.rel-pbe-n-rrkjus_psl.1.0.0.UPF: wavefunction(s) 6S 5D renormalized Subspace diagonalization in iterative solution of the eigenvalue problem: one sub-group per k-point group (pool) will be used scalapack distributed-memory algorithm (size of sub-group: 6* 6 procs) Parallelization info -------------------- sticks: dense smooth PW G-vecs: dense smooth PW Min 45 20 6 2889 886 138 Max 46 21 7 2896 925 144 Sum 3243 1497 437 208257 65341 10175 bravais-lattice index = 14 lattice parameter (alat) = 7.5120 a.u. unit-cell volume = 1369.0100 (a.u.)^3 number of atoms/cell = 12 number of atomic types = 3 number of electrons = 72.00 number of Kohn-Sham states= 86 kinetic-energy cutoff = 50.0000 Ry charge density cutoff = 433.0000 Ry Exchange-correlation = PBE ( 1 4 3 4 0 0) Non magnetic calculation with spin-orbit celldm(1)= 7.512039 celldm(2)= 1.674909 celldm(3)= 1.928155 celldm(4)= 0.000000 celldm(5)= 0.000000 celldm(6)= 0.000000 crystal axes: (cart. coord. in units of alat) a(1) = ( 1.000000 0.000000 0.000000 ) a(2) = ( 0.000000 1.674909 0.000000 ) a(3) = ( 0.000000 0.000000 1.928155 ) reciprocal axes: (cart. coord. in units 2 pi/alat) b(1) = ( 1.000000 -0.000000 -0.000000 ) b(2) = ( 0.000000 0.597047 -0.000000 ) b(3) = ( 0.000000 0.000000 0.518631 ) PseudoPot. # 1 for Ge read from file: /users/gautes/Pseudo/Ge.rel-pbe-n-rrkjus_psl.1.0.0.UPF MD5 check sum: 069ab8842bb693aa9ce6e533f48e0b78 Pseudo is Ultrasoft + core correction, Zval = 4.0 Generated using "atomic" code by A. Dal Corso v.5.0.2 svn rev. 9656 Using radial grid of 1207 points, 6 beta functions with: l(1) = 0 l(2) = 0 l(3) = 1 l(4) = 1 l(5) = 1 l(6) = 1 Q(r) pseudized with 0 coefficients PseudoPot. # 2 for Zr read from file: /users/gautes/Pseudo/Zr.rel-pbe-n-nc.UPF MD5 check sum: 453101d5cee66cf3691e2371f73c5d7d Pseudo is Norm-conserving + core correction, Zval = 4.0 Generated using "atomic" code by A. Dal Corso v.5.0.2 svn rev. 9656 Using radial grid of 1225 points, 4 beta functions with: l(1) = 1 l(2) = 1 l(3) = 2 l(4) = 2 PseudoPot. # 3 for Pt read from file: /users/gautes/Pseudo/Pt.rel-pbe-n-rrkjus_psl.1.0.0.UPF MD5 check sum: 5a767c0d250ba2b616d7addddc548ecc Pseudo is Ultrasoft + core correction, Zval = 10.0 Generated using "atomic" code by A. Dal Corso v.5.0.2 svn rev. 9656 Using radial grid of 1277 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 Ge 4.00 72.64000 Ge( 1.00) Zr 4.00 91.22400 Zr( 1.00) Pt 10.00 195.08400 Pt( 1.00) 8 Sym. Ops., with inversion, found ( 6 have fractional translation) s frac. trans. isym = 1 identity cryst. s( 1) = ( 1 0 0 ) ( 0 1 0 ) ( 0 0 1 ) cart. s( 1) = ( 1.0000000 0.0000000 -0.0000000 ) ( 0.0000000 1.0000000 -0.0000000 ) ( 0.0000000 0.0000000 1.0000000 ) isym = 2 180 deg rotation - cart. axis [0,0,1] cryst. s( 2) = ( -1 0 0 ) f =( 0.0000000 ) ( 0 -1 0 ) ( 0.5000000 ) ( 0 0 1 ) ( 0.5000000 ) cart. s( 2) = ( -1.0000000 -0.0000000 0.0000000 ) f =( 0.0000000 ) ( 0.0000000 -1.0000000 0.0000000 ) ( 0.8374547 ) ( 0.0000000 0.0000000 1.0000000 ) ( 0.9640773 ) isym = 3 180 deg rotation - cart. axis [0,1,0] cryst. s( 3) = ( -1 0 0 ) f =( 0.5000000 ) ( 0 1 0 ) ( 0.5000000 ) ( 0 0 -1 ) ( -0.5000000 ) cart. s( 3) = ( -1.0000000 0.0000000 -0.0000000 ) f =( 0.5000000 ) ( 0.0000000 1.0000000 -0.0000000 ) ( 0.8374547 ) ( 0.0000000 0.0000000 -1.0000000 ) ( -0.9640773 ) isym = 4 180 deg rotation - cart. axis [1,0,0] cryst. s( 4) = ( 1 0 0 ) f =( 0.5000000 ) ( 0 -1 0 ) ( 0.0000000 ) ( 0 0 -1 ) ( 0.0000000 ) cart. s( 4) = ( 1.0000000 -0.0000000 -0.0000000 ) f =( 0.5000000 ) ( 0.0000000 -1.0000000 0.0000000 ) ( 0.0000000 ) ( 0.0000000 0.0000000 -1.0000000 ) ( 0.0000000 ) isym = 5 inversion cryst. s( 5) = ( -1 0 0 ) ( 0 -1 0 ) ( 0 0 -1 ) cart. s( 5) = ( -1.0000000 -0.0000000 0.0000000 ) ( 0.0000000 -1.0000000 0.0000000 ) ( 0.0000000 0.0000000 -1.0000000 ) isym = 6 inv. 180 deg rotation - cart. axis [0,0,1] cryst. s( 6) = ( 1 0 0 ) f =( 0.0000000 ) ( 0 1 0 ) ( 0.5000000 ) ( 0 0 -1 ) ( -0.5000000 ) cart. s( 6) = ( 1.0000000 0.0000000 -0.0000000 ) f =( -0.0000000 ) ( 0.0000000 1.0000000 -0.0000000 ) ( 0.8374547 ) ( 0.0000000 0.0000000 -1.0000000 ) ( -0.9640773 ) isym = 7 inv. 180 deg rotation - cart. axis [0,1,0] cryst. s( 7) = ( 1 0 0 ) f =( 0.5000000 ) ( 0 -1 0 ) ( 0.5000000 ) ( 0 0 1 ) ( 0.5000000 ) cart. s( 7) = ( 1.0000000 -0.0000000 0.0000000 ) f =( 0.5000000 ) ( 0.0000000 -1.0000000 0.0000000 ) ( 0.8374547 ) ( 0.0000000 0.0000000 1.0000000 ) ( 0.9640773 ) isym = 8 inv. 180 deg rotation - cart. axis [1,0,0] cryst. s( 8) = ( -1 0 0 ) f =( 0.5000000 ) ( 0 1 0 ) ( 0.0000000 ) ( 0 0 1 ) ( 0.0000000 ) cart. s( 8) = ( -1.0000000 0.0000000 0.0000000 ) f =( 0.5000000 ) ( 0.0000000 1.0000000 -0.0000000 ) ( 0.0000000 ) ( 0.0000000 0.0000000 1.0000000 ) ( 0.0000000 ) double point group D_2h (mmm) there are 10 classes and 2 irreducible representations the character table: E -E C2 C2' C2'' i -i s_v s_v' s_v'' -C2 -C2' -C2'' -s_v -s_v' -s_v' G_5+ 2.00 -2.00 0.00 0.00 0.00 2.00 -2.00 0.00 0.00 0.00 G_5- 2.00 -2.00 0.00 0.00 0.00 -2.00 2.00 0.00 0.00 0.00 the symmetry operations in each class and the name of the first element: E 1 identity -E -1 identity E C2 -C2 2 -2 180 deg rotation - cart. axis [0,0,1] C2' -C2' 3 -3 180 deg rotation - cart. axis [0,1,0] C2'' -C2'' 4 -4 180 deg rotation - cart. axis [1,0,0] i 5 inversion -i -5 inversion E s_v -s_v 6 -6 inv. 180 deg rotation - cart. axis [0,0,1] s_v'-s_v' 7 -7 inv. 180 deg rotation - cart. axis [0,1,0] s_v''-s_v' 8 -8 inv. 180 deg rotation - cart. axis [1,0,0] Cartesian axes number of k points= 352 Fermi-Dirac smearing, width (Ry)= 0.0010 cart. coord. in units 2pi/alat k( 1) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0028409 k( 2) = ( 0.0125000 -0.0000000 -0.0000000), wk = 0.0028409 k( 3) = ( 0.0250000 -0.0000000 -0.0000000), wk = 0.0028409 k( 4) = ( 0.0375000 -0.0000000 -0.0000000), wk = 0.0028409 k( 5) = ( 0.0500000 -0.0000000 -0.0000000), wk = 0.0028409 k( 6) = ( 0.0625000 -0.0000000 -0.0000000), wk = 0.0028409 k( 7) = ( 0.0750000 -0.0000000 -0.0000000), wk = 0.0028409 k( 8) = ( 0.0875000 -0.0000000 -0.0000000), wk = 0.0028409 k( 9) = ( 0.1000000 -0.0000000 -0.0000000), wk = 0.0028409 k( 10) = ( 0.1125000 -0.0000000 -0.0000000), wk = 0.0028409 k( 11) = ( 0.1250000 -0.0000000 -0.0000000), wk = 0.0028409 k( 12) = ( 0.1375000 -0.0000000 -0.0000000), wk = 0.0028409 k( 13) = ( 0.1500000 -0.0000000 -0.0000000), wk = 0.0028409 k( 14) = ( 0.1625000 -0.0000000 -0.0000000), wk = 0.0028409 k( 15) = ( 0.1750000 -0.0000000 -0.0000000), wk = 0.0028409 k( 16) = ( 0.1875000 -0.0000000 -0.0000000), wk = 0.0028409 k( 17) = ( 0.2000000 -0.0000000 -0.0000000), wk = 0.0028409 k( 18) = ( 0.2125000 -0.0000000 -0.0000000), wk = 0.0028409 k( 19) = ( 0.2250000 -0.0000000 -0.0000000), wk = 0.0028409 k( 20) = ( 0.2375000 -0.0000000 -0.0000000), wk = 0.0028409 k( 21) = ( 0.2500000 -0.0000000 -0.0000000), wk = 0.0028409 k( 22) = ( 0.2625000 -0.0000000 -0.0000000), wk = 0.0028409 k( 23) = ( 0.2750000 -0.0000000 -0.0000000), wk = 0.0028409 k( 24) = ( 0.2875000 -0.0000000 -0.0000000), wk = 0.0028409 k( 25) = ( 0.3000000 -0.0000000 -0.0000000), wk = 0.0028409 k( 26) = ( 0.3125000 -0.0000000 -0.0000000), wk = 0.0028409 k( 27) = ( 0.3250000 -0.0000000 -0.0000000), wk = 0.0028409 k( 28) = ( 0.3375000 -0.0000000 -0.0000000), wk = 0.0028409 k( 29) = ( 0.3500000 -0.0000000 -0.0000000), wk = 0.0028409 k( 30) = ( 0.3625000 -0.0000000 -0.0000000), wk = 0.0028409 k( 31) = ( 0.3750000 -0.0000000 -0.0000000), wk = 0.0028409 k( 32) = ( 0.3875000 -0.0000000 -0.0000000), wk = 0.0028409 k( 33) = ( 0.4000000 -0.0000000 -0.0000000), wk = 0.0028409 k( 34) = ( 0.4125000 -0.0000000 -0.0000000), wk = 0.0028409 k( 35) = ( 0.4250000 -0.0000000 -0.0000000), wk = 0.0028409 k( 36) = ( 0.4375000 -0.0000000 -0.0000000), wk = 0.0028409 k( 37) = ( 0.4500000 -0.0000000 -0.0000000), wk = 0.0028409 k( 38) = ( 0.4625000 -0.0000000 -0.0000000), wk = 0.0028409 k( 39) = ( 0.4750000 -0.0000000 -0.0000000), wk = 0.0028409 k( 40) = ( 0.4875000 -0.0000000 -0.0000000), wk = 0.0028409 k( 41) = ( 0.5000000 -0.0000000 -0.0000000), wk = 0.0028409 k( 42) = ( 0.5000000 -0.0000000 -0.0000000), wk = 0.0028409 k( 43) = ( 0.5000000 0.0124385 -0.0000000), wk = 0.0028409 k( 44) = ( 0.5000000 0.0248770 -0.0000000), wk = 0.0028409 k( 45) = ( 0.5000000 0.0373155 -0.0000000), wk = 0.0028409 k( 46) = ( 0.5000000 0.0497539 -0.0000000), wk = 0.0028409 k( 47) = ( 0.5000000 0.0621924 -0.0000000), wk = 0.0028409 k( 48) = ( 0.5000000 0.0746309 -0.0000000), wk = 0.0028409 k( 49) = ( 0.5000000 0.0870694 -0.0000000), wk = 0.0028409 k( 50) = ( 0.5000000 0.0995079 -0.0000000), wk = 0.0028409 k( 51) = ( 0.5000000 0.1119464 -0.0000000), wk = 0.0028409 k( 52) = ( 0.5000000 0.1243848 -0.0000000), wk = 0.0028409 k( 53) = ( 0.5000000 0.1368233 -0.0000000), wk = 0.0028409 k( 54) = ( 0.5000000 0.1492618 -0.0000000), wk = 0.0028409 k( 55) = ( 0.5000000 0.1617003 -0.0000000), wk = 0.0028409 k( 56) = ( 0.5000000 0.1741388 -0.0000000), wk = 0.0028409 k( 57) = ( 0.5000000 0.1865773 -0.0000000), wk = 0.0028409 k( 58) = ( 0.5000000 0.1990157 -0.0000000), wk = 0.0028409 k( 59) = ( 0.5000000 0.2114542 -0.0000000), wk = 0.0028409 k( 60) = ( 0.5000000 0.2238927 -0.0000000), wk = 0.0028409 k( 61) = ( 0.5000000 0.2363312 -0.0000000), wk = 0.0028409 k( 62) = ( 0.5000000 0.2487697 -0.0000000), wk = 0.0028409 k( 63) = ( 0.5000000 0.2612082 -0.0000000), wk = 0.0028409 k( 64) = ( 0.5000000 0.2736466 -0.0000000), wk = 0.0028409 k( 65) = ( 0.5000000 0.2860851 -0.0000000), wk = 0.0028409 k( 66) = ( 0.5000000 0.2985236 -0.0000000), wk = 0.0028409 k( 67) = ( 0.5000000 0.2985236 -0.0000000), wk = 0.0028409 k( 68) = ( 0.4875000 0.2985236 -0.0000000), wk = 0.0028409 k( 69) = ( 0.4750000 0.2985236 -0.0000000), wk = 0.0028409 k( 70) = ( 0.4625000 0.2985236 -0.0000000), wk = 0.0028409 k( 71) = ( 0.4500000 0.2985236 -0.0000000), wk = 0.0028409 k( 72) = ( 0.4375000 0.2985236 -0.0000000), wk = 0.0028409 k( 73) = ( 0.4250000 0.2985236 -0.0000000), wk = 0.0028409 k( 74) = ( 0.4125000 0.2985236 -0.0000000), wk = 0.0028409 k( 75) = ( 0.4000000 0.2985236 -0.0000000), wk = 0.0028409 k( 76) = ( 0.3875000 0.2985236 -0.0000000), wk = 0.0028409 k( 77) = ( 0.3750000 0.2985236 -0.0000000), wk = 0.0028409 k( 78) = ( 0.3625000 0.2985236 -0.0000000), wk = 0.0028409 k( 79) = ( 0.3500000 0.2985236 -0.0000000), wk = 0.0028409 k( 80) = ( 0.3375000 0.2985236 -0.0000000), wk = 0.0028409 k( 81) = ( 0.3250000 0.2985236 -0.0000000), wk = 0.0028409 k( 82) = ( 0.3125000 0.2985236 -0.0000000), wk = 0.0028409 k( 83) = ( 0.3000000 0.2985236 -0.0000000), wk = 0.0028409 k( 84) = ( 0.2875000 0.2985236 -0.0000000), wk = 0.0028409 k( 85) = ( 0.2750000 0.2985236 -0.0000000), wk = 0.0028409 k( 86) = ( 0.2625000 0.2985236 -0.0000000), wk = 0.0028409 k( 87) = ( 0.2500000 0.2985236 -0.0000000), wk = 0.0028409 k( 88) = ( 0.2375000 0.2985236 -0.0000000), wk = 0.0028409 k( 89) = ( 0.2250000 0.2985236 -0.0000000), wk = 0.0028409 k( 90) = ( 0.2125000 0.2985236 -0.0000000), wk = 0.0028409 k( 91) = ( 0.2000000 0.2985236 -0.0000000), wk = 0.0028409 k( 92) = ( 0.1875000 0.2985236 -0.0000000), wk = 0.0028409 k( 93) = ( 0.1750000 0.2985236 -0.0000000), wk = 0.0028409 k( 94) = ( 0.1625000 0.2985236 -0.0000000), wk = 0.0028409 k( 95) = ( 0.1500000 0.2985236 -0.0000000), wk = 0.0028409 k( 96) = ( 0.1375000 0.2985236 -0.0000000), wk = 0.0028409 k( 97) = ( 0.1250000 0.2985236 -0.0000000), wk = 0.0028409 k( 98) = ( 0.1125000 0.2985236 -0.0000000), wk = 0.0028409 k( 99) = ( 0.1000000 0.2985236 -0.0000000), wk = 0.0028409 k( 100) = ( 0.0875000 0.2985236 -0.0000000), wk = 0.0028409 k( 101) = ( 0.0750000 0.2985236 -0.0000000), wk = 0.0028409 k( 102) = ( 0.0625000 0.2985236 -0.0000000), wk = 0.0028409 k( 103) = ( 0.0500000 0.2985236 -0.0000000), wk = 0.0028409 k( 104) = ( 0.0375000 0.2985236 -0.0000000), wk = 0.0028409 k( 105) = ( 0.0250000 0.2985236 -0.0000000), wk = 0.0028409 k( 106) = ( 0.0125000 0.2985236 -0.0000000), wk = 0.0028409 k( 107) = ( 0.0000000 0.2985236 -0.0000000), wk = 0.0028409 k( 108) = ( 0.0000000 0.2985236 -0.0000000), wk = 0.0028409 k( 109) = ( 0.0000000 0.2860851 -0.0000000), wk = 0.0028409 k( 110) = ( 0.0000000 0.2736466 -0.0000000), wk = 0.0028409 k( 111) = ( 0.0000000 0.2612082 -0.0000000), wk = 0.0028409 k( 112) = ( 0.0000000 0.2487697 -0.0000000), wk = 0.0028409 k( 113) = ( 0.0000000 0.2363312 -0.0000000), wk = 0.0028409 k( 114) = ( 0.0000000 0.2238927 -0.0000000), wk = 0.0028409 k( 115) = ( 0.0000000 0.2114542 -0.0000000), wk = 0.0028409 k( 116) = ( 0.0000000 0.1990157 -0.0000000), wk = 0.0028409 k( 117) = ( 0.0000000 0.1865773 -0.0000000), wk = 0.0028409 k( 118) = ( 0.0000000 0.1741388 -0.0000000), wk = 0.0028409 k( 119) = ( 0.0000000 0.1617003 -0.0000000), wk = 0.0028409 k( 120) = ( 0.0000000 0.1492618 -0.0000000), wk = 0.0028409 k( 121) = ( 0.0000000 0.1368233 -0.0000000), wk = 0.0028409 k( 122) = ( 0.0000000 0.1243848 -0.0000000), wk = 0.0028409 k( 123) = ( 0.0000000 0.1119464 -0.0000000), wk = 0.0028409 k( 124) = ( 0.0000000 0.0995079 -0.0000000), wk = 0.0028409 k( 125) = ( 0.0000000 0.0870694 -0.0000000), wk = 0.0028409 k( 126) = ( 0.0000000 0.0746309 -0.0000000), wk = 0.0028409 k( 127) = ( 0.0000000 0.0621924 -0.0000000), wk = 0.0028409 k( 128) = ( 0.0000000 0.0497539 -0.0000000), wk = 0.0028409 k( 129) = ( 0.0000000 0.0373155 -0.0000000), wk = 0.0028409 k( 130) = ( 0.0000000 0.0248770 -0.0000000), wk = 0.0028409 k( 131) = ( 0.0000000 0.0124385 -0.0000000), wk = 0.0028409 k( 132) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0028409 k( 133) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0028409 k( 134) = ( 0.0000000 0.0000000 0.0123483), wk = 0.0028409 k( 135) = ( 0.0000000 0.0000000 0.0246967), wk = 0.0028409 k( 136) = ( 0.0000000 0.0000000 0.0370450), wk = 0.0028409 k( 137) = ( 0.0000000 0.0000000 0.0493934), wk = 0.0028409 k( 138) = ( 0.0000000 0.0000000 0.0617417), wk = 0.0028409 k( 139) = ( 0.0000000 0.0000000 0.0740901), wk = 0.0028409 k( 140) = ( 0.0000000 0.0000000 0.0864384), wk = 0.0028409 k( 141) = ( 0.0000000 0.0000000 0.0987868), wk = 0.0028409 k( 142) = ( 0.0000000 0.0000000 0.1111351), wk = 0.0028409 k( 143) = ( 0.0000000 0.0000000 0.1234835), wk = 0.0028409 k( 144) = ( 0.0000000 0.0000000 0.1358318), wk = 0.0028409 k( 145) = ( 0.0000000 0.0000000 0.1481802), wk = 0.0028409 k( 146) = ( 0.0000000 0.0000000 0.1605285), wk = 0.0028409 k( 147) = ( 0.0000000 0.0000000 0.1728769), wk = 0.0028409 k( 148) = ( 0.0000000 0.0000000 0.1852252), wk = 0.0028409 k( 149) = ( 0.0000000 0.0000000 0.1975736), wk = 0.0028409 k( 150) = ( 0.0000000 0.0000000 0.2099219), wk = 0.0028409 k( 151) = ( 0.0000000 0.0000000 0.2222703), wk = 0.0028409 k( 152) = ( 0.0000000 0.0000000 0.2346186), wk = 0.0028409 k( 153) = ( 0.0000000 0.0000000 0.2469670), wk = 0.0028409 k( 154) = ( 0.0000000 0.0000000 0.2593153), wk = 0.0028409 k( 155) = ( 0.0000000 0.0000000 0.2593153), wk = 0.0028409 k( 156) = ( 0.0125000 -0.0000000 0.2593153), wk = 0.0028409 k( 157) = ( 0.0250000 -0.0000000 0.2593153), wk = 0.0028409 k( 158) = ( 0.0375000 -0.0000000 0.2593153), wk = 0.0028409 k( 159) = ( 0.0500000 -0.0000000 0.2593153), wk = 0.0028409 k( 160) = ( 0.0625000 -0.0000000 0.2593153), wk = 0.0028409 k( 161) = ( 0.0750000 -0.0000000 0.2593153), wk = 0.0028409 k( 162) = ( 0.0875000 -0.0000000 0.2593153), wk = 0.0028409 k( 163) = ( 0.1000000 -0.0000000 0.2593153), wk = 0.0028409 k( 164) = ( 0.1125000 -0.0000000 0.2593153), wk = 0.0028409 k( 165) = ( 0.1250000 -0.0000000 0.2593153), wk = 0.0028409 k( 166) = ( 0.1375000 -0.0000000 0.2593153), wk = 0.0028409 k( 167) = ( 0.1500000 -0.0000000 0.2593153), wk = 0.0028409 k( 168) = ( 0.1625000 -0.0000000 0.2593153), wk = 0.0028409 k( 169) = ( 0.1750000 -0.0000000 0.2593153), wk = 0.0028409 k( 170) = ( 0.1875000 -0.0000000 0.2593153), wk = 0.0028409 k( 171) = ( 0.2000000 -0.0000000 0.2593153), wk = 0.0028409 k( 172) = ( 0.2125000 -0.0000000 0.2593153), wk = 0.0028409 k( 173) = ( 0.2250000 -0.0000000 0.2593153), wk = 0.0028409 k( 174) = ( 0.2375000 -0.0000000 0.2593153), wk = 0.0028409 k( 175) = ( 0.2500000 -0.0000000 0.2593153), wk = 0.0028409 k( 176) = ( 0.2625000 -0.0000000 0.2593153), wk = 0.0028409 k( 177) = ( 0.2750000 -0.0000000 0.2593153), wk = 0.0028409 k( 178) = ( 0.2875000 -0.0000000 0.2593153), wk = 0.0028409 k( 179) = ( 0.3000000 -0.0000000 0.2593153), wk = 0.0028409 k( 180) = ( 0.3125000 -0.0000000 0.2593153), wk = 0.0028409 k( 181) = ( 0.3250000 -0.0000000 0.2593153), wk = 0.0028409 k( 182) = ( 0.3375000 -0.0000000 0.2593153), wk = 0.0028409 k( 183) = ( 0.3500000 -0.0000000 0.2593153), wk = 0.0028409 k( 184) = ( 0.3625000 -0.0000000 0.2593153), wk = 0.0028409 k( 185) = ( 0.3750000 -0.0000000 0.2593153), wk = 0.0028409 k( 186) = ( 0.3875000 -0.0000000 0.2593153), wk = 0.0028409 k( 187) = ( 0.4000000 -0.0000000 0.2593153), wk = 0.0028409 k( 188) = ( 0.4125000 -0.0000000 0.2593153), wk = 0.0028409 k( 189) = ( 0.4250000 -0.0000000 0.2593153), wk = 0.0028409 k( 190) = ( 0.4375000 -0.0000000 0.2593153), wk = 0.0028409 k( 191) = ( 0.4500000 -0.0000000 0.2593153), wk = 0.0028409 k( 192) = ( 0.4625000 -0.0000000 0.2593153), wk = 0.0028409 k( 193) = ( 0.4750000 -0.0000000 0.2593153), wk = 0.0028409 k( 194) = ( 0.4875000 -0.0000000 0.2593153), wk = 0.0028409 k( 195) = ( 0.5000000 -0.0000000 0.2593153), wk = 0.0028409 k( 196) = ( 0.5000000 -0.0000000 0.2593153), wk = 0.0028409 k( 197) = ( 0.5000000 0.0124385 0.2593153), wk = 0.0028409 k( 198) = ( 0.5000000 0.0248770 0.2593153), wk = 0.0028409 k( 199) = ( 0.5000000 0.0373155 0.2593153), wk = 0.0028409 k( 200) = ( 0.5000000 0.0497539 0.2593153), wk = 0.0028409 k( 201) = ( 0.5000000 0.0621924 0.2593153), wk = 0.0028409 k( 202) = ( 0.5000000 0.0746309 0.2593153), wk = 0.0028409 k( 203) = ( 0.5000000 0.0870694 0.2593153), wk = 0.0028409 k( 204) = ( 0.5000000 0.0995079 0.2593153), wk = 0.0028409 k( 205) = ( 0.5000000 0.1119464 0.2593153), wk = 0.0028409 k( 206) = ( 0.5000000 0.1243848 0.2593153), wk = 0.0028409 k( 207) = ( 0.5000000 0.1368233 0.2593153), wk = 0.0028409 k( 208) = ( 0.5000000 0.1492618 0.2593153), wk = 0.0028409 k( 209) = ( 0.5000000 0.1617003 0.2593153), wk = 0.0028409 k( 210) = ( 0.5000000 0.1741388 0.2593153), wk = 0.0028409 k( 211) = ( 0.5000000 0.1865773 0.2593153), wk = 0.0028409 k( 212) = ( 0.5000000 0.1990157 0.2593153), wk = 0.0028409 k( 213) = ( 0.5000000 0.2114542 0.2593153), wk = 0.0028409 k( 214) = ( 0.5000000 0.2238927 0.2593153), wk = 0.0028409 k( 215) = ( 0.5000000 0.2363312 0.2593153), wk = 0.0028409 k( 216) = ( 0.5000000 0.2487697 0.2593153), wk = 0.0028409 k( 217) = ( 0.5000000 0.2612082 0.2593153), wk = 0.0028409 k( 218) = ( 0.5000000 0.2736466 0.2593153), wk = 0.0028409 k( 219) = ( 0.5000000 0.2860851 0.2593153), wk = 0.0028409 k( 220) = ( 0.5000000 0.2985236 0.2593153), wk = 0.0028409 k( 221) = ( 0.5000000 0.2985236 0.2593153), wk = 0.0028409 k( 222) = ( 0.4875000 0.2985236 0.2593153), wk = 0.0028409 k( 223) = ( 0.4750000 0.2985236 0.2593153), wk = 0.0028409 k( 224) = ( 0.4625000 0.2985236 0.2593153), wk = 0.0028409 k( 225) = ( 0.4500000 0.2985236 0.2593153), wk = 0.0028409 k( 226) = ( 0.4375000 0.2985236 0.2593153), wk = 0.0028409 k( 227) = ( 0.4250000 0.2985236 0.2593153), wk = 0.0028409 k( 228) = ( 0.4125000 0.2985236 0.2593153), wk = 0.0028409 k( 229) = ( 0.4000000 0.2985236 0.2593153), wk = 0.0028409 k( 230) = ( 0.3875000 0.2985236 0.2593153), wk = 0.0028409 k( 231) = ( 0.3750000 0.2985236 0.2593153), wk = 0.0028409 k( 232) = ( 0.3625000 0.2985236 0.2593153), wk = 0.0028409 k( 233) = ( 0.3500000 0.2985236 0.2593153), wk = 0.0028409 k( 234) = ( 0.3375000 0.2985236 0.2593153), wk = 0.0028409 k( 235) = ( 0.3250000 0.2985236 0.2593153), wk = 0.0028409 k( 236) = ( 0.3125000 0.2985236 0.2593153), wk = 0.0028409 k( 237) = ( 0.3000000 0.2985236 0.2593153), wk = 0.0028409 k( 238) = ( 0.2875000 0.2985236 0.2593153), wk = 0.0028409 k( 239) = ( 0.2750000 0.2985236 0.2593153), wk = 0.0028409 k( 240) = ( 0.2625000 0.2985236 0.2593153), wk = 0.0028409 k( 241) = ( 0.2500000 0.2985236 0.2593153), wk = 0.0028409 k( 242) = ( 0.2375000 0.2985236 0.2593153), wk = 0.0028409 k( 243) = ( 0.2250000 0.2985236 0.2593153), wk = 0.0028409 k( 244) = ( 0.2125000 0.2985236 0.2593153), wk = 0.0028409 k( 245) = ( 0.2000000 0.2985236 0.2593153), wk = 0.0028409 k( 246) = ( 0.1875000 0.2985236 0.2593153), wk = 0.0028409 k( 247) = ( 0.1750000 0.2985236 0.2593153), wk = 0.0028409 k( 248) = ( 0.1625000 0.2985236 0.2593153), wk = 0.0028409 k( 249) = ( 0.1500000 0.2985236 0.2593153), wk = 0.0028409 k( 250) = ( 0.1375000 0.2985236 0.2593153), wk = 0.0028409 k( 251) = ( 0.1250000 0.2985236 0.2593153), wk = 0.0028409 k( 252) = ( 0.1125000 0.2985236 0.2593153), wk = 0.0028409 k( 253) = ( 0.1000000 0.2985236 0.2593153), wk = 0.0028409 k( 254) = ( 0.0875000 0.2985236 0.2593153), wk = 0.0028409 k( 255) = ( 0.0750000 0.2985236 0.2593153), wk = 0.0028409 k( 256) = ( 0.0625000 0.2985236 0.2593153), wk = 0.0028409 k( 257) = ( 0.0500000 0.2985236 0.2593153), wk = 0.0028409 k( 258) = ( 0.0375000 0.2985236 0.2593153), wk = 0.0028409 k( 259) = ( 0.0250000 0.2985236 0.2593153), wk = 0.0028409 k( 260) = ( 0.0125000 0.2985236 0.2593153), wk = 0.0028409 k( 261) = ( 0.0000000 0.2985236 0.2593153), wk = 0.0028409 k( 262) = ( 0.0000000 0.2985236 0.2593153), wk = 0.0028409 k( 263) = ( 0.0000000 0.2860851 0.2593153), wk = 0.0028409 k( 264) = ( 0.0000000 0.2736466 0.2593153), wk = 0.0028409 k( 265) = ( 0.0000000 0.2612082 0.2593153), wk = 0.0028409 k( 266) = ( 0.0000000 0.2487697 0.2593153), wk = 0.0028409 k( 267) = ( 0.0000000 0.2363312 0.2593153), wk = 0.0028409 k( 268) = ( 0.0000000 0.2238927 0.2593153), wk = 0.0028409 k( 269) = ( 0.0000000 0.2114542 0.2593153), wk = 0.0028409 k( 270) = ( 0.0000000 0.1990157 0.2593153), wk = 0.0028409 k( 271) = ( 0.0000000 0.1865773 0.2593153), wk = 0.0028409 k( 272) = ( 0.0000000 0.1741388 0.2593153), wk = 0.0028409 k( 273) = ( 0.0000000 0.1617003 0.2593153), wk = 0.0028409 k( 274) = ( 0.0000000 0.1492618 0.2593153), wk = 0.0028409 k( 275) = ( 0.0000000 0.1368233 0.2593153), wk = 0.0028409 k( 276) = ( 0.0000000 0.1243848 0.2593153), wk = 0.0028409 k( 277) = ( 0.0000000 0.1119464 0.2593153), wk = 0.0028409 k( 278) = ( 0.0000000 0.0995079 0.2593153), wk = 0.0028409 k( 279) = ( 0.0000000 0.0870694 0.2593153), wk = 0.0028409 k( 280) = ( 0.0000000 0.0746309 0.2593153), wk = 0.0028409 k( 281) = ( 0.0000000 0.0621924 0.2593153), wk = 0.0028409 k( 282) = ( 0.0000000 0.0497539 0.2593153), wk = 0.0028409 k( 283) = ( 0.0000000 0.0373155 0.2593153), wk = 0.0028409 k( 284) = ( 0.0000000 0.0248770 0.2593153), wk = 0.0028409 k( 285) = ( 0.0000000 0.0124385 0.2593153), wk = 0.0028409 k( 286) = ( 0.0000000 0.0000000 0.2593153), wk = 0.0028409 k( 287) = ( 0.0000000 0.2985236 -0.0000000), wk = 0.0028409 k( 288) = ( 0.0000000 0.2985236 0.0123483), wk = 0.0028409 k( 289) = ( 0.0000000 0.2985236 0.0246967), wk = 0.0028409 k( 290) = ( 0.0000000 0.2985236 0.0370450), wk = 0.0028409 k( 291) = ( 0.0000000 0.2985236 0.0493934), wk = 0.0028409 k( 292) = ( 0.0000000 0.2985236 0.0617417), wk = 0.0028409 k( 293) = ( 0.0000000 0.2985236 0.0740901), wk = 0.0028409 k( 294) = ( 0.0000000 0.2985236 0.0864384), wk = 0.0028409 k( 295) = ( 0.0000000 0.2985236 0.0987868), wk = 0.0028409 k( 296) = ( 0.0000000 0.2985236 0.1111351), wk = 0.0028409 k( 297) = ( 0.0000000 0.2985236 0.1234835), wk = 0.0028409 k( 298) = ( 0.0000000 0.2985236 0.1358318), wk = 0.0028409 k( 299) = ( 0.0000000 0.2985236 0.1481802), wk = 0.0028409 k( 300) = ( 0.0000000 0.2985236 0.1605285), wk = 0.0028409 k( 301) = ( 0.0000000 0.2985236 0.1728769), wk = 0.0028409 k( 302) = ( 0.0000000 0.2985236 0.1852252), wk = 0.0028409 k( 303) = ( 0.0000000 0.2985236 0.1975736), wk = 0.0028409 k( 304) = ( 0.0000000 0.2985236 0.2099219), wk = 0.0028409 k( 305) = ( 0.0000000 0.2985236 0.2222703), wk = 0.0028409 k( 306) = ( 0.0000000 0.2985236 0.2346186), wk = 0.0028409 k( 307) = ( 0.0000000 0.2985236 0.2469670), wk = 0.0028409 k( 308) = ( 0.0000000 0.2985236 0.2593153), wk = 0.0028409 k( 309) = ( 0.5000000 -0.0000000 0.2593153), wk = 0.0028409 k( 310) = ( 0.5000000 -0.0000000 0.2469670), wk = 0.0028409 k( 311) = ( 0.5000000 -0.0000000 0.2346186), wk = 0.0028409 k( 312) = ( 0.5000000 -0.0000000 0.2222703), wk = 0.0028409 k( 313) = ( 0.5000000 -0.0000000 0.2099219), wk = 0.0028409 k( 314) = ( 0.5000000 -0.0000000 0.1975736), wk = 0.0028409 k( 315) = ( 0.5000000 -0.0000000 0.1852252), wk = 0.0028409 k( 316) = ( 0.5000000 -0.0000000 0.1728769), wk = 0.0028409 k( 317) = ( 0.5000000 -0.0000000 0.1605285), wk = 0.0028409 k( 318) = ( 0.5000000 -0.0000000 0.1481802), wk = 0.0028409 k( 319) = ( 0.5000000 -0.0000000 0.1358318), wk = 0.0028409 k( 320) = ( 0.5000000 -0.0000000 0.1234835), wk = 0.0028409 k( 321) = ( 0.5000000 -0.0000000 0.1111351), wk = 0.0028409 k( 322) = ( 0.5000000 -0.0000000 0.0987868), wk = 0.0028409 k( 323) = ( 0.5000000 -0.0000000 0.0864384), wk = 0.0028409 k( 324) = ( 0.5000000 -0.0000000 0.0740901), wk = 0.0028409 k( 325) = ( 0.5000000 -0.0000000 0.0617417), wk = 0.0028409 k( 326) = ( 0.5000000 -0.0000000 0.0493934), wk = 0.0028409 k( 327) = ( 0.5000000 -0.0000000 0.0370450), wk = 0.0028409 k( 328) = ( 0.5000000 -0.0000000 0.0246967), wk = 0.0028409 k( 329) = ( 0.5000000 -0.0000000 0.0123483), wk = 0.0028409 k( 330) = ( 0.5000000 -0.0000000 -0.0000000), wk = 0.0028409 k( 331) = ( 0.5000000 0.2985236 -0.0000000), wk = 0.0028409 k( 332) = ( 0.5000000 0.2985236 0.0123483), wk = 0.0028409 k( 333) = ( 0.5000000 0.2985236 0.0246967), wk = 0.0028409 k( 334) = ( 0.5000000 0.2985236 0.0370450), wk = 0.0028409 k( 335) = ( 0.5000000 0.2985236 0.0493934), wk = 0.0028409 k( 336) = ( 0.5000000 0.2985236 0.0617417), wk = 0.0028409 k( 337) = ( 0.5000000 0.2985236 0.0740901), wk = 0.0028409 k( 338) = ( 0.5000000 0.2985236 0.0864384), wk = 0.0028409 k( 339) = ( 0.5000000 0.2985236 0.0987868), wk = 0.0028409 k( 340) = ( 0.5000000 0.2985236 0.1111351), wk = 0.0028409 k( 341) = ( 0.5000000 0.2985236 0.1234835), wk = 0.0028409 k( 342) = ( 0.5000000 0.2985236 0.1358318), wk = 0.0028409 k( 343) = ( 0.5000000 0.2985236 0.1481802), wk = 0.0028409 k( 344) = ( 0.5000000 0.2985236 0.1605285), wk = 0.0028409 k( 345) = ( 0.5000000 0.2985236 0.1728769), wk = 0.0028409 k( 346) = ( 0.5000000 0.2985236 0.1852252), wk = 0.0028409 k( 347) = ( 0.5000000 0.2985236 0.1975736), wk = 0.0028409 k( 348) = ( 0.5000000 0.2985236 0.2099219), wk = 0.0028409 k( 349) = ( 0.5000000 0.2985236 0.2222703), wk = 0.0028409 k( 350) = ( 0.5000000 0.2985236 0.2346186), wk = 0.0028409 k( 351) = ( 0.5000000 0.2985236 0.2469670), wk = 0.0028409 k( 352) = ( 0.5000000 0.2985236 0.2593153), wk = 0.0028409 cryst. coord. k( 1) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0028409 k( 2) = ( 0.0125000 -0.0000000 -0.0000000), wk = 0.0028409 k( 3) = ( 0.0250000 -0.0000000 -0.0000000), wk = 0.0028409 k( 4) = ( 0.0375000 -0.0000000 -0.0000000), wk = 0.0028409 k( 5) = ( 0.0500000 -0.0000000 -0.0000000), wk = 0.0028409 k( 6) = ( 0.0625000 0.0000000 -0.0000000), wk = 0.0028409 k( 7) = ( 0.0750000 -0.0000000 -0.0000000), wk = 0.0028409 k( 8) = ( 0.0875000 0.0000000 -0.0000000), wk = 0.0028409 k( 9) = ( 0.1000000 -0.0000000 -0.0000000), wk = 0.0028409 k( 10) = ( 0.1125000 -0.0000000 -0.0000000), wk = 0.0028409 k( 11) = ( 0.1250000 0.0000000 -0.0000000), wk = 0.0028409 k( 12) = ( 0.1375000 -0.0000000 -0.0000000), wk = 0.0028409 k( 13) = ( 0.1500000 -0.0000000 -0.0000000), wk = 0.0028409 k( 14) = ( 0.1625000 -0.0000000 -0.0000000), wk = 0.0028409 k( 15) = ( 0.1750000 0.0000000 -0.0000000), wk = 0.0028409 k( 16) = ( 0.1875000 -0.0000000 -0.0000000), wk = 0.0028409 k( 17) = ( 0.2000000 -0.0000000 -0.0000000), wk = 0.0028409 k( 18) = ( 0.2125000 0.0000000 -0.0000000), wk = 0.0028409 k( 19) = ( 0.2250000 -0.0000000 -0.0000000), wk = 0.0028409 k( 20) = ( 0.2375000 -0.0000000 -0.0000000), wk = 0.0028409 k( 21) = ( 0.2500000 0.0000000 -0.0000000), wk = 0.0028409 k( 22) = ( 0.2625000 0.0000000 -0.0000000), wk = 0.0028409 k( 23) = ( 0.2750000 -0.0000000 -0.0000000), wk = 0.0028409 k( 24) = ( 0.2875000 0.0000000 -0.0000000), wk = 0.0028409 k( 25) = ( 0.3000000 -0.0000000 -0.0000000), wk = 0.0028409 k( 26) = ( 0.3125000 -0.0000000 -0.0000000), wk = 0.0028409 k( 27) = ( 0.3250000 -0.0000000 -0.0000000), wk = 0.0028409 k( 28) = ( 0.3375000 -0.0000000 -0.0000000), wk = 0.0028409 k( 29) = ( 0.3500000 0.0000000 -0.0000000), wk = 0.0028409 k( 30) = ( 0.3625000 -0.0000000 -0.0000000), wk = 0.0028409 k( 31) = ( 0.3750000 -0.0000000 -0.0000000), wk = 0.0028409 k( 32) = ( 0.3875000 -0.0000000 -0.0000000), wk = 0.0028409 k( 33) = ( 0.4000000 -0.0000000 -0.0000000), wk = 0.0028409 k( 34) = ( 0.4125000 -0.0000000 -0.0000000), wk = 0.0028409 k( 35) = ( 0.4250000 0.0000000 -0.0000000), wk = 0.0028409 k( 36) = ( 0.4375000 0.0000000 0.0000000), wk = 0.0028409 k( 37) = ( 0.4500000 -0.0000000 -0.0000000), wk = 0.0028409 k( 38) = ( 0.4625000 0.0000000 -0.0000000), wk = 0.0028409 k( 39) = ( 0.4750000 -0.0000000 -0.0000000), wk = 0.0028409 k( 40) = ( 0.4875000 -0.0000000 -0.0000000), wk = 0.0028409 k( 41) = ( 0.5000000 0.0000000 -0.0000000), wk = 0.0028409 k( 42) = ( 0.5000000 0.0000000 -0.0000000), wk = 0.0028409 k( 43) = ( 0.5000000 0.0208333 -0.0000000), wk = 0.0028409 k( 44) = ( 0.5000000 0.0416667 -0.0000000), wk = 0.0028409 k( 45) = ( 0.5000000 0.0625000 -0.0000000), wk = 0.0028409 k( 46) = ( 0.5000000 0.0833333 -0.0000000), wk = 0.0028409 k( 47) = ( 0.5000000 0.1041667 -0.0000000), wk = 0.0028409 k( 48) = ( 0.5000000 0.1250000 -0.0000000), wk = 0.0028409 k( 49) = ( 0.5000000 0.1458333 0.0000000), wk = 0.0028409 k( 50) = ( 0.5000000 0.1666667 -0.0000000), wk = 0.0028409 k( 51) = ( 0.5000000 0.1875000 0.0000000), wk = 0.0028409 k( 52) = ( 0.5000000 0.2083333 -0.0000000), wk = 0.0028409 k( 53) = ( 0.5000000 0.2291667 0.0000000), wk = 0.0028409 k( 54) = ( 0.5000000 0.2500000 -0.0000000), wk = 0.0028409 k( 55) = ( 0.5000000 0.2708333 -0.0000000), wk = 0.0028409 k( 56) = ( 0.5000000 0.2916667 -0.0000000), wk = 0.0028409 k( 57) = ( 0.5000000 0.3125000 -0.0000000), wk = 0.0028409 k( 58) = ( 0.5000000 0.3333333 -0.0000000), wk = 0.0028409 k( 59) = ( 0.5000000 0.3541667 -0.0000000), wk = 0.0028409 k( 60) = ( 0.5000000 0.3750000 0.0000000), wk = 0.0028409 k( 61) = ( 0.5000000 0.3958333 -0.0000000), wk = 0.0028409 k( 62) = ( 0.5000000 0.4166667 -0.0000000), wk = 0.0028409 k( 63) = ( 0.5000000 0.4375000 -0.0000000), wk = 0.0028409 k( 64) = ( 0.5000000 0.4583333 0.0000000), wk = 0.0028409 k( 65) = ( 0.5000000 0.4791667 -0.0000000), wk = 0.0028409 k( 66) = ( 0.5000000 0.5000000 -0.0000000), wk = 0.0028409 k( 67) = ( 0.5000000 0.5000000 -0.0000000), wk = 0.0028409 k( 68) = ( 0.4875000 0.5000000 -0.0000000), wk = 0.0028409 k( 69) = ( 0.4750000 0.5000000 -0.0000000), wk = 0.0028409 k( 70) = ( 0.4625000 0.5000000 -0.0000000), wk = 0.0028409 k( 71) = ( 0.4500000 0.5000000 0.0000000), wk = 0.0028409 k( 72) = ( 0.4375000 0.5000000 -0.0000000), wk = 0.0028409 k( 73) = ( 0.4250000 0.5000000 0.0000000), wk = 0.0028409 k( 74) = ( 0.4125000 0.5000000 -0.0000000), wk = 0.0028409 k( 75) = ( 0.4000000 0.5000000 -0.0000000), wk = 0.0028409 k( 76) = ( 0.3875000 0.5000000 -0.0000000), wk = 0.0028409 k( 77) = ( 0.3750000 0.5000000 -0.0000000), wk = 0.0028409 k( 78) = ( 0.3625000 0.5000000 -0.0000000), wk = 0.0028409 k( 79) = ( 0.3500000 0.5000000 -0.0000000), wk = 0.0028409 k( 80) = ( 0.3375000 0.5000000 -0.0000000), wk = 0.0028409 k( 81) = ( 0.3250000 0.5000000 -0.0000000), wk = 0.0028409 k( 82) = ( 0.3125000 0.5000000 0.0000000), wk = 0.0028409 k( 83) = ( 0.3000000 0.5000000 -0.0000000), wk = 0.0028409 k( 84) = ( 0.2875000 0.5000000 0.0000000), wk = 0.0028409 k( 85) = ( 0.2750000 0.5000000 0.0000000), wk = 0.0028409 k( 86) = ( 0.2625000 0.5000000 -0.0000000), wk = 0.0028409 k( 87) = ( 0.2500000 0.5000000 0.0000000), wk = 0.0028409 k( 88) = ( 0.2375000 0.5000000 0.0000000), wk = 0.0028409 k( 89) = ( 0.2250000 0.5000000 0.0000000), wk = 0.0028409 k( 90) = ( 0.2125000 0.5000000 0.0000000), wk = 0.0028409 k( 91) = ( 0.2000000 0.5000000 0.0000000), wk = 0.0028409 k( 92) = ( 0.1875000 0.5000000 -0.0000000), wk = 0.0028409 k( 93) = ( 0.1750000 0.5000000 -0.0000000), wk = 0.0028409 k( 94) = ( 0.1625000 0.5000000 0.0000000), wk = 0.0028409 k( 95) = ( 0.1500000 0.5000000 0.0000000), wk = 0.0028409 k( 96) = ( 0.1375000 0.5000000 -0.0000000), wk = 0.0028409 k( 97) = ( 0.1250000 0.5000000 -0.0000000), wk = 0.0028409 k( 98) = ( 0.1125000 0.5000000 0.0000000), wk = 0.0028409 k( 99) = ( 0.1000000 0.5000000 -0.0000000), wk = 0.0028409 k( 100) = ( 0.0875000 0.5000000 0.0000000), wk = 0.0028409 k( 101) = ( 0.0750000 0.5000000 0.0000000), wk = 0.0028409 k( 102) = ( 0.0625000 0.5000000 0.0000000), wk = 0.0028409 k( 103) = ( 0.0500000 0.5000000 -0.0000000), wk = 0.0028409 k( 104) = ( 0.0375000 0.5000000 0.0000000), wk = 0.0028409 k( 105) = ( 0.0250000 0.5000000 0.0000000), wk = 0.0028409 k( 106) = ( 0.0125000 0.5000000 0.0000000), wk = 0.0028409 k( 107) = ( 0.0000000 0.5000000 -0.0000000), wk = 0.0028409 k( 108) = ( 0.0000000 0.5000000 -0.0000000), wk = 0.0028409 k( 109) = ( 0.0000000 0.4791667 0.0000000), wk = 0.0028409 k( 110) = ( 0.0000000 0.4583333 0.0000000), wk = 0.0028409 k( 111) = ( 0.0000000 0.4375000 -0.0000000), wk = 0.0028409 k( 112) = ( 0.0000000 0.4166667 -0.0000000), wk = 0.0028409 k( 113) = ( 0.0000000 0.3958333 0.0000000), wk = 0.0028409 k( 114) = ( 0.0000000 0.3750000 0.0000000), wk = 0.0028409 k( 115) = ( 0.0000000 0.3541667 0.0000000), wk = 0.0028409 k( 116) = ( 0.0000000 0.3333333 0.0000000), wk = 0.0028409 k( 117) = ( 0.0000000 0.3125000 -0.0000000), wk = 0.0028409 k( 118) = ( 0.0000000 0.2916667 -0.0000000), wk = 0.0028409 k( 119) = ( 0.0000000 0.2708333 0.0000000), wk = 0.0028409 k( 120) = ( 0.0000000 0.2500000 -0.0000000), wk = 0.0028409 k( 121) = ( 0.0000000 0.2291667 0.0000000), wk = 0.0028409 k( 122) = ( 0.0000000 0.2083333 0.0000000), wk = 0.0028409 k( 123) = ( 0.0000000 0.1875000 0.0000000), wk = 0.0028409 k( 124) = ( 0.0000000 0.1666667 0.0000000), wk = 0.0028409 k( 125) = ( 0.0000000 0.1458333 0.0000000), wk = 0.0028409 k( 126) = ( 0.0000000 0.1250000 -0.0000000), wk = 0.0028409 k( 127) = ( 0.0000000 0.1041667 0.0000000), wk = 0.0028409 k( 128) = ( 0.0000000 0.0833333 -0.0000000), wk = 0.0028409 k( 129) = ( 0.0000000 0.0625000 -0.0000000), wk = 0.0028409 k( 130) = ( 0.0000000 0.0416667 0.0000000), wk = 0.0028409 k( 131) = ( 0.0000000 0.0208333 -0.0000000), wk = 0.0028409 k( 132) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0028409 k( 133) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0028409 k( 134) = ( 0.0000000 0.0000000 0.0238095), wk = 0.0028409 k( 135) = ( 0.0000000 0.0000000 0.0476191), wk = 0.0028409 k( 136) = ( 0.0000000 0.0000000 0.0714286), wk = 0.0028409 k( 137) = ( 0.0000000 0.0000000 0.0952381), wk = 0.0028409 k( 138) = ( 0.0000000 0.0000000 0.1190476), wk = 0.0028409 k( 139) = ( 0.0000000 0.0000000 0.1428571), wk = 0.0028409 k( 140) = ( 0.0000000 0.0000000 0.1666667), wk = 0.0028409 k( 141) = ( 0.0000000 0.0000000 0.1904762), wk = 0.0028409 k( 142) = ( 0.0000000 0.0000000 0.2142857), wk = 0.0028409 k( 143) = ( 0.0000000 0.0000000 0.2380952), wk = 0.0028409 k( 144) = ( 0.0000000 0.0000000 0.2619048), wk = 0.0028409 k( 145) = ( 0.0000000 0.0000000 0.2857143), wk = 0.0028409 k( 146) = ( 0.0000000 0.0000000 0.3095238), wk = 0.0028409 k( 147) = ( 0.0000000 0.0000000 0.3333333), wk = 0.0028409 k( 148) = ( 0.0000000 0.0000000 0.3571429), wk = 0.0028409 k( 149) = ( 0.0000000 0.0000000 0.3809524), wk = 0.0028409 k( 150) = ( 0.0000000 0.0000000 0.4047619), wk = 0.0028409 k( 151) = ( 0.0000000 0.0000000 0.4285714), wk = 0.0028409 k( 152) = ( 0.0000000 0.0000000 0.4523810), wk = 0.0028409 k( 153) = ( 0.0000000 0.0000000 0.4761905), wk = 0.0028409 k( 154) = ( 0.0000000 0.0000000 0.5000000), wk = 0.0028409 k( 155) = ( 0.0000000 0.0000000 0.5000000), wk = 0.0028409 k( 156) = ( 0.0125000 -0.0000000 0.5000000), wk = 0.0028409 k( 157) = ( 0.0250000 -0.0000000 0.5000000), wk = 0.0028409 k( 158) = ( 0.0375000 -0.0000000 0.5000000), wk = 0.0028409 k( 159) = ( 0.0500000 -0.0000000 0.5000000), wk = 0.0028409 k( 160) = ( 0.0625000 0.0000000 0.5000000), wk = 0.0028409 k( 161) = ( 0.0750000 -0.0000000 0.5000000), wk = 0.0028409 k( 162) = ( 0.0875000 0.0000000 0.5000000), wk = 0.0028409 k( 163) = ( 0.1000000 -0.0000000 0.5000000), wk = 0.0028409 k( 164) = ( 0.1125000 -0.0000000 0.5000000), wk = 0.0028409 k( 165) = ( 0.1250000 0.0000000 0.5000000), wk = 0.0028409 k( 166) = ( 0.1375000 -0.0000000 0.5000000), wk = 0.0028409 k( 167) = ( 0.1500000 -0.0000000 0.5000000), wk = 0.0028409 k( 168) = ( 0.1625000 -0.0000000 0.5000000), wk = 0.0028409 k( 169) = ( 0.1750000 0.0000000 0.5000000), wk = 0.0028409 k( 170) = ( 0.1875000 -0.0000000 0.5000000), wk = 0.0028409 k( 171) = ( 0.2000000 -0.0000000 0.5000000), wk = 0.0028409 k( 172) = ( 0.2125000 0.0000000 0.5000000), wk = 0.0028409 k( 173) = ( 0.2250000 -0.0000000 0.5000000), wk = 0.0028409 k( 174) = ( 0.2375000 -0.0000000 0.5000000), wk = 0.0028409 k( 175) = ( 0.2500000 0.0000000 0.5000000), wk = 0.0028409 k( 176) = ( 0.2625000 0.0000000 0.5000000), wk = 0.0028409 k( 177) = ( 0.2750000 -0.0000000 0.5000000), wk = 0.0028409 k( 178) = ( 0.2875000 0.0000000 0.5000000), wk = 0.0028409 k( 179) = ( 0.3000000 -0.0000000 0.5000000), wk = 0.0028409 k( 180) = ( 0.3125000 -0.0000000 0.5000000), wk = 0.0028409 k( 181) = ( 0.3250000 -0.0000000 0.5000000), wk = 0.0028409 k( 182) = ( 0.3375000 -0.0000000 0.5000000), wk = 0.0028409 k( 183) = ( 0.3500000 0.0000000 0.5000000), wk = 0.0028409 k( 184) = ( 0.3625000 -0.0000000 0.5000000), wk = 0.0028409 k( 185) = ( 0.3750000 -0.0000000 0.5000000), wk = 0.0028409 k( 186) = ( 0.3875000 -0.0000000 0.5000000), wk = 0.0028409 k( 187) = ( 0.4000000 -0.0000000 0.5000000), wk = 0.0028409 k( 188) = ( 0.4125000 -0.0000000 0.5000000), wk = 0.0028409 k( 189) = ( 0.4250000 0.0000000 0.5000000), wk = 0.0028409 k( 190) = ( 0.4375000 0.0000000 0.5000000), wk = 0.0028409 k( 191) = ( 0.4500000 -0.0000000 0.5000000), wk = 0.0028409 k( 192) = ( 0.4625000 0.0000000 0.5000000), wk = 0.0028409 k( 193) = ( 0.4750000 -0.0000000 0.5000000), wk = 0.0028409 k( 194) = ( 0.4875000 -0.0000000 0.5000000), wk = 0.0028409 k( 195) = ( 0.5000000 0.0000000 0.5000000), wk = 0.0028409 k( 196) = ( 0.5000000 0.0000000 0.5000000), wk = 0.0028409 k( 197) = ( 0.5000000 0.0208333 0.5000000), wk = 0.0028409 k( 198) = ( 0.5000000 0.0416667 0.5000000), wk = 0.0028409 k( 199) = ( 0.5000000 0.0625000 0.5000000), wk = 0.0028409 k( 200) = ( 0.5000000 0.0833333 0.5000000), wk = 0.0028409 k( 201) = ( 0.5000000 0.1041667 0.5000000), wk = 0.0028409 k( 202) = ( 0.5000000 0.1250000 0.5000000), wk = 0.0028409 k( 203) = ( 0.5000000 0.1458333 0.5000000), wk = 0.0028409 k( 204) = ( 0.5000000 0.1666667 0.5000000), wk = 0.0028409 k( 205) = ( 0.5000000 0.1875000 0.5000000), wk = 0.0028409 k( 206) = ( 0.5000000 0.2083333 0.5000000), wk = 0.0028409 k( 207) = ( 0.5000000 0.2291667 0.5000000), wk = 0.0028409 k( 208) = ( 0.5000000 0.2500000 0.5000000), wk = 0.0028409 k( 209) = ( 0.5000000 0.2708333 0.5000000), wk = 0.0028409 k( 210) = ( 0.5000000 0.2916667 0.5000000), wk = 0.0028409 k( 211) = ( 0.5000000 0.3125000 0.5000000), wk = 0.0028409 k( 212) = ( 0.5000000 0.3333333 0.5000000), wk = 0.0028409 k( 213) = ( 0.5000000 0.3541667 0.5000000), wk = 0.0028409 k( 214) = ( 0.5000000 0.3750000 0.5000000), wk = 0.0028409 k( 215) = ( 0.5000000 0.3958333 0.5000000), wk = 0.0028409 k( 216) = ( 0.5000000 0.4166667 0.5000000), wk = 0.0028409 k( 217) = ( 0.5000000 0.4375000 0.5000000), wk = 0.0028409 k( 218) = ( 0.5000000 0.4583333 0.5000000), wk = 0.0028409 k( 219) = ( 0.5000000 0.4791667 0.5000000), wk = 0.0028409 k( 220) = ( 0.5000000 0.5000000 0.5000000), wk = 0.0028409 k( 221) = ( 0.5000000 0.5000000 0.5000000), wk = 0.0028409 k( 222) = ( 0.4875000 0.5000000 0.5000000), wk = 0.0028409 k( 223) = ( 0.4750000 0.5000000 0.5000000), wk = 0.0028409 k( 224) = ( 0.4625000 0.5000000 0.5000000), wk = 0.0028409 k( 225) = ( 0.4500000 0.5000000 0.5000000), wk = 0.0028409 k( 226) = ( 0.4375000 0.5000000 0.5000000), wk = 0.0028409 k( 227) = ( 0.4250000 0.5000000 0.5000000), wk = 0.0028409 k( 228) = ( 0.4125000 0.5000000 0.5000000), wk = 0.0028409 k( 229) = ( 0.4000000 0.5000000 0.5000000), wk = 0.0028409 k( 230) = ( 0.3875000 0.5000000 0.5000000), wk = 0.0028409 k( 231) = ( 0.3750000 0.5000000 0.5000000), wk = 0.0028409 k( 232) = ( 0.3625000 0.5000000 0.5000000), wk = 0.0028409 k( 233) = ( 0.3500000 0.5000000 0.5000000), wk = 0.0028409 k( 234) = ( 0.3375000 0.5000000 0.5000000), wk = 0.0028409 k( 235) = ( 0.3250000 0.5000000 0.5000000), wk = 0.0028409 k( 236) = ( 0.3125000 0.5000000 0.5000000), wk = 0.0028409 k( 237) = ( 0.3000000 0.5000000 0.5000000), wk = 0.0028409 k( 238) = ( 0.2875000 0.5000000 0.5000000), wk = 0.0028409 k( 239) = ( 0.2750000 0.5000000 0.5000000), wk = 0.0028409 k( 240) = ( 0.2625000 0.5000000 0.5000000), wk = 0.0028409 k( 241) = ( 0.2500000 0.5000000 0.5000000), wk = 0.0028409 k( 242) = ( 0.2375000 0.5000000 0.5000000), wk = 0.0028409 k( 243) = ( 0.2250000 0.5000000 0.5000000), wk = 0.0028409 k( 244) = ( 0.2125000 0.5000000 0.5000000), wk = 0.0028409 k( 245) = ( 0.2000000 0.5000000 0.5000000), wk = 0.0028409 k( 246) = ( 0.1875000 0.5000000 0.5000000), wk = 0.0028409 k( 247) = ( 0.1750000 0.5000000 0.5000000), wk = 0.0028409 k( 248) = ( 0.1625000 0.5000000 0.5000000), wk = 0.0028409 k( 249) = ( 0.1500000 0.5000000 0.5000000), wk = 0.0028409 k( 250) = ( 0.1375000 0.5000000 0.5000000), wk = 0.0028409 k( 251) = ( 0.1250000 0.5000000 0.5000000), wk = 0.0028409 k( 252) = ( 0.1125000 0.5000000 0.5000000), wk = 0.0028409 k( 253) = ( 0.1000000 0.5000000 0.5000000), wk = 0.0028409 k( 254) = ( 0.0875000 0.5000000 0.5000000), wk = 0.0028409 k( 255) = ( 0.0750000 0.5000000 0.5000000), wk = 0.0028409 k( 256) = ( 0.0625000 0.5000000 0.5000000), wk = 0.0028409 k( 257) = ( 0.0500000 0.5000000 0.5000000), wk = 0.0028409 k( 258) = ( 0.0375000 0.5000000 0.5000000), wk = 0.0028409 k( 259) = ( 0.0250000 0.5000000 0.5000000), wk = 0.0028409 k( 260) = ( 0.0125000 0.5000000 0.5000000), wk = 0.0028409 k( 261) = ( 0.0000000 0.5000000 0.5000000), wk = 0.0028409 k( 262) = ( 0.0000000 0.5000000 0.5000000), wk = 0.0028409 k( 263) = ( 0.0000000 0.4791667 0.5000000), wk = 0.0028409 k( 264) = ( 0.0000000 0.4583333 0.5000000), wk = 0.0028409 k( 265) = ( 0.0000000 0.4375000 0.5000000), wk = 0.0028409 k( 266) = ( 0.0000000 0.4166667 0.5000000), wk = 0.0028409 k( 267) = ( 0.0000000 0.3958333 0.5000000), wk = 0.0028409 k( 268) = ( 0.0000000 0.3750000 0.5000000), wk = 0.0028409 k( 269) = ( 0.0000000 0.3541667 0.5000000), wk = 0.0028409 k( 270) = ( 0.0000000 0.3333333 0.5000000), wk = 0.0028409 k( 271) = ( 0.0000000 0.3125000 0.5000000), wk = 0.0028409 k( 272) = ( 0.0000000 0.2916667 0.5000000), wk = 0.0028409 k( 273) = ( 0.0000000 0.2708333 0.5000000), wk = 0.0028409 k( 274) = ( 0.0000000 0.2500000 0.5000000), wk = 0.0028409 k( 275) = ( 0.0000000 0.2291667 0.5000000), wk = 0.0028409 k( 276) = ( 0.0000000 0.2083333 0.5000000), wk = 0.0028409 k( 277) = ( 0.0000000 0.1875000 0.5000000), wk = 0.0028409 k( 278) = ( 0.0000000 0.1666667 0.5000000), wk = 0.0028409 k( 279) = ( 0.0000000 0.1458333 0.5000000), wk = 0.0028409 k( 280) = ( 0.0000000 0.1250000 0.5000000), wk = 0.0028409 k( 281) = ( 0.0000000 0.1041667 0.5000000), wk = 0.0028409 k( 282) = ( 0.0000000 0.0833333 0.5000000), wk = 0.0028409 k( 283) = ( 0.0000000 0.0625000 0.5000000), wk = 0.0028409 k( 284) = ( 0.0000000 0.0416667 0.5000000), wk = 0.0028409 k( 285) = ( 0.0000000 0.0208333 0.5000000), wk = 0.0028409 k( 286) = ( 0.0000000 0.0000000 0.5000000), wk = 0.0028409 k( 287) = ( 0.0000000 0.5000000 -0.0000000), wk = 0.0028409 k( 288) = ( 0.0000000 0.5000000 0.0238095), wk = 0.0028409 k( 289) = ( 0.0000000 0.5000000 0.0476191), wk = 0.0028409 k( 290) = ( 0.0000000 0.5000000 0.0714286), wk = 0.0028409 k( 291) = ( 0.0000000 0.5000000 0.0952381), wk = 0.0028409 k( 292) = ( 0.0000000 0.5000000 0.1190476), wk = 0.0028409 k( 293) = ( 0.0000000 0.5000000 0.1428571), wk = 0.0028409 k( 294) = ( 0.0000000 0.5000000 0.1666667), wk = 0.0028409 k( 295) = ( 0.0000000 0.5000000 0.1904762), wk = 0.0028409 k( 296) = ( 0.0000000 0.5000000 0.2142857), wk = 0.0028409 k( 297) = ( 0.0000000 0.5000000 0.2380952), wk = 0.0028409 k( 298) = ( 0.0000000 0.5000000 0.2619048), wk = 0.0028409 k( 299) = ( 0.0000000 0.5000000 0.2857143), wk = 0.0028409 k( 300) = ( 0.0000000 0.5000000 0.3095238), wk = 0.0028409 k( 301) = ( 0.0000000 0.5000000 0.3333333), wk = 0.0028409 k( 302) = ( 0.0000000 0.5000000 0.3571429), wk = 0.0028409 k( 303) = ( 0.0000000 0.5000000 0.3809524), wk = 0.0028409 k( 304) = ( 0.0000000 0.5000000 0.4047619), wk = 0.0028409 k( 305) = ( 0.0000000 0.5000000 0.4285714), wk = 0.0028409 k( 306) = ( 0.0000000 0.5000000 0.4523810), wk = 0.0028409 k( 307) = ( 0.0000000 0.5000000 0.4761905), wk = 0.0028409 k( 308) = ( 0.0000000 0.5000000 0.5000000), wk = 0.0028409 k( 309) = ( 0.5000000 0.0000000 0.5000000), wk = 0.0028409 k( 310) = ( 0.5000000 0.0000000 0.4761905), wk = 0.0028409 k( 311) = ( 0.5000000 0.0000000 0.4523810), wk = 0.0028409 k( 312) = ( 0.5000000 0.0000000 0.4285714), wk = 0.0028409 k( 313) = ( 0.5000000 0.0000000 0.4047619), wk = 0.0028409 k( 314) = ( 0.5000000 0.0000000 0.3809524), wk = 0.0028409 k( 315) = ( 0.5000000 0.0000000 0.3571429), wk = 0.0028409 k( 316) = ( 0.5000000 0.0000000 0.3333333), wk = 0.0028409 k( 317) = ( 0.5000000 0.0000000 0.3095238), wk = 0.0028409 k( 318) = ( 0.5000000 0.0000000 0.2857143), wk = 0.0028409 k( 319) = ( 0.5000000 0.0000000 0.2619048), wk = 0.0028409 k( 320) = ( 0.5000000 0.0000000 0.2380952), wk = 0.0028409 k( 321) = ( 0.5000000 0.0000000 0.2142857), wk = 0.0028409 k( 322) = ( 0.5000000 0.0000000 0.1904762), wk = 0.0028409 k( 323) = ( 0.5000000 0.0000000 0.1666667), wk = 0.0028409 k( 324) = ( 0.5000000 0.0000000 0.1428571), wk = 0.0028409 k( 325) = ( 0.5000000 0.0000000 0.1190476), wk = 0.0028409 k( 326) = ( 0.5000000 0.0000000 0.0952381), wk = 0.0028409 k( 327) = ( 0.5000000 0.0000000 0.0714286), wk = 0.0028409 k( 328) = ( 0.5000000 0.0000000 0.0476191), wk = 0.0028409 k( 329) = ( 0.5000000 0.0000000 0.0238095), wk = 0.0028409 k( 330) = ( 0.5000000 0.0000000 -0.0000000), wk = 0.0028409 k( 331) = ( 0.5000000 0.5000000 -0.0000000), wk = 0.0028409 k( 332) = ( 0.5000000 0.5000000 0.0238095), wk = 0.0028409 k( 333) = ( 0.5000000 0.5000000 0.0476191), wk = 0.0028409 k( 334) = ( 0.5000000 0.5000000 0.0714286), wk = 0.0028409 k( 335) = ( 0.5000000 0.5000000 0.0952381), wk = 0.0028409 k( 336) = ( 0.5000000 0.5000000 0.1190476), wk = 0.0028409 k( 337) = ( 0.5000000 0.5000000 0.1428571), wk = 0.0028409 k( 338) = ( 0.5000000 0.5000000 0.1666667), wk = 0.0028409 k( 339) = ( 0.5000000 0.5000000 0.1904762), wk = 0.0028409 k( 340) = ( 0.5000000 0.5000000 0.2142857), wk = 0.0028409 k( 341) = ( 0.5000000 0.5000000 0.2380952), wk = 0.0028409 k( 342) = ( 0.5000000 0.5000000 0.2619048), wk = 0.0028409 k( 343) = ( 0.5000000 0.5000000 0.2857143), wk = 0.0028409 k( 344) = ( 0.5000000 0.5000000 0.3095238), wk = 0.0028409 k( 345) = ( 0.5000000 0.5000000 0.3333333), wk = 0.0028409 k( 346) = ( 0.5000000 0.5000000 0.3571429), wk = 0.0028409 k( 347) = ( 0.5000000 0.5000000 0.3809524), wk = 0.0028409 k( 348) = ( 0.5000000 0.5000000 0.4047619), wk = 0.0028409 k( 349) = ( 0.5000000 0.5000000 0.4285714), wk = 0.0028409 k( 350) = ( 0.5000000 0.5000000 0.4523810), wk = 0.0028409 k( 351) = ( 0.5000000 0.5000000 0.4761905), wk = 0.0028409 k( 352) = ( 0.5000000 0.5000000 0.5000000), wk = 0.0028409 Dense grid: 208257 G-vectors FFT dimensions: ( 50, 90, 96) Smooth grid: 65341 G-vectors FFT dimensions: ( 36, 60, 72) Largest allocated arrays est. size (Mb) dimensions Kohn-Sham Wavefunctions 0.31 Mb ( 240, 86) NL pseudopotentials 0.47 Mb ( 120, 256) Each V/rho on FFT grid 0.14 Mb ( 9000) Each G-vector array 0.02 Mb ( 2893) G-vector shells 0.01 Mb ( 1469) Largest temporary arrays est. size (Mb) dimensions Auxiliary wavefunctions 1.26 Mb ( 240, 344) Each subspace H/S matrix 0.05 Mb ( 57, 57) Each matrix 0.67 Mb ( 256, 2, 86) The potential is recalculated from file : ./ZrGePt.save/charge-density.dat Starting wfc are 176 randomized atomic wfcs Band Structure Calculation Davidson diagonalization with overlap Computing kpt #: 1 total cpu time spent up to now is 4.0 secs Computing kpt #: 2 total cpu time spent up to now is 6.0 secs Computing kpt #: 3 total cpu time spent up to now is 8.0 secs Computing kpt #: 4 total cpu time spent up to now is 10.1 secs Computing kpt #: 5 total cpu time spent up to now is 12.2 secs Computing kpt #: 6 total cpu time spent up to now is 14.2 secs Computing kpt #: 7 total cpu time spent up to now is 16.2 secs Computing kpt #: 8 total cpu time spent up to now is 18.3 secs Computing kpt #: 9 total cpu time spent up to now is 20.7 secs Computing kpt #: 10 total cpu time spent up to now is 22.9 secs Computing kpt #: 11 total cpu time spent up to now is 25.1 secs Computing kpt #: 12 total cpu time spent up to now is 27.6 secs Computing kpt #: 13 total cpu time spent up to now is 30.2 secs Computing kpt #: 14 total cpu time spent up to now is 32.8 secs Computing kpt #: 15 total cpu time spent up to now is 36.1 secs Computing kpt #: 16 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 40.8 secs Computing kpt #: 17 total cpu time spent up to now is 45.2 secs Computing kpt #: 18 total cpu time spent up to now is 48.3 secs Computing kpt #: 19 total cpu time spent up to now is 51.5 secs Computing kpt #: 20 total cpu time spent up to now is 54.3 secs Computing kpt #: 21 total cpu time spent up to now is 57.1 secs Computing kpt #: 22 total cpu time spent up to now is 60.0 secs Computing kpt #: 23 total cpu time spent up to now is 62.8 secs Computing kpt #: 24 total cpu time spent up to now is 66.0 secs Computing kpt #: 25 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 70.6 secs Computing kpt #: 26 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 75.2 secs Computing kpt #: 27 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 79.7 secs Computing kpt #: 28 total cpu time spent up to now is 83.4 secs Computing kpt #: 29 total cpu time spent up to now is 86.3 secs Computing kpt #: 30 total cpu time spent up to now is 89.1 secs Computing kpt #: 31 total cpu time spent up to now is 91.8 secs Computing kpt #: 32 total cpu time spent up to now is 94.6 secs Computing kpt #: 33 total cpu time spent up to now is 97.3 secs Computing kpt #: 34 total cpu time spent up to now is 100.0 secs Computing kpt #: 35 total cpu time spent up to now is 102.7 secs Computing kpt #: 36 total cpu time spent up to now is 105.4 secs Computing kpt #: 37 total cpu time spent up to now is 108.2 secs Computing kpt #: 38 total cpu time spent up to now is 111.0 secs Computing kpt #: 39 total cpu time spent up to now is 113.9 secs Computing kpt #: 40 total cpu time spent up to now is 117.1 secs Computing kpt #: 41 total cpu time spent up to now is 119.7 secs Computing kpt #: 42 total cpu time spent up to now is 122.4 secs Computing kpt #: 43 total cpu time spent up to now is 125.0 secs Computing kpt #: 44 total cpu time spent up to now is 127.7 secs Computing kpt #: 45 total cpu time spent up to now is 130.5 secs Computing kpt #: 46 total cpu time spent up to now is 133.3 secs Computing kpt #: 47 total cpu time spent up to now is 136.2 secs Computing kpt #: 48 total cpu time spent up to now is 139.7 secs Computing kpt #: 49 total cpu time spent up to now is 143.6 secs Computing kpt #: 50 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 148.2 secs Computing kpt #: 51 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 152.9 secs Computing kpt #: 52 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 157.4 secs Computing kpt #: 53 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 161.9 secs Computing kpt #: 54 total cpu time spent up to now is 165.7 secs Computing kpt #: 55 total cpu time spent up to now is 168.5 secs Computing kpt #: 56 total cpu time spent up to now is 171.4 secs Computing kpt #: 57 total cpu time spent up to now is 174.1 secs Computing kpt #: 58 total cpu time spent up to now is 176.8 secs Computing kpt #: 59 total cpu time spent up to now is 179.5 secs Computing kpt #: 60 total cpu time spent up to now is 182.2 secs Computing kpt #: 61 total cpu time spent up to now is 185.1 secs Computing kpt #: 62 total cpu time spent up to now is 187.9 secs Computing kpt #: 63 total cpu time spent up to now is 191.0 secs Computing kpt #: 64 total cpu time spent up to now is 194.7 secs Computing kpt #: 65 total cpu time spent up to now is 198.5 secs Computing kpt #: 66 total cpu time spent up to now is 202.3 secs Computing kpt #: 67 total cpu time spent up to now is 206.2 secs Computing kpt #: 68 total cpu time spent up to now is 210.3 secs Computing kpt #: 69 total cpu time spent up to now is 213.2 secs Computing kpt #: 70 total cpu time spent up to now is 217.1 secs Computing kpt #: 71 total cpu time spent up to now is 220.9 secs Computing kpt #: 72 total cpu time spent up to now is 224.7 secs Computing kpt #: 73 total cpu time spent up to now is 228.8 secs Computing kpt #: 74 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 233.2 secs Computing kpt #: 75 total cpu time spent up to now is 236.9 secs Computing kpt #: 76 total cpu time spent up to now is 241.1 secs Computing kpt #: 77 total cpu time spent up to now is 245.1 secs Computing kpt #: 78 total cpu time spent up to now is 248.8 secs Computing kpt #: 79 total cpu time spent up to now is 252.9 secs Computing kpt #: 80 total cpu time spent up to now is 256.5 secs Computing kpt #: 81 total cpu time spent up to now is 260.2 secs Computing kpt #: 82 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 264.6 secs Computing kpt #: 83 total cpu time spent up to now is 268.3 secs Computing kpt #: 84 total cpu time spent up to now is 272.5 secs Computing kpt #: 85 total cpu time spent up to now is 276.6 secs Computing kpt #: 86 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 281.0 secs Computing kpt #: 87 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 285.4 secs Computing kpt #: 88 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 289.8 secs Computing kpt #: 89 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 294.1 secs Computing kpt #: 90 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 298.6 secs Computing kpt #: 91 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 303.0 secs Computing kpt #: 92 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 307.4 secs Computing kpt #: 93 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 311.8 secs Computing kpt #: 94 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 316.2 secs Computing kpt #: 95 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 320.8 secs Computing kpt #: 96 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 325.3 secs Computing kpt #: 97 total cpu time spent up to now is 329.5 secs Computing kpt #: 98 total cpu time spent up to now is 333.6 secs Computing kpt #: 99 total cpu time spent up to now is 336.8 secs Computing kpt #: 100 total cpu time spent up to now is 340.1 secs Computing kpt #: 101 total cpu time spent up to now is 343.7 secs Computing kpt #: 102 total cpu time spent up to now is 347.0 secs Computing kpt #: 103 total cpu time spent up to now is 350.7 secs Computing kpt #: 104 total cpu time spent up to now is 354.5 secs Computing kpt #: 105 total cpu time spent up to now is 358.2 secs Computing kpt #: 106 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 362.7 secs Computing kpt #: 107 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 367.1 secs Computing kpt #: 108 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 371.6 secs Computing kpt #: 109 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 376.1 secs Computing kpt #: 110 total cpu time spent up to now is 379.4 secs Computing kpt #: 111 total cpu time spent up to now is 382.1 secs Computing kpt #: 112 total cpu time spent up to now is 384.9 secs Computing kpt #: 113 total cpu time spent up to now is 387.7 secs Computing kpt #: 114 total cpu time spent up to now is 390.4 secs Computing kpt #: 115 total cpu time spent up to now is 393.0 secs Computing kpt #: 116 total cpu time spent up to now is 395.6 secs Computing kpt #: 117 total cpu time spent up to now is 398.2 secs Computing kpt #: 118 total cpu time spent up to now is 401.0 secs Computing kpt #: 119 total cpu time spent up to now is 404.2 secs Computing kpt #: 120 total cpu time spent up to now is 407.5 secs Computing kpt #: 121 total cpu time spent up to now is 410.8 secs Computing kpt #: 122 total cpu time spent up to now is 413.7 secs Computing kpt #: 123 total cpu time spent up to now is 416.9 secs Computing kpt #: 124 total cpu time spent up to now is 419.7 secs Computing kpt #: 125 total cpu time spent up to now is 422.4 secs Computing kpt #: 126 total cpu time spent up to now is 424.9 secs Computing kpt #: 127 total cpu time spent up to now is 427.2 secs Computing kpt #: 128 total cpu time spent up to now is 429.4 secs Computing kpt #: 129 total cpu time spent up to now is 431.6 secs Computing kpt #: 130 total cpu time spent up to now is 433.6 secs Computing kpt #: 131 total cpu time spent up to now is 435.7 secs Computing kpt #: 132 total cpu time spent up to now is 437.7 secs Computing kpt #: 133 total cpu time spent up to now is 439.7 secs Computing kpt #: 134 total cpu time spent up to now is 441.7 secs Computing kpt #: 135 total cpu time spent up to now is 443.7 secs Computing kpt #: 136 total cpu time spent up to now is 445.8 secs Computing kpt #: 137 total cpu time spent up to now is 447.9 secs Computing kpt #: 138 total cpu time spent up to now is 449.9 secs Computing kpt #: 139 total cpu time spent up to now is 452.0 secs Computing kpt #: 140 total cpu time spent up to now is 454.1 secs Computing kpt #: 141 total cpu time spent up to now is 456.2 secs Computing kpt #: 142 total cpu time spent up to now is 458.4 secs Computing kpt #: 143 total cpu time spent up to now is 460.5 secs Computing kpt #: 144 total cpu time spent up to now is 462.9 secs Computing kpt #: 145 total cpu time spent up to now is 465.5 secs Computing kpt #: 146 total cpu time spent up to now is 468.2 secs Computing kpt #: 147 total cpu time spent up to now is 471.8 secs Computing kpt #: 148 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 476.4 secs Computing kpt #: 149 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 480.9 secs Computing kpt #: 150 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 485.5 secs Computing kpt #: 151 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 490.1 secs Computing kpt #: 152 total cpu time spent up to now is 494.3 secs Computing kpt #: 153 total cpu time spent up to now is 498.2 secs Computing kpt #: 154 total cpu time spent up to now is 501.3 secs Computing kpt #: 155 total cpu time spent up to now is 504.1 secs Computing kpt #: 156 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 508.6 secs Computing kpt #: 157 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 513.2 secs Computing kpt #: 158 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 517.9 secs Computing kpt #: 159 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 522.6 secs Computing kpt #: 160 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 527.3 secs Computing kpt #: 161 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 532.0 secs Computing kpt #: 162 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 536.6 secs Computing kpt #: 163 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 541.2 secs Computing kpt #: 164 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 545.7 secs Computing kpt #: 165 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 550.3 secs Computing kpt #: 166 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 554.9 secs Computing kpt #: 167 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 559.5 secs Computing kpt #: 168 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 564.2 secs Computing kpt #: 169 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 568.8 secs Computing kpt #: 170 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 573.5 secs Computing kpt #: 171 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 578.1 secs Computing kpt #: 172 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 582.8 secs Computing kpt #: 173 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 587.4 secs Computing kpt #: 174 total cpu time spent up to now is 591.8 secs Computing kpt #: 175 total cpu time spent up to now is 595.8 secs Computing kpt #: 176 total cpu time spent up to now is 600.1 secs Computing kpt #: 177 total cpu time spent up to now is 604.0 secs Computing kpt #: 178 total cpu time spent up to now is 607.7 secs Computing kpt #: 179 total cpu time spent up to now is 611.1 secs Computing kpt #: 180 total cpu time spent up to now is 615.0 secs Computing kpt #: 181 total cpu time spent up to now is 617.9 secs Computing kpt #: 182 total cpu time spent up to now is 621.5 secs Computing kpt #: 183 total cpu time spent up to now is 625.2 secs Computing kpt #: 184 total cpu time spent up to now is 629.1 secs Computing kpt #: 185 total cpu time spent up to now is 633.3 secs Computing kpt #: 186 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 637.8 secs Computing kpt #: 187 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 642.7 secs Computing kpt #: 188 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 647.2 secs Computing kpt #: 189 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 651.8 secs Computing kpt #: 190 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 656.4 secs Computing kpt #: 191 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 661.0 secs Computing kpt #: 192 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 665.6 secs Computing kpt #: 193 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 670.2 secs Computing kpt #: 194 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 674.7 secs Computing kpt #: 195 total cpu time spent up to now is 678.6 secs Computing kpt #: 196 total cpu time spent up to now is 682.4 secs Computing kpt #: 197 total cpu time spent up to now is 686.3 secs Computing kpt #: 198 total cpu time spent up to now is 689.7 secs Computing kpt #: 199 total cpu time spent up to now is 693.0 secs Computing kpt #: 200 total cpu time spent up to now is 696.1 secs Computing kpt #: 201 total cpu time spent up to now is 699.1 secs Computing kpt #: 202 total cpu time spent up to now is 701.9 secs Computing kpt #: 203 total cpu time spent up to now is 704.7 secs Computing kpt #: 204 total cpu time spent up to now is 707.4 secs Computing kpt #: 205 total cpu time spent up to now is 710.1 secs Computing kpt #: 206 total cpu time spent up to now is 713.0 secs Computing kpt #: 207 total cpu time spent up to now is 715.8 secs Computing kpt #: 208 total cpu time spent up to now is 718.6 secs Computing kpt #: 209 total cpu time spent up to now is 721.4 secs Computing kpt #: 210 total cpu time spent up to now is 724.5 secs Computing kpt #: 211 total cpu time spent up to now is 727.5 secs Computing kpt #: 212 total cpu time spent up to now is 730.6 secs Computing kpt #: 213 total cpu time spent up to now is 734.2 secs Computing kpt #: 214 total cpu time spent up to now is 738.0 secs Computing kpt #: 215 total cpu time spent up to now is 741.8 secs Computing kpt #: 216 total cpu time spent up to now is 745.8 secs Computing kpt #: 217 total cpu time spent up to now is 750.0 secs Computing kpt #: 218 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 754.5 secs Computing kpt #: 219 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 759.0 secs Computing kpt #: 220 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 763.5 secs Computing kpt #: 221 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 768.1 secs Computing kpt #: 222 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 772.6 secs Computing kpt #: 223 total cpu time spent up to now is 776.4 secs Computing kpt #: 224 total cpu time spent up to now is 779.6 secs Computing kpt #: 225 total cpu time spent up to now is 782.4 secs Computing kpt #: 226 total cpu time spent up to now is 785.2 secs Computing kpt #: 227 total cpu time spent up to now is 787.9 secs Computing kpt #: 228 total cpu time spent up to now is 790.6 secs Computing kpt #: 229 total cpu time spent up to now is 793.3 secs Computing kpt #: 230 total cpu time spent up to now is 796.0 secs Computing kpt #: 231 total cpu time spent up to now is 798.7 secs Computing kpt #: 232 total cpu time spent up to now is 801.5 secs Computing kpt #: 233 total cpu time spent up to now is 804.6 secs Computing kpt #: 234 total cpu time spent up to now is 808.3 secs Computing kpt #: 235 total cpu time spent up to now is 812.5 secs Computing kpt #: 236 total cpu time spent up to now is 816.7 secs Computing kpt #: 237 total cpu time spent up to now is 820.4 secs Computing kpt #: 238 total cpu time spent up to now is 823.6 secs Computing kpt #: 239 total cpu time spent up to now is 826.4 secs Computing kpt #: 240 total cpu time spent up to now is 829.0 secs Computing kpt #: 241 total cpu time spent up to now is 831.3 secs Computing kpt #: 242 total cpu time spent up to now is 833.5 secs Computing kpt #: 243 total cpu time spent up to now is 835.6 secs Computing kpt #: 244 total cpu time spent up to now is 837.7 secs Computing kpt #: 245 total cpu time spent up to now is 839.9 secs Computing kpt #: 246 total cpu time spent up to now is 842.1 secs Computing kpt #: 247 total cpu time spent up to now is 844.4 secs Computing kpt #: 248 total cpu time spent up to now is 846.7 secs Computing kpt #: 249 total cpu time spent up to now is 849.5 secs Computing kpt #: 250 total cpu time spent up to now is 852.6 secs Computing kpt #: 251 total cpu time spent up to now is 855.7 secs Computing kpt #: 252 total cpu time spent up to now is 859.0 secs Computing kpt #: 253 total cpu time spent up to now is 862.1 secs Computing kpt #: 254 total cpu time spent up to now is 865.2 secs Computing kpt #: 255 total cpu time spent up to now is 868.0 secs Computing kpt #: 256 total cpu time spent up to now is 870.5 secs Computing kpt #: 257 total cpu time spent up to now is 872.8 secs Computing kpt #: 258 total cpu time spent up to now is 875.0 secs Computing kpt #: 259 total cpu time spent up to now is 877.6 secs Computing kpt #: 260 total cpu time spent up to now is 880.7 secs Computing kpt #: 261 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 885.2 secs Computing kpt #: 262 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 889.8 secs Computing kpt #: 263 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 894.3 secs Computing kpt #: 264 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 898.8 secs Computing kpt #: 265 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 903.2 secs Computing kpt #: 266 total cpu time spent up to now is 906.6 secs Computing kpt #: 267 total cpu time spent up to now is 909.7 secs Computing kpt #: 268 total cpu time spent up to now is 912.3 secs Computing kpt #: 269 total cpu time spent up to now is 914.8 secs Computing kpt #: 270 total cpu time spent up to now is 917.2 secs Computing kpt #: 271 total cpu time spent up to now is 919.5 secs Computing kpt #: 272 total cpu time spent up to now is 922.2 secs Computing kpt #: 273 total cpu time spent up to now is 924.4 secs Computing kpt #: 274 total cpu time spent up to now is 926.7 secs Computing kpt #: 275 total cpu time spent up to now is 929.1 secs Computing kpt #: 276 total cpu time spent up to now is 931.3 secs Computing kpt #: 277 total cpu time spent up to now is 933.9 secs Computing kpt #: 278 total cpu time spent up to now is 936.4 secs Computing kpt #: 279 total cpu time spent up to now is 939.0 secs Computing kpt #: 280 total cpu time spent up to now is 941.9 secs Computing kpt #: 281 total cpu time spent up to now is 944.6 secs Computing kpt #: 282 total cpu time spent up to now is 947.2 secs Computing kpt #: 283 total cpu time spent up to now is 949.9 secs Computing kpt #: 284 total cpu time spent up to now is 952.8 secs Computing kpt #: 285 total cpu time spent up to now is 955.7 secs Computing kpt #: 286 total cpu time spent up to now is 958.6 secs Computing kpt #: 287 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 963.1 secs Computing kpt #: 288 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 967.6 secs Computing kpt #: 289 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 972.1 secs Computing kpt #: 290 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 976.6 secs Computing kpt #: 291 total cpu time spent up to now is 981.0 secs Computing kpt #: 292 total cpu time spent up to now is 985.2 secs Computing kpt #: 293 total cpu time spent up to now is 989.1 secs Computing kpt #: 294 total cpu time spent up to now is 992.9 secs Computing kpt #: 295 total cpu time spent up to now is 996.7 secs Computing kpt #: 296 total cpu time spent up to now is 1000.6 secs Computing kpt #: 297 total cpu time spent up to now is 1004.4 secs Computing kpt #: 298 total cpu time spent up to now is 1008.2 secs Computing kpt #: 299 total cpu time spent up to now is 1012.0 secs Computing kpt #: 300 total cpu time spent up to now is 1015.9 secs Computing kpt #: 301 total cpu time spent up to now is 1019.8 secs Computing kpt #: 302 total cpu time spent up to now is 1024.1 secs Computing kpt #: 303 total cpu time spent up to now is 1028.6 secs Computing kpt #: 304 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 1033.1 secs Computing kpt #: 305 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 1037.6 secs Computing kpt #: 306 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 1042.1 secs Computing kpt #: 307 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 1046.6 secs Computing kpt #: 308 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 1051.1 secs Computing kpt #: 309 total cpu time spent up to now is 1055.0 secs Computing kpt #: 310 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 1059.5 secs Computing kpt #: 311 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 1064.1 secs Computing kpt #: 312 total cpu time spent up to now is 1068.3 secs Computing kpt #: 313 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 1072.8 secs Computing kpt #: 314 total cpu time spent up to now is 1076.5 secs Computing kpt #: 315 total cpu time spent up to now is 1080.0 secs Computing kpt #: 316 total cpu time spent up to now is 1084.2 secs Computing kpt #: 317 total cpu time spent up to now is 1087.2 secs Computing kpt #: 318 total cpu time spent up to now is 1090.5 secs Computing kpt #: 319 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 1095.1 secs Computing kpt #: 320 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 1099.8 secs Computing kpt #: 321 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 1104.4 secs Computing kpt #: 322 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 1109.1 secs Computing kpt #: 323 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 1113.7 secs Computing kpt #: 324 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 1118.4 secs Computing kpt #: 325 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 1123.0 secs Computing kpt #: 326 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 1127.7 secs Computing kpt #: 327 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 1132.4 secs Computing kpt #: 328 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 1137.0 secs Computing kpt #: 329 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 1141.7 secs Computing kpt #: 330 total cpu time spent up to now is 1144.4 secs Computing kpt #: 331 total cpu time spent up to now is 1148.6 secs Computing kpt #: 332 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 1153.4 secs Computing kpt #: 333 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 1158.2 secs Computing kpt #: 334 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 1163.0 secs Computing kpt #: 335 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 1167.8 secs Computing kpt #: 336 total cpu time spent up to now is 1171.9 secs Computing kpt #: 337 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 1176.7 secs Computing kpt #: 338 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 1181.5 secs Computing kpt #: 339 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 1186.3 secs Computing kpt #: 340 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 1191.1 secs Computing kpt #: 341 total cpu time spent up to now is 1195.2 secs Computing kpt #: 342 total cpu time spent up to now is 1199.6 secs Computing kpt #: 343 total cpu time spent up to now is 1203.9 secs Computing kpt #: 344 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 1208.6 secs Computing kpt #: 345 total cpu time spent up to now is 1212.8 secs Computing kpt #: 346 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 1217.7 secs Computing kpt #: 347 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 1222.7 secs Computing kpt #: 348 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 1227.5 secs Computing kpt #: 349 c_bands: 3 eigenvalues not converged total cpu time spent up to now is 1232.4 secs Computing kpt #: 350 c_bands: 4 eigenvalues not converged total cpu time spent up to now is 1237.4 secs Computing kpt #: 351 c_bands: 5 eigenvalues not converged total cpu time spent up to now is 1242.6 secs Computing kpt #: 352 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 1247.2 secs ethr = 1.39E-08, avg # of iterations = 79.6 total cpu time spent up to now is 1247.2 secs End of band structure calculation k = 0.0000 0.0000 0.0000 ( 8189 PWs) bands (ev): 0.7891 0.7891 2.5319 2.5319 2.5681 2.5681 2.6700 2.6700 5.9350 5.9350 6.0318 6.0318 6.6139 6.6139 6.6484 6.6484 6.8335 6.8335 6.8493 6.8493 7.1405 7.1405 7.2142 7.2142 7.5033 7.5033 7.5125 7.5125 7.5566 7.5566 8.0009 8.0009 8.1254 8.1254 8.2435 8.2435 8.5593 8.5593 8.9158 8.9158 9.0481 9.0481 9.1042 9.1042 9.2804 9.2804 9.3324 9.3324 9.8831 9.8831 10.0539 10.0539 10.1588 10.1588 10.3724 10.3724 10.9512 10.9512 11.0641 11.0641 11.3346 11.3346 11.5602 11.5602 11.8117 11.8117 11.8976 11.8976 12.1164 12.1164 12.2816 12.2816 13.0773 13.0773 13.3668 13.3668 13.5102 13.5102 13.7397 13.7397 13.8225 13.8225 14.1326 14.1326 14.2092 14.2092 k = 0.0125-0.0000-0.0000 ( 8205 PWs) bands (ev): 0.7907 0.7907 2.5326 2.5326 2.5687 2.5687 2.6702 2.6702 5.9338 5.9338 6.0332 6.0332 6.6145 6.6145 6.6489 6.6489 6.8347 6.8347 6.8493 6.8493 7.1405 7.1405 7.2150 7.2150 7.5021 7.5021 7.5134 7.5134 7.5580 7.5580 8.0010 8.0010 8.1243 8.1243 8.2435 8.2435 8.5600 8.5600 8.9158 8.9158 9.0473 9.0473 9.1009 9.1009 9.2796 9.2796 9.3355 9.3355 9.8822 9.8822 10.0361 10.0361 10.1746 10.1746 10.3749 10.3749 10.9479 10.9479 11.0610 11.0610 11.3373 11.3373 11.5551 11.5551 11.8098 11.8098 11.8960 11.8960 12.1162 12.1162 12.2802 12.2802 13.0807 13.0807 13.3612 13.3612 13.5111 13.5111 13.7380 13.7380 13.8338 13.8338 14.1335 14.1335 14.2071 14.2071 k = 0.0250-0.0000-0.0000 ( 8205 PWs) bands (ev): 0.7953 0.7953 2.5346 2.5346 2.5705 2.5705 2.6708 2.6708 5.9300 5.9300 6.0377 6.0377 6.6162 6.6162 6.6504 6.6504 6.8382 6.8382 6.8497 6.8497 7.1403 7.1403 7.2174 7.2174 7.4985 7.4985 7.5162 7.5162 7.5618 7.5618 8.0013 8.0013 8.1210 8.1210 8.2436 8.2436 8.5618 8.5618 8.9154 8.9154 9.0450 9.0450 9.0916 9.0916 9.2781 9.2781 9.3436 9.3436 9.8791 9.8791 10.0000 10.0000 10.2042 10.2042 10.3835 10.3835 10.9382 10.9382 11.0519 11.0519 11.3454 11.3454 11.5396 11.5396 11.8041 11.8041 11.8913 11.8913 12.1155 12.1155 12.2757 12.2757 13.0905 13.0905 13.3462 13.3462 13.5139 13.5139 13.7342 13.7342 13.8642 13.8642 14.1359 14.1359 14.2011 14.2011 k = 0.0375-0.0000-0.0000 ( 8221 PWs) bands (ev): 0.8030 0.8030 2.5379 2.5379 2.5736 2.5736 2.6718 2.6718 5.9240 5.9240 6.0449 6.0449 6.6189 6.6189 6.6528 6.6528 6.8432 6.8432 6.8509 6.8509 7.1399 7.1399 7.2215 7.2215 7.4932 7.4932 7.5211 7.5211 7.5674 7.5674 8.0018 8.0018 8.1156 8.1156 8.2437 8.2437 8.5647 8.5647 8.9143 8.9143 9.0408 9.0408 9.0782 9.0782 9.2769 9.2769 9.3546 9.3546 9.8725 9.8725 9.9613 9.9613 10.2303 10.2303 10.4004 10.4004 10.9227 10.9227 11.0372 11.0372 11.3581 11.3581 11.5140 11.5140 11.7951 11.7951 11.8841 11.8841 12.1142 12.1142 12.2677 12.2677 13.1067 13.1067 13.3260 13.3260 13.5185 13.5185 13.7295 13.7295 13.9077 13.9077 14.1400 14.1400 14.1916 14.1916 k = 0.0500-0.0000-0.0000 ( 8229 PWs) bands (ev): 0.8139 0.8139 2.5424 2.5424 2.5778 2.5778 2.6733 2.6733 5.9157 5.9157 6.0551 6.0551 6.6225 6.6225 6.6561 6.6561 6.8469 6.8469 6.8562 6.8562 7.1390 7.1390 7.2273 7.2273 7.4869 7.4869 7.5277 7.5277 7.5740 7.5740 8.0027 8.0027 8.1085 8.1085 8.2440 8.2440 8.5683 8.5683 8.9117 8.9117 9.0333 9.0333 9.0642 9.0642 9.2764 9.2764 9.3671 9.3671 9.8589 9.8589 9.9281 9.9281 10.2469 10.2469 10.4269 10.4269 10.9025 10.9025 11.0176 11.0176 11.3745 11.3745 11.4787 11.4787 11.7831 11.7831 11.8751 11.8751 12.1121 12.1121 12.2554 12.2554 13.1284 13.1284 13.3048 13.3048 13.5249 13.5249 13.7229 13.7229 13.9587 13.9587 14.1459 14.1459 14.1801 14.1801 k = 0.0625-0.0000-0.0000 ( 8237 PWs) bands (ev): 0.8277 0.8277 2.5482 2.5482 2.5832 2.5832 2.6752 2.6752 5.9056 5.9056 6.0680 6.0680 6.6266 6.6266 6.6604 6.6604 6.8485 6.8485 6.8664 6.8664 7.1377 7.1377 7.2349 7.2349 7.4802 7.4802 7.5358 7.5358 7.5813 7.5813 8.0040 8.0040 8.0998 8.0998 8.2444 8.2444 8.5723 8.5723 8.9059 8.9059 9.0206 9.0206 9.0545 9.0545 9.2765 9.2765 9.3798 9.3798 9.8338 9.8338 9.9066 9.9066 10.2537 10.2537 10.4609 10.4609 10.8785 10.8785 10.9940 10.9940 11.3926 11.3926 11.4356 11.4356 11.7683 11.7683 11.8655 11.8655 12.1092 12.1092 12.2382 12.2382 13.1551 13.1551 13.2859 13.2859 13.5331 13.5331 13.7132 13.7132 14.0116 14.0116 14.1545 14.1545 14.1685 14.1685 k = 0.0750-0.0000-0.0000 ( 8225 PWs) bands (ev): 0.8446 0.8446 2.5551 2.5551 2.5898 2.5898 2.6774 2.6774 5.8937 5.8937 6.0836 6.0836 6.6308 6.6308 6.6655 6.6655 6.8500 6.8500 6.8796 6.8796 7.1357 7.1357 7.2442 7.2442 7.4735 7.4735 7.5450 7.5450 7.5891 7.5891 8.0060 8.0060 8.0901 8.0901 8.2449 8.2449 8.5763 8.5763 8.8952 8.8952 9.0048 9.0048 9.0500 9.0500 9.2768 9.2768 9.3923 9.3923 9.7998 9.7998 9.8947 9.8947 10.2530 10.2530 10.4981 10.4981 10.8519 10.8519 10.9672 10.9672 11.3774 11.3774 11.4202 11.4202 11.7507 11.7507 11.8560 11.8560 12.1050 12.1050 12.2161 12.2161 13.1858 13.1858 13.2716 13.2716 13.5430 13.5430 13.6986 13.6986 14.0574 14.0574 14.1581 14.1581 14.1725 14.1725 k = 0.0875-0.0000-0.0000 ( 8225 PWs) bands (ev): 0.8645 0.8645 2.5631 2.5631 2.5974 2.5974 2.6801 2.6801 5.8805 5.8805 6.1019 6.1019 6.6346 6.6346 6.6716 6.6716 6.8522 6.8522 6.8952 6.8952 7.1330 7.1330 7.2549 7.2549 7.4669 7.4669 7.5547 7.5547 7.5974 7.5974 8.0088 8.0088 8.0797 8.0797 8.2454 8.2454 8.5802 8.5802 8.8776 8.8776 8.9904 8.9904 9.0489 9.0489 9.2769 9.2769 9.4040 9.4040 9.7631 9.7631 9.8868 9.8868 10.2473 10.2473 10.5340 10.5340 10.8240 10.8240 10.9382 10.9382 11.3196 11.3196 11.4426 11.4426 11.7301 11.7301 11.8477 11.8477 12.0989 12.0989 12.1896 12.1896 13.2190 13.2190 13.2635 13.2635 13.5545 13.5545 13.6774 13.6774 14.0842 14.0842 14.1534 14.1534 14.2067 14.2067 k = 0.1000-0.0000-0.0000 ( 8223 PWs) bands (ev): 0.8874 0.8874 2.5721 2.5721 2.6062 2.6062 2.6831 2.6831 5.8661 5.8661 6.1226 6.1226 6.6376 6.6376 6.6784 6.6784 6.8557 6.8557 6.9131 6.9131 7.1299 7.1299 7.2669 7.2669 7.4607 7.4607 7.5645 7.5645 7.6060 7.6060 8.0128 8.0128 8.0691 8.0691 8.2458 8.2458 8.5837 8.5837 8.8532 8.8532 8.9794 8.9794 9.0504 9.0504 9.2766 9.2766 9.4147 9.4147 9.7265 9.7265 9.8804 9.8804 10.2378 10.2378 10.5641 10.5641 10.7970 10.7970 10.9081 10.9081 11.2549 11.2549 11.4680 11.4680 11.7067 11.7067 11.8411 11.8411 12.0890 12.0890 12.1610 12.1610 13.2472 13.2472 13.2685 13.2685 13.5670 13.5670 13.6491 13.6491 14.0940 14.0940 14.1510 14.1510 14.2577 14.2577 k = 0.1125-0.0000-0.0000 ( 8227 PWs) bands (ev): 0.9132 0.9132 2.5820 2.5820 2.6159 2.6159 2.6865 2.6865 5.8510 5.8510 6.1458 6.1458 6.6390 6.6390 6.6860 6.6860 6.8609 6.8609 6.9330 6.9330 7.1263 7.1263 7.2797 7.2797 7.4552 7.4552 7.5739 7.5739 7.6149 7.6149 8.0182 8.0182 8.0586 8.0586 8.2457 8.2457 8.5866 8.5866 8.8236 8.8236 8.9712 8.9712 9.0541 9.0541 9.2755 9.2755 9.4244 9.4244 9.6913 9.6913 9.8744 9.8744 10.2255 10.2255 10.5831 10.5831 10.7748 10.7748 10.8777 10.8777 11.1858 11.1858 11.4947 11.4947 11.6809 11.6809 11.8367 11.8367 12.0709 12.0709 12.1356 12.1356 13.2562 13.2562 13.2996 13.2996 13.5775 13.5775 13.6168 13.6168 14.0984 14.0984 14.1485 14.1485 14.3149 14.3149 k = 0.1250-0.0000-0.0000 ( 8219 PWs) bands (ev): 0.9419 0.9419 2.5927 2.5927 2.6266 2.6266 2.6903 2.6903 5.8355 5.8355 6.1712 6.1712 6.6384 6.6384 6.6940 6.6940 6.8681 6.8681 6.9548 6.9548 7.1228 7.1228 7.2927 7.2927 7.4503 7.4503 7.5827 7.5827 7.6237 7.6237 8.0253 8.0253 8.0488 8.0488 8.2452 8.2452 8.5890 8.5890 8.7912 8.7912 8.9647 8.9647 9.0596 9.0596 9.2733 9.2733 9.4328 9.4328 9.6580 9.6580 9.8683 9.8683 10.2109 10.2109 10.5851 10.5851 10.7616 10.7616 10.8479 10.8479 11.1137 11.1137 11.5221 11.5221 11.6533 11.6533 11.8349 11.8349 12.0398 12.0398 12.1189 12.1189 13.2643 13.2643 13.3367 13.3367 13.5599 13.5599 13.6079 13.6079 14.1018 14.1018 14.1458 14.1458 14.3716 14.3716 k = 0.1375-0.0000-0.0000 ( 8207 PWs) bands (ev): 0.9734 0.9734 2.6040 2.6040 2.6381 2.6381 2.6945 2.6945 5.8198 5.8198 6.1987 6.1987 6.6356 6.6356 6.7023 6.7023 6.8776 6.8776 6.9782 6.9782 7.1195 7.1195 7.3055 7.3055 7.4463 7.4463 7.5908 7.5908 7.6323 7.6323 8.0327 8.0327 8.0415 8.0415 8.2440 8.2440 8.5904 8.5904 8.7579 8.7579 8.9592 8.9592 9.0663 9.0663 9.2699 9.2699 9.4398 9.4398 9.6273 9.6273 9.8618 9.8618 10.1941 10.1941 10.5683 10.5683 10.7571 10.7571 10.8201 10.8201 11.0401 11.0401 11.5482 11.5482 11.6259 11.6259 11.8356 11.8356 11.9988 11.9988 12.1090 12.1090 13.2759 13.2759 13.3720 13.3720 13.5176 13.5176 13.6226 13.6226 14.1003 14.1003 14.1471 14.1471 14.4237 14.4237 k = 0.1500-0.0000-0.0000 ( 8205 PWs) bands (ev): 1.0077 1.0077 2.6158 2.6158 2.6504 2.6504 2.6990 2.6990 5.8042 5.8042 6.2281 6.2281 6.6304 6.6304 6.7103 6.7103 6.8894 6.8894 7.0029 7.0029 7.1171 7.1171 7.3174 7.3174 7.4429 7.4429 7.5983 7.5983 7.6405 7.6405 8.0285 8.0285 8.0489 8.0489 8.2422 8.2422 8.5906 8.5906 8.7257 8.7257 8.9544 8.9544 9.0738 9.0738 9.2650 9.2650 9.4449 9.4449 9.5998 9.5998 9.8546 9.8546 10.1754 10.1754 10.5375 10.5375 10.7523 10.7523 10.7980 10.7980 10.9667 10.9667 11.5624 11.5624 11.6094 11.6094 11.8386 11.8386 11.9530 11.9530 12.1024 12.1024 13.2899 13.2899 13.3956 13.3956 13.4822 13.4822 13.6412 13.6412 14.0885 14.0885 14.1570 14.1570 14.4680 14.4680 k = 0.1625-0.0000-0.0000 ( 8209 PWs) bands (ev): 1.0447 1.0447 2.6279 2.6279 2.6634 2.6634 2.7040 2.7040 5.7891 5.7891 6.2591 6.2591 6.6228 6.6228 6.7176 6.7176 6.9034 6.9034 7.0282 7.0282 7.1166 7.1166 7.3277 7.3277 7.4400 7.4400 7.6057 7.6057 7.6483 7.6483 8.0208 8.0208 8.0628 8.0628 8.2400 8.2400 8.5881 8.5881 8.6973 8.6973 8.9502 8.9502 9.0817 9.0817 9.2584 9.2584 9.4472 9.4472 9.5767 9.5767 9.8464 9.8464 10.1549 10.1549 10.4985 10.4985 10.7355 10.7355 10.7856 10.7856 10.8961 10.8961 11.5431 11.5431 11.6252 11.6252 11.8414 11.8414 11.9072 11.9072 12.0974 12.0974 13.3015 13.3015 13.3844 13.3844 13.4843 13.4843 13.6614 13.6614 14.0672 14.0672 14.1734 14.1734 14.5013 14.5013 k = 0.1750-0.0000-0.0000 ( 8201 PWs) bands (ev): 1.0843 1.0843 2.6402 2.6402 2.6768 2.6768 2.7095 2.7095 5.7747 5.7747 6.2914 6.2914 6.6130 6.6130 6.7239 6.7239 6.9194 6.9194 7.0527 7.0527 7.1194 7.1194 7.3356 7.3356 7.4370 7.4370 7.6135 7.6135 7.6560 7.6560 8.0136 8.0136 8.0787 8.0787 8.2380 8.2380 8.5809 8.5809 8.6757 8.6757 8.9466 8.9466 9.0894 9.0894 9.2501 9.2501 9.4454 9.4454 9.5600 9.5600 9.8371 9.8371 10.1329 10.1329 10.4550 10.4550 10.7072 10.7072 10.7732 10.7732 10.8352 10.8352 11.5102 11.5102 11.6528 11.6528 11.8289 11.8289 11.8781 11.8781 12.0932 12.0932 13.2922 13.2922 13.3700 13.3700 13.5122 13.5122 13.6828 13.6828 14.0387 14.0387 14.1932 14.1932 14.5195 14.5195 k = 0.1875-0.0000-0.0000 ( 8193 PWs) bands (ev): 1.1265 1.1265 2.6526 2.6526 2.6904 2.6904 2.7157 2.7157 5.7613 5.7613 6.3247 6.3247 6.6012 6.6012 6.7285 6.7285 6.9370 6.9370 7.0739 7.0739 7.1287 7.1287 7.3405 7.3405 7.4339 7.4339 7.6220 7.6220 7.6642 7.6642 8.0070 8.0070 8.0948 8.0948 8.2375 8.2375 8.5671 8.5671 8.6639 8.6639 8.9435 8.9435 9.0966 9.0966 9.2400 9.2400 9.4383 9.4383 9.5510 9.5510 9.8261 9.8261 10.1094 10.1094 10.4088 10.4088 10.6686 10.6686 10.7434 10.7434 10.7998 10.7998 11.4735 11.4735 11.6808 11.6808 11.7884 11.7884 11.8796 11.8796 12.0898 12.0898 13.2532 13.2532 13.3836 13.3836 13.5443 13.5443 13.7051 13.7051 14.0044 14.0044 14.2140 14.2140 14.5137 14.5137 k = 0.2000-0.0000-0.0000 ( 8183 PWs) bands (ev): 1.1712 1.1712 2.6647 2.6647 2.7034 2.7034 2.7232 2.7232 5.7490 5.7490 6.3585 6.3585 6.5877 6.5877 6.7310 6.7310 6.9557 6.9557 7.0889 7.0889 7.1471 7.1471 7.3410 7.3410 7.4309 7.4309 7.6315 7.6315 7.6736 7.6736 8.0010 8.0010 8.1088 8.1088 8.2407 8.2407 8.5478 8.5478 8.6613 8.6613 8.9410 8.9410 9.1030 9.1030 9.2281 9.2281 9.4261 9.4261 9.5499 9.5499 9.8133 9.8133 10.0846 10.0846 10.3612 10.3612 10.6172 10.6172 10.7069 10.7069 10.7821 10.7821 11.4343 11.4343 11.6969 11.6969 11.7518 11.7518 11.8899 11.8899 12.0871 12.0871 13.2068 13.2068 13.4089 13.4089 13.5753 13.5753 13.7280 13.7280 13.9659 13.9659 14.2342 14.2342 14.4860 14.4860 k = 0.2125-0.0000-0.0000 ( 8171 PWs) bands (ev): 1.2183 1.2183 2.6766 2.6766 2.7151 2.7151 2.7326 2.7326 5.7382 5.7382 6.3922 6.3922 6.5731 6.5731 6.7311 6.7311 6.9751 6.9751 7.0998 7.0998 7.1730 7.1730 7.3356 7.3356 7.4296 7.4296 7.6419 7.6419 7.6849 7.6849 7.9956 7.9956 8.1180 8.1180 8.2501 8.2501 8.5264 8.5264 8.6651 8.6651 8.9389 8.9389 9.1081 9.1081 9.2145 9.2145 9.4111 9.4111 9.5550 9.5550 9.7982 9.7982 10.0586 10.0586 10.3129 10.3129 10.5572 10.5572 10.6770 10.6770 10.7654 10.7654 11.3932 11.3932 11.6670 11.6670 11.7588 11.7588 11.9015 11.9015 12.0851 12.0851 13.1625 13.1625 13.4388 13.4388 13.6033 13.6033 13.7511 13.7511 13.9251 13.9251 14.2525 14.2525 14.4515 14.4515 k = 0.2250-0.0000-0.0000 ( 8175 PWs) bands (ev): 1.2676 1.2676 2.6880 2.6880 2.7249 2.7249 2.7444 2.7444 5.7290 5.7290 6.4247 6.4247 6.5581 6.5581 6.7285 6.7285 6.9947 6.9947 7.1098 7.1098 7.2025 7.2025 7.3235 7.3235 7.4316 7.4316 7.6527 7.6527 7.6988 7.6988 7.9906 7.9906 8.1213 8.1213 8.2671 8.2671 8.5053 8.5053 8.6733 8.6733 8.9372 8.9372 9.1117 9.1117 9.1995 9.1995 9.3953 9.3953 9.5644 9.5644 9.7806 9.7806 10.0317 10.0317 10.2644 10.2644 10.4949 10.4949 10.6517 10.6517 10.7464 10.7464 11.3501 11.3501 11.6177 11.6177 11.7827 11.7827 11.9124 11.9124 12.0842 12.0842 13.1237 13.1237 13.4715 13.4715 13.6262 13.6262 13.7741 13.7741 13.8851 13.8851 14.2677 14.2677 14.4151 14.4151 k = 0.2375-0.0000-0.0000 ( 8175 PWs) bands (ev): 1.3190 1.3190 2.6987 2.6987 2.7335 2.7335 2.7575 2.7575 5.7215 5.7215 6.4535 6.4535 6.5447 6.5447 6.7232 6.7232 7.0141 7.0141 7.1202 7.1202 7.2330 7.2330 7.3058 7.3058 7.4377 7.4377 7.6633 7.6633 7.7154 7.7154 7.9855 7.9855 8.1201 8.1201 8.2904 8.2904 8.4857 8.4857 8.6846 8.6846 8.9359 8.9359 9.1135 9.1135 9.1836 9.1836 9.3801 9.3801 9.5770 9.5770 9.7603 9.7603 10.0039 10.0039 10.2161 10.2161 10.4338 10.4338 10.6291 10.6291 10.7249 10.7249 11.3053 11.3053 11.5658 11.5658 11.8044 11.8044 11.9223 11.9223 12.0848 12.0848 13.0924 13.0924 13.5061 13.5061 13.6406 13.6406 13.7957 13.7957 13.8511 13.8511 14.2792 14.2792 14.3782 14.3782 k = 0.2500-0.0000-0.0000 ( 8169 PWs) bands (ev): 1.3725 1.3725 2.7086 2.7086 2.7418 2.7418 2.7711 2.7711 5.7160 5.7160 6.4721 6.4721 6.5388 6.5388 6.7156 6.7156 7.0326 7.0326 7.1301 7.1301 7.2594 7.2594 7.2894 7.2894 7.4480 7.4480 7.6737 7.6737 7.7343 7.7343 7.9799 7.9799 8.1174 8.1174 8.3177 8.3177 8.4684 8.4684 8.6982 8.6982 8.9348 8.9348 9.1133 9.1133 9.1674 9.1674 9.3663 9.3663 9.5919 9.5919 9.7374 9.7374 9.9755 9.9755 10.1685 10.1685 10.3755 10.3755 10.6080 10.6080 10.7014 10.7014 11.2590 11.2590 11.5139 11.5139 11.8174 11.8174 11.9331 11.9331 12.0873 12.0873 13.0698 13.0698 13.5423 13.5423 13.6417 13.6417 13.8095 13.8095 13.8357 13.8357 14.2862 14.2862 14.3425 14.3425 k = 0.2625-0.0000-0.0000 ( 8167 PWs) bands (ev): 1.4279 1.4279 2.7177 2.7177 2.7501 2.7501 2.7844 2.7844 5.7126 5.7126 6.4718 6.4718 6.5480 6.5480 6.7066 6.7066 7.0498 7.0498 7.1360 7.1360 7.2568 7.2568 7.3039 7.3039 7.4623 7.4623 7.6841 7.6841 7.7550 7.7550 7.9734 7.9734 8.1156 8.1156 8.3461 8.3461 8.4543 8.4543 8.7133 8.7133 8.9340 8.9340 9.1109 9.1109 9.1518 9.1518 9.3542 9.3542 9.6085 9.6085 9.7123 9.7123 9.9464 9.9464 10.1219 10.1219 10.3207 10.3207 10.5878 10.5878 10.6767 10.6767 11.2113 11.2113 11.4624 11.4624 11.8165 11.8165 11.9475 11.9475 12.0921 12.0921 13.0565 13.0565 13.5793 13.5793 13.6264 13.6264 13.8097 13.8097 13.8491 13.8491 14.2830 14.2830 14.3142 14.3142 k = 0.2750-0.0000-0.0000 ( 8169 PWs) bands (ev): 1.4850 1.4850 2.7260 2.7260 2.7585 2.7585 2.7969 2.7969 5.7114 5.7114 6.4582 6.4582 6.5647 6.5647 6.6978 6.6978 7.0641 7.0641 7.1328 7.1328 7.2487 7.2487 7.3327 7.3327 7.4805 7.4805 7.6946 7.6946 7.7768 7.7768 7.9657 7.9657 8.1164 8.1164 8.3715 8.3715 8.4464 8.4464 8.7286 8.7286 8.9339 8.9339 9.1061 9.1061 9.1377 9.1377 9.3438 9.3438 9.6245 9.6245 9.6872 9.6872 9.9166 9.9166 10.0767 10.0767 10.2697 10.2697 10.5680 10.5680 10.6515 10.6515 11.1627 11.1627 11.4118 11.4118 11.7998 11.7998 11.9660 11.9660 12.0993 12.0993 13.0525 13.0525 13.5936 13.5936 13.6220 13.6220 13.8156 13.8156 13.8688 13.8688 14.2573 14.2573 14.3070 14.3070 k = 0.2875-0.0000-0.0000 ( 8167 PWs) bands (ev): 1.5437 1.5437 2.7335 2.7335 2.7670 2.7670 2.8084 2.8084 5.7124 5.7124 6.4398 6.4398 6.5772 6.5772 6.6920 6.6920 7.0700 7.0700 7.1229 7.1229 7.2532 7.2532 7.3612 7.3612 7.5028 7.5028 7.7055 7.7055 7.7992 7.7992 7.9575 7.9575 8.1201 8.1201 8.3858 8.3858 8.4519 8.4519 8.7423 8.7423 8.9355 8.9355 9.0994 9.0994 9.1259 9.1259 9.3349 9.3349 9.6291 9.6291 9.6732 9.6732 9.8863 9.8863 10.0334 10.0334 10.2228 10.2228 10.5480 10.5480 10.6267 10.6267 11.1133 11.1133 11.3620 11.3620 11.7692 11.7692 11.9863 11.9863 12.1086 12.1086 13.0573 13.0573 13.5614 13.5614 13.6597 13.6597 13.8275 13.8275 13.8883 13.8883 14.2230 14.2230 14.3076 14.3076 k = 0.3000-0.0000-0.0000 ( 8155 PWs) bands (ev): 1.6038 1.6038 2.7404 2.7404 2.7752 2.7752 2.8184 2.8184 5.7157 5.7157 6.4196 6.4196 6.5793 6.5793 6.6913 6.6913 7.0565 7.0565 7.1227 7.1227 7.2674 7.2674 7.3876 7.3876 7.5293 7.5293 7.7169 7.7169 7.8215 7.8215 7.9497 7.9497 8.1261 8.1261 8.3861 8.3861 8.4734 8.4734 8.7522 8.7522 8.9402 8.9402 9.0917 9.0917 9.1165 9.1165 9.3271 9.3271 9.6075 9.6075 9.6854 9.6854 9.8553 9.8553 9.9922 9.9922 10.1802 10.1802 10.5273 10.5273 10.6030 10.6030 11.0637 11.0637 11.3132 11.3132 11.7270 11.7270 12.0063 12.0063 12.1198 12.1198 13.0699 13.0699 13.5277 13.5277 13.6995 13.6995 13.8418 13.8418 13.9067 13.9067 14.1880 14.1880 14.3092 14.3092 k = 0.3125-0.0000-0.0000 ( 8147 PWs) bands (ev): 1.6651 1.6651 2.7469 2.7469 2.7830 2.7830 2.8269 2.8269 5.7214 5.7214 6.3986 6.3986 6.5703 6.5703 6.6943 6.6943 7.0301 7.0301 7.1326 7.1326 7.2865 7.2865 7.4113 7.4113 7.5598 7.5598 7.7289 7.7289 7.8428 7.8428 7.9444 7.9444 8.1332 8.1332 8.3810 8.3810 8.5023 8.5023 8.7563 8.7563 8.9491 8.9491 9.0842 9.0842 9.1093 9.1093 9.3198 9.3198 9.5762 9.5762 9.7075 9.7075 9.8239 9.8239 9.9538 9.9538 10.1419 10.1419 10.5053 10.5053 10.5811 10.5811 11.0141 11.0141 11.2655 11.2655 11.6753 11.6753 12.0244 12.0244 12.1323 12.1323 13.0890 13.0890 13.4971 13.4971 13.7397 13.7397 13.8568 13.8568 13.9233 13.9233 14.1536 14.1536 14.3103 14.3103 k = 0.3250-0.0000-0.0000 ( 8147 PWs) bands (ev): 1.7274 1.7274 2.7529 2.7529 2.7902 2.7902 2.8334 2.8334 5.7295 5.7295 6.3774 6.3774 6.5533 6.5533 6.6954 6.6954 7.0037 7.0037 7.1450 7.1450 7.3077 7.3077 7.4323 7.4323 7.5937 7.5937 7.7416 7.7416 7.8613 7.8613 7.9444 7.9444 8.1398 8.1398 8.3758 8.3758 8.5333 8.5333 8.7541 8.7541 8.9613 8.9613 9.0783 9.0783 9.1044 9.1044 9.3123 9.3123 9.5428 9.5428 9.7322 9.7322 9.7926 9.7926 9.9185 9.9185 10.1084 10.1084 10.4817 10.4817 10.5615 10.5615 10.9649 10.9649 11.2189 11.2189 11.6158 11.6158 12.0404 12.0404 12.1455 12.1455 13.1133 13.1133 13.4717 13.4717 13.7799 13.7799 13.8716 13.8716 13.9381 13.9381 14.1202 14.1202 14.3055 14.3055 k = 0.3375-0.0000-0.0000 ( 8145 PWs) bands (ev): 1.7906 1.7906 2.7585 2.7585 2.7967 2.7967 2.8377 2.8377 5.7399 5.7399 6.3562 6.3562 6.5314 6.5314 6.6891 6.6891 6.9838 6.9838 7.1574 7.1574 7.3294 7.3294 7.4508 7.4508 7.6302 7.6302 7.7549 7.7549 7.8747 7.8747 7.9526 7.9526 8.1444 8.1444 8.3719 8.3719 8.5646 8.5646 8.7473 8.7473 8.9734 8.9734 9.0755 9.0755 9.1030 9.1030 9.3036 9.3036 9.5091 9.5091 9.7489 9.7489 9.7705 9.7705 9.8871 9.8871 10.0800 10.0800 10.4562 10.4562 10.5444 10.5444 10.9166 10.9166 11.1735 11.1735 11.5497 11.5497 12.0543 12.0543 12.1582 12.1582 13.1414 13.1414 13.4528 13.4528 13.8197 13.8197 13.8858 13.8858 13.9507 13.9507 14.0879 14.0879 14.2807 14.2807 k = 0.3500-0.0000-0.0000 ( 8149 PWs) bands (ev): 1.8543 1.8543 2.7636 2.7636 2.8024 2.8024 2.8398 2.8398 5.7527 5.7527 6.3352 6.3352 6.5066 6.5066 6.6727 6.6727 6.9735 6.9735 7.1687 7.1687 7.3509 7.3509 7.4672 7.4672 7.6684 7.6684 7.7689 7.7689 7.8830 7.8830 7.9698 7.9698 8.1462 8.1462 8.3693 8.3693 8.5956 8.5956 8.7383 8.7383 8.9805 8.9805 9.0759 9.0759 9.1077 9.1077 9.2929 9.2929 9.4759 9.4759 9.7246 9.7246 9.7883 9.7883 9.8623 9.8623 10.0573 10.0573 10.4288 10.4288 10.5297 10.5297 10.8698 10.8698 11.1293 11.1293 11.4784 11.4784 12.0664 12.0664 12.1698 12.1698 13.1723 13.1723 13.4413 13.4413 13.8581 13.8581 13.8993 13.8993 13.9612 13.9612 14.0569 14.0569 14.2472 14.2472 k = 0.3625-0.0000-0.0000 ( 8159 PWs) bands (ev): 1.9183 1.9183 2.7683 2.7683 2.8071 2.8071 2.8396 2.8396 5.7677 5.7677 6.3146 6.3146 6.4802 6.4802 6.6466 6.6466 6.9726 6.9726 7.1784 7.1784 7.3715 7.3715 7.4818 7.4818 7.7071 7.7071 7.7836 7.7836 7.8890 7.8890 7.9932 7.9932 8.1452 8.1452 8.3667 8.3667 8.6257 8.6257 8.7300 8.7300 8.9807 8.9807 9.0769 9.0769 9.1211 9.1211 9.2792 9.2792 9.4439 9.4439 9.6942 9.6942 9.8011 9.8011 9.8546 9.8546 10.0409 10.0409 10.3995 10.3995 10.5170 10.5170 10.8249 10.8249 11.0863 11.0863 11.4028 11.4028 12.0772 12.0772 12.1794 12.1794 13.2049 13.2049 13.4374 13.4374 13.8925 13.8925 13.9134 13.9134 13.9695 13.9695 14.0277 14.0277 14.2122 14.2122 k = 0.3750-0.0000-0.0000 ( 8169 PWs) bands (ev): 1.9823 1.9823 2.7720 2.7720 2.8103 2.8103 2.8374 2.8374 5.7849 5.7849 6.2942 6.2942 6.4530 6.4530 6.6136 6.6136 6.9789 6.9789 7.1859 7.1859 7.3911 7.3911 7.4950 7.4950 7.7448 7.7448 7.7996 7.7996 7.8955 7.8955 8.0196 8.0196 8.1422 8.1422 8.3623 8.3623 8.6547 8.6547 8.7248 8.7248 8.9762 8.9762 9.0766 9.0766 9.1410 9.1410 9.2621 9.2621 9.4135 9.4135 9.6641 9.6641 9.7936 9.7936 9.8738 9.8738 10.0318 10.0318 10.3686 10.3686 10.5056 10.5056 10.7827 10.7827 11.0445 11.0445 11.3240 11.3240 12.0870 12.0870 12.1867 12.1867 13.2386 13.2386 13.4412 13.4412 13.9127 13.9127 13.9355 13.9355 13.9751 13.9751 14.0022 14.0022 14.1781 14.1781 k = 0.3875-0.0000-0.0000 ( 8171 PWs) bands (ev): 2.0461 2.0461 2.7742 2.7742 2.8116 2.8116 2.8342 2.8342 5.8043 5.8043 6.2741 6.2741 6.4258 6.4258 6.5769 6.5769 6.9898 6.9898 7.1910 7.1910 7.4095 7.4095 7.5069 7.5069 7.7786 7.7786 7.8189 7.8189 7.9038 7.9038 8.0467 8.0467 8.1389 8.1389 8.3540 8.3540 8.6824 8.6824 8.7238 8.7238 8.9702 8.9702 9.0754 9.0754 9.1616 9.1616 9.2426 9.2426 9.3847 9.3847 9.6347 9.6347 9.7823 9.7823 9.9035 9.9035 10.0308 10.0308 10.3359 10.3359 10.4950 10.4950 10.7442 10.7442 11.0040 11.0040 11.2430 11.2430 12.0961 12.0961 12.1915 12.1915 13.2732 13.2732 13.4522 13.4522 13.9186 13.9186 13.9569 13.9569 13.9717 13.9717 13.9922 13.9922 14.1484 14.1484 k = 0.4000-0.0000-0.0000 ( 8173 PWs) bands (ev): 2.1093 2.1093 2.7734 2.7734 2.8107 2.8107 2.8317 2.8317 5.8256 5.8256 6.2540 6.2540 6.3995 6.3995 6.5389 6.5389 7.0034 7.0034 7.1934 7.1934 7.4268 7.4268 7.5175 7.5175 7.8039 7.8039 7.8451 7.8451 7.9138 7.9138 8.0718 8.0718 8.1379 8.1379 8.3410 8.3410 8.7091 8.7091 8.7270 8.7270 8.9651 8.9651 9.0737 9.0737 9.1752 9.1752 9.2249 9.2249 9.3579 9.3579 9.6057 9.6057 9.7759 9.7759 9.9350 9.9350 10.0389 10.0389 10.3015 10.3015 10.4840 10.4840 10.7108 10.7108 10.9648 10.9648 11.1605 11.1605 12.1047 12.1047 12.1939 12.1939 13.3085 13.3085 13.4695 13.4695 13.9105 13.9105 13.9569 13.9569 13.9733 13.9733 13.9967 13.9967 14.1305 14.1305 k = 0.4125-0.0000-0.0000 ( 8177 PWs) bands (ev): 2.1717 2.1717 2.7669 2.7669 2.8092 2.8092 2.8307 2.8307 5.8488 5.8488 6.2333 6.2333 6.3751 6.3751 6.5015 6.5015 7.0185 7.0185 7.1929 7.1929 7.4432 7.4432 7.5267 7.5267 7.8216 7.8216 7.8768 7.8768 7.9246 7.9246 8.0913 8.0913 8.1432 8.1432 8.3233 8.3233 8.7327 8.7327 8.7352 8.7352 8.9628 8.9628 9.0717 9.0717 9.1685 9.1685 9.2197 9.2197 9.3342 9.3342 9.5767 9.5767 9.7772 9.7772 9.9657 9.9657 10.0567 10.0567 10.2655 10.2655 10.4716 10.4716 10.6838 10.6838 10.9268 10.9268 11.0778 11.0778 12.1128 12.1128 12.1941 12.1941 13.3448 13.3448 13.4919 13.4919 13.8885 13.8885 13.9558 13.9558 13.9737 13.9737 13.9927 13.9927 14.1333 14.1333 k = 0.4250-0.0000-0.0000 ( 8169 PWs) bands (ev): 2.2329 2.2329 2.7529 2.7529 2.8092 2.8092 2.8305 2.8305 5.8736 5.8736 6.2116 6.2116 6.3538 6.3538 6.4659 6.4659 7.0343 7.0343 7.1897 7.1897 7.4588 7.4588 7.5341 7.5341 7.8361 7.8361 7.9083 7.9083 7.9358 7.9358 8.1036 8.1036 8.1567 8.1567 8.3017 8.3017 8.7400 8.7400 8.7603 8.7603 8.9639 8.9639 9.0693 9.0693 9.1459 9.1459 9.2194 9.2194 9.3174 9.3174 9.5476 9.5476 9.7871 9.7871 9.9948 9.9948 10.0832 10.0832 10.2282 10.2282 10.4572 10.4572 10.6645 10.6645 10.8899 10.8899 10.9961 10.9961 12.1206 12.1206 12.1926 12.1926 13.3820 13.3820 13.5182 13.5182 13.8604 13.8604 13.9468 13.9468 13.9683 13.9683 13.9869 13.9869 14.1540 14.1540 k = 0.4375-0.0000-0.0000 ( 8151 PWs) bands (ev): 2.2926 2.2926 2.7323 2.7323 2.8109 2.8109 2.8304 2.8304 5.9000 5.9000 6.1882 6.1882 6.3365 6.3365 6.4329 6.4329 7.0505 7.0505 7.1840 7.1840 7.4736 7.4736 7.5395 7.5395 7.8494 7.8494 7.9298 7.9298 7.9532 7.9532 8.1133 8.1133 8.1732 8.1732 8.2778 8.2778 8.7476 8.7476 8.7844 8.7844 8.9686 8.9686 9.0667 9.0667 9.1205 9.1205 9.2090 9.2090 9.3119 9.3119 9.5184 9.5184 9.8053 9.8053 10.0230 10.0230 10.1145 10.1145 10.1905 10.1905 10.4416 10.4416 10.6531 10.6531 10.8530 10.8530 10.9176 10.9176 12.1281 12.1281 12.1896 12.1896 13.4205 13.4205 13.5473 13.5473 13.8295 13.8295 13.9180 13.9180 13.9695 13.9695 13.9854 13.9854 14.1830 14.1830 k = 0.4500-0.0000-0.0000 ( 8153 PWs) bands (ev): 2.3505 2.3505 2.7060 2.7060 2.8134 2.8134 2.8300 2.8300 5.9277 5.9277 6.1629 6.1629 6.3241 6.3241 6.4033 6.4033 7.0666 7.0666 7.1760 7.1760 7.4875 7.4875 7.5427 7.5427 7.8622 7.8622 7.9353 7.9353 7.9813 7.9813 8.1238 8.1238 8.1869 8.1869 8.2539 8.2539 8.7560 8.7560 8.8053 8.8053 8.9763 8.9763 9.0636 9.0636 9.0976 9.0976 9.1873 9.1873 9.3169 9.3169 9.4893 9.4893 9.8308 9.8308 10.0516 10.0516 10.1338 10.1338 10.1640 10.1640 10.4283 10.4283 10.6479 10.6479 10.8109 10.8109 10.8500 10.8500 12.1354 12.1354 12.1855 12.1855 13.4599 13.4599 13.5779 13.5779 13.7968 13.7968 13.8827 13.8827 13.9723 13.9723 13.9848 13.9848 14.2148 14.2148 k = 0.4625-0.0000-0.0000 ( 8148 PWs) bands (ev): 2.4061 2.4061 2.6749 2.6749 2.8163 2.8163 2.8292 2.8292 5.9565 5.9565 6.1357 6.1357 6.3168 6.3168 6.3774 6.3774 7.0826 7.0826 7.1661 7.1661 7.5005 7.5005 7.5434 7.5434 7.8747 7.8747 7.9337 7.9337 8.0114 8.0114 8.1337 8.1337 8.1936 8.1936 8.2340 8.2340 8.7661 8.7661 8.8198 8.8198 8.9873 8.9873 9.0594 9.0594 9.0809 9.0809 9.1597 9.1597 9.3282 9.3282 9.4608 9.4608 9.8622 9.8622 10.0806 10.0806 10.1028 10.1028 10.1803 10.1803 10.4240 10.4240 10.6433 10.6433 10.7567 10.7567 10.8056 10.8056 12.1425 12.1425 12.1805 12.1805 13.5002 13.5002 13.6084 13.6084 13.7637 13.7637 13.8458 13.8458 13.9751 13.9751 13.9842 13.9842 14.2470 14.2470 k = 0.4750-0.0000-0.0000 ( 8146 PWs) bands (ev): 2.4591 2.4591 2.6394 2.6394 2.8191 2.8191 2.8280 2.8280 5.9861 5.9861 6.1070 6.1070 6.3148 6.3148 6.3557 6.3557 7.0983 7.0983 7.1547 7.1547 7.5123 7.5123 7.5417 7.5417 7.8869 7.8869 7.9280 7.9280 8.0414 8.0414 8.1356 8.1356 8.1943 8.1943 8.2227 8.2227 8.7785 8.7785 8.8247 8.8247 9.0021 9.0021 9.0534 9.0534 9.0730 9.0730 9.1302 9.1302 9.3435 9.3435 9.4333 9.4333 9.8980 9.8980 10.0613 10.0613 10.1110 10.1110 10.1908 10.1908 10.4371 10.4371 10.6224 10.6224 10.7176 10.7176 10.7744 10.7744 12.1494 12.1494 12.1749 12.1749 13.5407 13.5407 13.6343 13.6343 13.7342 13.7342 13.8092 13.8092 13.9774 13.9774 13.9834 13.9834 14.2783 14.2783 k = 0.4875-0.0000-0.0000 ( 8138 PWs) bands (ev): 2.5093 2.5093 2.5997 2.5997 2.8218 2.8218 2.8263 2.8263 6.0164 6.0164 6.0772 6.0772 6.3178 6.3178 6.3384 6.3384 7.1135 7.1135 7.1419 7.1419 7.5226 7.5226 7.5375 7.5375 7.8986 7.8986 7.9197 7.9197 8.0706 8.0706 8.1221 8.1221 8.1990 8.1990 8.2158 8.2158 8.7930 8.7930 8.8198 8.8198 9.0201 9.0201 9.0466 9.0466 9.0728 9.0728 9.1025 9.1025 9.3620 9.3620 9.4073 9.4073 9.9369 9.9369 10.0195 10.0195 10.1398 10.1398 10.1845 10.1845 10.4703 10.4703 10.5740 10.5740 10.7138 10.7138 10.7484 10.7484 12.1561 12.1561 12.1689 12.1689 13.5804 13.5804 13.6406 13.6406 13.7235 13.7235 13.7740 13.7740 13.9794 13.9794 13.9824 13.9824 14.3077 14.3077 k = 0.5000-0.0000-0.0000 ( 8140 PWs) bands (ev): 2.5563 2.5563 2.5563 2.5563 2.8242 2.8242 2.8242 2.8242 6.0468 6.0468 6.0468 6.0468 6.3257 6.3257 6.3257 6.3257 7.1281 7.1281 7.1281 7.1281 7.5310 7.5310 7.5310 7.5310 7.9097 7.9097 7.9097 7.9097 8.0983 8.0983 8.0983 8.0983 8.2077 8.2077 8.2077 8.2077 8.8078 8.8078 8.8078 8.8078 9.0366 9.0366 9.0366 9.0366 9.0817 9.0817 9.0817 9.0817 9.3834 9.3834 9.3834 9.3834 9.9778 9.9778 9.9778 9.9778 10.1656 10.1656 10.1656 10.1656 10.5186 10.5186 10.5186 10.5186 10.7274 10.7274 10.7274 10.7274 12.1626 12.1626 12.1626 12.1626 13.6167 13.6167 13.6167 13.6167 13.7426 13.7426 13.7426 13.7426 13.9810 13.9810 13.9810 13.9810 14.3344 14.3344 k = 0.5000-0.0000-0.0000 ( 8140 PWs) bands (ev): 2.5563 2.5563 2.5563 2.5563 2.8242 2.8242 2.8242 2.8242 6.0468 6.0468 6.0468 6.0468 6.3257 6.3257 6.3257 6.3257 7.1281 7.1281 7.1281 7.1281 7.5310 7.5310 7.5310 7.5310 7.9097 7.9097 7.9097 7.9097 8.0983 8.0983 8.0983 8.0983 8.2077 8.2077 8.2077 8.2077 8.8078 8.8078 8.8078 8.8078 9.0366 9.0366 9.0366 9.0366 9.0817 9.0817 9.0817 9.0817 9.3834 9.3834 9.3834 9.3834 9.9778 9.9778 9.9778 9.9778 10.1656 10.1656 10.1656 10.1656 10.5186 10.5186 10.5186 10.5186 10.7274 10.7274 10.7274 10.7274 12.1626 12.1626 12.1626 12.1626 13.6167 13.6167 13.6167 13.6167 13.7426 13.7426 13.7426 13.7426 13.9810 13.9810 13.9810 13.9810 14.3344 14.3344 k = 0.5000 0.0124-0.0000 ( 8138 PWs) bands (ev): 2.5567 2.5567 2.5567 2.5567 2.8241 2.8241 2.8241 2.8241 6.0465 6.0465 6.0465 6.0465 6.3242 6.3242 6.3242 6.3242 7.1299 7.1299 7.1299 7.1299 7.5312 7.5312 7.5312 7.5312 7.9098 7.9098 7.9098 7.9098 8.0977 8.0977 8.0977 8.0977 8.2091 8.2091 8.2091 8.2091 8.8076 8.8076 8.8076 8.8076 9.0288 9.0288 9.0288 9.0288 9.0880 9.0880 9.0880 9.0880 9.3842 9.3842 9.3842 9.3842 9.9775 9.9775 9.9775 9.9775 10.1642 10.1642 10.1642 10.1642 10.5171 10.5171 10.5171 10.5171 10.7303 10.7303 10.7303 10.7303 12.1605 12.1605 12.1605 12.1605 13.6142 13.6142 13.6142 13.6142 13.7396 13.7396 13.7396 13.7396 13.9893 13.9893 13.9893 13.9893 14.3345 14.3345 k = 0.5000 0.0249-0.0000 ( 8126 PWs) bands (ev): 2.5578 2.5578 2.5578 2.5578 2.8235 2.8235 2.8235 2.8235 6.0454 6.0454 6.0454 6.0454 6.3197 6.3197 6.3197 6.3197 7.1353 7.1353 7.1353 7.1353 7.5315 7.5315 7.5315 7.5315 7.9102 7.9102 7.9102 7.9102 8.0961 8.0961 8.0961 8.0961 8.2130 8.2130 8.2130 8.2130 8.8071 8.8071 8.8071 8.8071 9.0122 9.0122 9.0122 9.0122 9.1004 9.1004 9.1004 9.1004 9.3865 9.3865 9.3865 9.3865 9.9767 9.9767 9.9767 9.9767 10.1601 10.1601 10.1601 10.1601 10.5126 10.5126 10.5126 10.5126 10.7390 10.7390 10.7390 10.7390 12.1543 12.1543 12.1543 12.1543 13.6068 13.6068 13.6068 13.6068 13.7323 13.7323 13.7323 13.7323 14.0123 14.0123 14.0123 14.0123 14.3349 14.3349 k = 0.5000 0.0373-0.0000 ( 8140 PWs) bands (ev): 2.5597 2.5597 2.5597 2.5597 2.8226 2.8226 2.8226 2.8226 6.0436 6.0436 6.0436 6.0436 6.3124 6.3124 6.3124 6.3124 7.1440 7.1440 7.1440 7.1440 7.5321 7.5321 7.5321 7.5321 7.9107 7.9107 7.9107 7.9107 8.0937 8.0937 8.0937 8.0937 8.2192 8.2192 8.2192 8.2192 8.8061 8.8061 8.8061 8.8061 8.9926 8.9926 8.9926 8.9926 9.1131 9.1131 9.1131 9.1131 9.3904 9.3904 9.3904 9.3904 9.9754 9.9754 9.9754 9.9754 10.1537 10.1537 10.1537 10.1537 10.5051 10.5051 10.5051 10.5051 10.7531 10.7531 10.7531 10.7531 12.1441 12.1441 12.1441 12.1441 13.5952 13.5952 13.5952 13.5952 13.7234 13.7234 13.7234 13.7234 14.0462 14.0462 14.0462 14.0462 14.3358 14.3358 k = 0.5000 0.0498-0.0000 ( 8146 PWs) bands (ev): 2.5623 2.5623 2.5623 2.5623 2.8214 2.8214 2.8214 2.8214 6.0411 6.0411 6.0411 6.0411 6.3027 6.3027 6.3027 6.3027 7.1557 7.1557 7.1557 7.1557 7.5330 7.5330 7.5330 7.5330 7.9113 7.9113 7.9113 7.9113 8.0907 8.0907 8.0907 8.0907 8.2276 8.2276 8.2276 8.2276 8.8048 8.8048 8.8048 8.8048 8.9719 8.9719 8.9719 8.9719 9.1244 9.1244 9.1244 9.1244 9.3959 9.3959 9.3959 9.3959 9.9732 9.9732 9.9732 9.9732 10.1454 10.1454 10.1454 10.1454 10.4947 10.4947 10.4947 10.4947 10.7720 10.7720 10.7720 10.7720 12.1300 12.1300 12.1300 12.1300 13.5808 13.5808 13.5808 13.5808 13.7148 13.7148 13.7148 13.7148 14.0877 14.0877 14.0877 14.0877 14.3377 14.3377 k = 0.5000 0.0622-0.0000 ( 8150 PWs) bands (ev): 2.5657 2.5657 2.5657 2.5657 2.8198 2.8198 2.8198 2.8198 6.0381 6.0381 6.0381 6.0381 6.2908 6.2908 6.2908 6.2908 7.1699 7.1699 7.1699 7.1699 7.5340 7.5340 7.5340 7.5340 7.9118 7.9118 7.9118 7.9118 8.0876 8.0876 8.0876 8.0876 8.2377 8.2377 8.2377 8.2377 8.8031 8.8031 8.8031 8.8031 8.9511 8.9511 8.9511 8.9511 9.1339 9.1339 9.1339 9.1339 9.4028 9.4028 9.4028 9.4028 9.9702 9.9702 9.9702 9.9702 10.1358 10.1358 10.1358 10.1358 10.4816 10.4816 10.4816 10.4816 10.7953 10.7953 10.7953 10.7953 12.1124 12.1124 12.1124 12.1124 13.5651 13.5651 13.5651 13.5651 13.7070 13.7070 13.7070 13.7070 14.1340 14.1340 14.1340 14.1340 14.3409 14.3409 k = 0.5000 0.0746-0.0000 ( 8160 PWs) bands (ev): 2.5698 2.5698 2.5698 2.5698 2.8178 2.8178 2.8178 2.8178 6.0345 6.0345 6.0345 6.0345 6.2771 6.2771 6.2771 6.2771 7.1862 7.1862 7.1862 7.1862 7.5352 7.5352 7.5352 7.5352 7.9120 7.9120 7.9120 7.9120 8.0844 8.0844 8.0844 8.0844 8.2495 8.2495 8.2495 8.2495 8.8010 8.8010 8.8010 8.8010 8.9309 8.9309 8.9309 8.9309 9.1414 9.1414 9.1414 9.1414 9.4111 9.4111 9.4111 9.4111 9.9660 9.9660 9.9660 9.9660 10.1254 10.1254 10.1254 10.1254 10.4660 10.4660 10.4660 10.4660 10.8222 10.8222 10.8222 10.8222 12.0914 12.0914 12.0914 12.0914 13.5493 13.5493 13.5493 13.5493 13.7000 13.7000 13.7000 13.7000 14.1833 14.1833 14.1833 14.1833 14.3459 14.3459 k = 0.5000 0.0871-0.0000 ( 8162 PWs) bands (ev): 2.5745 2.5745 2.5745 2.5745 2.8154 2.8154 2.8154 2.8154 6.0304 6.0304 6.0304 6.0304 6.2622 6.2622 6.2622 6.2622 7.2041 7.2041 7.2041 7.2041 7.5365 7.5365 7.5365 7.5365 7.9119 7.9119 7.9119 7.9119 8.0813 8.0813 8.0813 8.0813 8.2628 8.2628 8.2628 8.2628 8.7983 8.7983 8.7983 8.7983 8.9116 8.9116 8.9116 8.9116 9.1473 9.1473 9.1473 9.1473 9.4205 9.4205 9.4205 9.4205 9.9604 9.9604 9.9604 9.9604 10.1147 10.1147 10.1147 10.1147 10.4479 10.4479 10.4479 10.4479 10.8522 10.8522 10.8522 10.8522 12.0676 12.0676 12.0676 12.0676 13.5346 13.5346 13.5346 13.5346 13.6933 13.6933 13.6933 13.6933 14.2339 14.2339 14.2339 14.2339 14.3531 14.3531 k = 0.5000 0.0995-0.0000 ( 8158 PWs) bands (ev): 2.5799 2.5799 2.5799 2.5799 2.8127 2.8127 2.8127 2.8127 6.0260 6.0260 6.0260 6.0260 6.2463 6.2463 6.2463 6.2463 7.2231 7.2231 7.2231 7.2231 7.5379 7.5379 7.5379 7.5379 7.9115 7.9115 7.9115 7.9115 8.0782 8.0782 8.0782 8.0782 8.2775 8.2775 8.2775 8.2775 8.7948 8.7948 8.7948 8.7948 8.8942 8.8942 8.8942 8.8942 9.1516 9.1516 9.1516 9.1516 9.4307 9.4307 9.4307 9.4307 9.9533 9.9533 9.9533 9.9533 10.1041 10.1041 10.1041 10.1041 10.4278 10.4278 10.4278 10.4278 10.8846 10.8846 10.8846 10.8846 12.0411 12.0411 12.0411 12.0411 13.5215 13.5215 13.5215 13.5215 13.6868 13.6868 13.6868 13.6868 14.2842 14.2842 14.2842 14.2842 14.3633 14.3633 k = 0.5000 0.1119-0.0000 ( 8154 PWs) bands (ev): 2.5859 2.5859 2.5859 2.5859 2.8096 2.8096 2.8096 2.8096 6.0214 6.0214 6.0214 6.0214 6.2298 6.2298 6.2298 6.2298 7.2428 7.2428 7.2428 7.2428 7.5393 7.5393 7.5393 7.5393 7.9108 7.9108 7.9108 7.9108 8.0750 8.0750 8.0750 8.0750 8.2935 8.2935 8.2935 8.2935 8.7902 8.7902 8.7902 8.7902 8.8791 8.8791 8.8791 8.8791 9.1548 9.1548 9.1548 9.1548 9.4415 9.4415 9.4415 9.4415 9.9447 9.9447 9.9447 9.9447 10.0939 10.0939 10.0939 10.0939 10.4058 10.4058 10.4058 10.4058 10.9191 10.9191 10.9191 10.9191 12.0125 12.0125 12.0125 12.0125 13.5104 13.5104 13.5104 13.5104 13.6803 13.6803 13.6803 13.6803 14.3307 14.3307 14.3307 14.3307 14.3788 14.3788 k = 0.5000 0.1244-0.0000 ( 8162 PWs) bands (ev): 2.5924 2.5924 2.5924 2.5924 2.8060 2.8060 2.8060 2.8060 6.0165 6.0165 6.0165 6.0165 6.2130 6.2130 6.2130 6.2130 7.2627 7.2627 7.2627 7.2627 7.5406 7.5406 7.5406 7.5406 7.9099 7.9099 7.9099 7.9099 8.0716 8.0716 8.0716 8.0716 8.3107 8.3107 8.3107 8.3107 8.7839 8.7839 8.7839 8.7839 8.8675 8.8675 8.8675 8.8675 9.1573 9.1573 9.1573 9.1573 9.4526 9.4526 9.4526 9.4526 9.9344 9.9344 9.9344 9.9344 10.0842 10.0842 10.0842 10.0842 10.3823 10.3823 10.3823 10.3823 10.9551 10.9551 10.9551 10.9551 11.9820 11.9820 11.9820 11.9820 13.5014 13.5014 13.5014 13.5014 13.6737 13.6737 13.6737 13.6737 14.3651 14.3651 14.3651 14.3652 14.4068 14.4068 k = 0.5000 0.1368-0.0000 ( 8170 PWs) bands (ev): 2.5994 2.5994 2.5994 2.5994 2.8021 2.8021 2.8021 2.8021 6.0116 6.0116 6.0116 6.0116 6.1963 6.1963 6.1963 6.1963 7.2826 7.2826 7.2826 7.2826 7.5416 7.5416 7.5416 7.5416 7.9090 7.9090 7.9090 7.9090 8.0678 8.0678 8.0678 8.0678 8.3289 8.3289 8.3289 8.3289 8.7755 8.7755 8.7755 8.7755 8.8599 8.8599 8.8599 8.8599 9.1591 9.1591 9.1591 9.1591 9.4637 9.4637 9.4637 9.4637 9.9228 9.9228 9.9228 9.9228 10.0750 10.0750 10.0750 10.0750 10.3575 10.3575 10.3575 10.3575 10.9923 10.9923 10.9923 10.9923 11.9500 11.9500 11.9500 11.9500 13.4946 13.4946 13.4946 13.4946 13.6669 13.6669 13.6669 13.6669 14.3865 14.3865 14.3865 14.3865 14.4472 14.4472 k = 0.5000 0.1493-0.0000 ( 8164 PWs) bands (ev): 2.6069 2.6069 2.6069 2.6069 2.7978 2.7978 2.7978 2.7978 6.0067 6.0067 6.0067 6.0067 6.1798 6.1798 6.1798 6.1798 7.3020 7.3020 7.3020 7.3020 7.5423 7.5423 7.5423 7.5423 7.9082 7.9082 7.9082 7.9082 8.0635 8.0635 8.0635 8.0635 8.3478 8.3478 8.3478 8.3478 8.7651 8.7651 8.7651 8.7651 8.8567 8.8567 8.8567 8.8567 9.1605 9.1605 9.1605 9.1605 9.4747 9.4747 9.4747 9.4747 9.9101 9.9101 9.9101 9.9101 10.0663 10.0663 10.0663 10.0663 10.3318 10.3318 10.3318 10.3318 11.0303 11.0303 11.0303 11.0303 11.9168 11.9168 11.9168 11.9168 13.4899 13.4899 13.4899 13.4899 13.6599 13.6599 13.6599 13.6599 14.4045 14.4045 14.4045 14.4046 14.4893 14.4893 k = 0.5000 0.1617-0.0000 ( 8156 PWs) bands (ev): 2.6149 2.6149 2.6149 2.6149 2.7930 2.7930 2.7930 2.7930 6.0019 6.0019 6.0019 6.0019 6.1639 6.1639 6.1639 6.1639 7.3210 7.3210 7.3210 7.3210 7.5425 7.5425 7.5425 7.5425 7.9079 7.9079 7.9079 7.9079 8.0585 8.0585 8.0585 8.0585 8.3672 8.3672 8.3672 8.3672 8.7530 8.7530 8.7530 8.7530 8.8577 8.8577 8.8577 8.8577 9.1615 9.1615 9.1615 9.1615 9.4853 9.4853 9.4853 9.4853 9.8964 9.8964 9.8964 9.8964 10.0581 10.0581 10.0581 10.0581 10.3056 10.3056 10.3056 10.3056 11.0689 11.0689 11.0689 11.0689 11.8827 11.8827 11.8827 11.8827 13.4873 13.4873 13.4873 13.4873 13.6527 13.6527 13.6527 13.6527 14.4225 14.4225 14.4225 14.4225 14.5287 14.5287 k = 0.5000 0.1741-0.0000 ( 8156 PWs) bands (ev): 2.6231 2.6231 2.6231 2.6231 2.7879 2.7879 2.7879 2.7879 5.9974 5.9974 5.9974 5.9974 6.1487 6.1487 6.1487 6.1487 7.3392 7.3392 7.3392 7.3392 7.5419 7.5419 7.5419 7.5419 7.9082 7.9082 7.9082 7.9082 8.0528 8.0528 8.0528 8.0528 8.3868 8.3868 8.3868 8.3868 8.7399 8.7399 8.7399 8.7399 8.8625 8.8625 8.8625 8.8625 9.1619 9.1619 9.1619 9.1619 9.4956 9.4956 9.4956 9.4956 9.8822 9.8822 9.8822 9.8822 10.0503 10.0503 10.0503 10.0503 10.2791 10.2791 10.2791 10.2791 11.1079 11.1079 11.1079 11.1079 11.8480 11.8480 11.8480 11.8480 13.4865 13.4865 13.4865 13.4865 13.6453 13.6453 13.6453 13.6453 14.4411 14.4411 14.4411 14.4411 14.5636 14.5636 k = 0.5000 0.1866-0.0000 ( 8164 PWs) bands (ev): 2.6317 2.6317 2.6317 2.6317 2.7823 2.7823 2.7823 2.7823 5.9931 5.9931 5.9931 5.9931 6.1343 6.1343 6.1343 6.1343 7.3566 7.3566 7.3566 7.3566 7.5404 7.5404 7.5404 7.5404 7.9094 7.9094 7.9094 7.9094 8.0464 8.0464 8.0464 8.0464 8.4063 8.4063 8.4063 8.4063 8.7262 8.7262 8.7262 8.7262 8.8707 8.8707 8.8707 8.8707 9.1617 9.1617 9.1617 9.1617 9.5054 9.5054 9.5054 9.5054 9.8679 9.8679 9.8679 9.8679 10.0432 10.0432 10.0432 10.0432 10.2526 10.2526 10.2526 10.2526 11.1470 11.1470 11.1470 11.1470 11.8128 11.8128 11.8128 11.8128 13.4874 13.4874 13.4874 13.4874 13.6377 13.6377 13.6377 13.6377 14.4602 14.4602 14.4602 14.4602 14.5933 14.5933 k = 0.5000 0.1990-0.0000 ( 8164 PWs) bands (ev): 2.6405 2.6405 2.6405 2.6405 2.7764 2.7764 2.7764 2.7764 5.9892 5.9892 5.9892 5.9892 6.1210 6.1210 6.1210 6.1210 7.3731 7.3731 7.3731 7.3731 7.5380 7.5380 7.5380 7.5380 7.9116 7.9116 7.9116 7.9116 8.0392 8.0392 8.0392 8.0392 8.4253 8.4253 8.4253 8.4253 8.7124 8.7124 8.7124 8.7124 8.8819 8.8819 8.8819 8.8819 9.1605 9.1605 9.1605 9.1605 9.5148 9.5148 9.5148 9.5148 9.8536 9.8536 9.8536 9.8536 10.0368 10.0368 10.0368 10.0368 10.2266 10.2266 10.2266 10.2266 11.1861 11.1861 11.1861 11.1861 11.7773 11.7773 11.7773 11.7773 13.4899 13.4899 13.4899 13.4899 13.6299 13.6299 13.6299 13.6299 14.4797 14.4797 14.4797 14.4797 14.6173 14.6173 k = 0.5000 0.2115-0.0000 ( 8164 PWs) bands (ev): 2.6495 2.6495 2.6495 2.6495 2.7701 2.7701 2.7701 2.7701 5.9857 5.9857 5.9857 5.9857 6.1089 6.1089 6.1089 6.1089 7.3889 7.3889 7.3889 7.3889 7.5345 7.5345 7.5345 7.5345 7.9149 7.9149 7.9149 7.9149 8.0314 8.0314 8.0314 8.0314 8.4436 8.4436 8.4436 8.4436 8.6986 8.6986 8.6986 8.6986 8.8958 8.8958 8.8958 8.8958 9.1579 9.1579 9.1579 9.1579 9.5236 9.5236 9.5236 9.5236 9.8397 9.8397 9.8397 9.8397 10.0315 10.0315 10.0315 10.0315 10.2012 10.2012 10.2012 10.2012 11.2251 11.2251 11.2251 11.2251 11.7417 11.7417 11.7417 11.7417 13.4936 13.4936 13.4936 13.4936 13.6219 13.6219 13.6219 13.6219 14.4993 14.4993 14.4993 14.4993 14.6354 14.6354 k = 0.5000 0.2239-0.0000 ( 8160 PWs) bands (ev): 2.6587 2.6587 2.6587 2.6587 2.7634 2.7634 2.7634 2.7634 5.9826 5.9826 5.9826 5.9826 6.0981 6.0981 6.0981 6.0981 7.4039 7.4039 7.4039 7.4039 7.5298 7.5298 7.5298 7.5298 7.9193 7.9193 7.9193 7.9193 8.0230 8.0230 8.0230 8.0230 8.4610 8.4610 8.4610 8.4610 8.6851 8.6851 8.6851 8.6851 8.9118 8.9118 8.9118 8.9118 9.1538 9.1538 9.1538 9.1538 9.5319 9.5319 9.5319 9.5319 9.8264 9.8264 9.8264 9.8264 10.0276 10.0276 10.0276 10.0276 10.1769 10.1769 10.1769 10.1769 11.2638 11.2638 11.2638 11.2638 11.7059 11.7059 11.7059 11.7059 13.4984 13.4984 13.4984 13.4984 13.6139 13.6139 13.6139 13.6139 14.5189 14.5189 14.5189 14.5189 14.6479 14.6479 k = 0.5000 0.2363-0.0000 ( 8168 PWs) bands (ev): 2.6678 2.6678 2.6678 2.6678 2.7563 2.7563 2.7563 2.7563 5.9800 5.9800 5.9800 5.9800 6.0887 6.0887 6.0887 6.0887 7.4181 7.4181 7.4181 7.4181 7.5240 7.5240 7.5240 7.5240 7.9248 7.9248 7.9248 7.9248 8.0141 8.0141 8.0141 8.0141 8.4771 8.4771 8.4771 8.4771 8.6721 8.6721 8.6721 8.6721 8.9294 8.9294 8.9294 8.9294 9.1480 9.1480 9.1480 9.1480 9.5395 9.5395 9.5395 9.5395 9.8141 9.8141 9.8141 9.8141 10.0254 10.0254 10.0254 10.0254 10.1540 10.1540 10.1540 10.1540 11.3022 11.3022 11.3022 11.3022 11.6701 11.6701 11.6701 11.6701 13.5041 13.5041 13.5041 13.5041 13.6058 13.6058 13.6058 13.6058 14.5381 14.5381 14.5381 14.5381 14.6549 14.6549 k = 0.5000 0.2488-0.0000 ( 8148 PWs) bands (ev): 2.6770 2.6770 2.6770 2.6770 2.7490 2.7490 2.7490 2.7490 5.9780 5.9780 5.9780 5.9780 6.0808 6.0808 6.0808 6.0808 7.4316 7.4316 7.4316 7.4316 7.5172 7.5172 7.5172 7.5172 7.9313 7.9313 7.9313 7.9313 8.0049 8.0049 8.0049 8.0049 8.4918 8.4918 8.4918 8.4918 8.6599 8.6599 8.6599 8.6599 8.9478 8.9478 8.9478 8.9478 9.1405 9.1405 9.1405 9.1405 9.5465 9.5465 9.5465 9.5465 9.8031 9.8031 9.8031 9.8031 10.0251 10.0251 10.0251 10.0251 10.1328 10.1328 10.1328 10.1328 11.3403 11.3403 11.3403 11.3403 11.6341 11.6341 11.6341 11.6341 13.5103 13.5103 13.5103 13.5103 13.5979 13.5979 13.5979 13.5979 14.5565 14.5565 14.5565 14.5565 14.6573 14.6573 k = 0.5000 0.2612-0.0000 ( 8160 PWs) bands (ev): 2.6859 2.6859 2.6859 2.6859 2.7414 2.7414 2.7414 2.7414 5.9764 5.9764 5.9764 5.9764 6.0745 6.0745 6.0745 6.0745 7.4445 7.4445 7.4445 7.4445 7.5093 7.5093 7.5093 7.5093 7.9386 7.9386 7.9386 7.9386 7.9955 7.9955 7.9955 7.9955 8.5046 8.5046 8.5046 8.5046 8.6490 8.6490 8.6490 8.6490 8.9658 8.9658 8.9658 8.9658 9.1318 9.1318 9.1318 9.1318 9.5525 9.5525 9.5525 9.5525 9.7938 9.7938 9.7938 9.7938 10.0269 10.0269 10.0269 10.0269 10.1137 10.1137 10.1137 10.1137 11.3780 11.3780 11.3780 11.3780 11.5981 11.5981 11.5981 11.5981 13.5165 13.5165 13.5165 13.5165 13.5904 13.5904 13.5904 13.5904 14.5739 14.5739 14.5739 14.5739 14.6557 14.6557 k = 0.5000 0.2736-0.0000 ( 8160 PWs) bands (ev): 2.6945 2.6945 2.6945 2.6945 2.7338 2.7338 2.7338 2.7338 5.9753 5.9753 5.9753 5.9753 6.0700 6.0700 6.0700 6.0700 7.4566 7.4566 7.4566 7.4566 7.5006 7.5006 7.5006 7.5006 7.9464 7.9464 7.9464 7.9464 7.9862 7.9862 7.9862 7.9862 8.5149 8.5149 8.5149 8.5149 8.6399 8.6399 8.6399 8.6399 8.9818 8.9818 8.9818 8.9818 9.1228 9.1228 9.1228 9.1228 9.5571 9.5571 9.5571 9.5571 9.7866 9.7866 9.7866 9.7866 10.0303 10.0303 10.0303 10.0303 10.0977 10.0977 10.0977 10.0977 11.4154 11.4154 11.4154 11.4154 11.5621 11.5621 11.5621 11.5621 13.5223 13.5223 13.5223 13.5223 13.5838 13.5838 13.5838 13.5838 14.5894 14.5894 14.5894 14.5894 14.6511 14.6511 k = 0.5000 0.2861-0.0000 ( 8168 PWs) bands (ev): 2.7021 2.7021 2.7021 2.7021 2.7269 2.7269 2.7269 2.7269 5.9746 5.9746 5.9746 5.9746 6.0672 6.0672 6.0672 6.0672 7.4679 7.4679 7.4679 7.4679 7.4914 7.4914 7.4914 7.4914 7.9542 7.9542 7.9542 7.9542 7.9775 7.9775 7.9775 7.9775 8.5217 8.5217 8.5217 8.5217 8.6338 8.6338 8.6338 8.6338 8.9933 8.9933 8.9933 8.9933 9.1157 9.1157 9.1157 9.1157 9.5601 9.5601 9.5601 9.5601 9.7821 9.7821 9.7821 9.7821 10.0343 10.0343 10.0343 10.0343 10.0860 10.0860 10.0860 10.0860 11.4524 11.4524 11.4524 11.4524 11.5258 11.5258 11.5258 11.5258 13.5267 13.5267 13.5267 13.5267 13.5790 13.5790 13.5790 13.5790 14.6017 14.6017 14.6017 14.6017 14.6453 14.6453 k = 0.5000 0.2985-0.0000 ( 8160 PWs) bands (ev): 2.7059 2.7059 2.7059 2.7059 2.7233 2.7233 2.7233 2.7233 5.9744 5.9744 5.9744 5.9744 6.0663 6.0663 6.0663 6.0663 7.4753 7.4753 7.4753 7.4753 7.4847 7.4847 7.4847 7.4847 7.9589 7.9589 7.9589 7.9589 7.9726 7.9726 7.9726 7.9726 8.5242 8.5242 8.5242 8.5242 8.6315 8.6315 8.6315 8.6315 8.9977 8.9977 8.9977 8.9977 9.1128 9.1128 9.1128 9.1128 9.5612 9.5612 9.5612 9.5612 9.7805 9.7805 9.7805 9.7805 10.0362 10.0362 10.0362 10.0362 10.0815 10.0815 10.0815 10.0815 11.4862 11.4862 11.4862 11.4862 11.4923 11.4923 11.4923 11.4923 13.5283 13.5283 13.5283 13.5283 13.5772 13.5772 13.5772 13.5772 14.6070 14.6070 14.6070 14.6071 14.6421 14.6421 k = 0.5000 0.2985-0.0000 ( 8160 PWs) bands (ev): 2.7059 2.7059 2.7059 2.7059 2.7233 2.7233 2.7233 2.7233 5.9744 5.9744 5.9744 5.9744 6.0663 6.0663 6.0663 6.0663 7.4753 7.4753 7.4753 7.4753 7.4847 7.4847 7.4847 7.4847 7.9589 7.9589 7.9589 7.9589 7.9726 7.9726 7.9726 7.9726 8.5242 8.5242 8.5242 8.5242 8.6315 8.6315 8.6315 8.6315 8.9977 8.9977 8.9977 8.9977 9.1128 9.1128 9.1128 9.1128 9.5612 9.5612 9.5612 9.5612 9.7805 9.7805 9.7805 9.7805 10.0362 10.0362 10.0362 10.0362 10.0815 10.0815 10.0815 10.0815 11.4862 11.4862 11.4862 11.4862 11.4923 11.4923 11.4923 11.4923 13.5283 13.5283 13.5283 13.5283 13.5772 13.5772 13.5772 13.5772 14.6070 14.6070 14.6070 14.6070 14.6421 14.6421 k = 0.4875 0.2985-0.0000 ( 8154 PWs) bands (ev): 2.6796 2.6796 2.6949 2.6949 2.7301 2.7301 2.7496 2.7496 5.9594 5.9594 5.9913 5.9913 6.0542 6.0542 6.0798 6.0798 7.4653 7.4653 7.4786 7.4786 7.4842 7.4842 7.4896 7.4896 7.9432 7.9432 7.9485 7.9485 7.9715 7.9715 7.9939 7.9939 8.4961 8.4961 8.5523 8.5523 8.5945 8.5945 8.6645 8.6645 8.9525 8.9525 9.0469 9.0469 9.0841 9.0841 9.1332 9.1332 9.5370 9.5370 9.5969 9.5969 9.7370 9.7370 9.8255 9.8255 10.0075 10.0075 10.0584 10.0584 10.0699 10.0699 10.1111 10.1111 11.4694 11.4694 11.4759 11.4759 11.5045 11.5045 11.5109 11.5109 13.4982 13.4982 13.5509 13.5509 13.5555 13.5555 13.6006 13.6006 14.5789 14.5789 14.6139 14.6139 14.6345 14.6345 k = 0.4750 0.2985-0.0000 ( 8150 PWs) bands (ev): 2.6513 2.6513 2.6645 2.6645 2.7521 2.7521 2.7738 2.7738 5.9466 5.9466 6.0100 6.0100 6.0437 6.0437 6.0946 6.0946 7.4543 7.4543 7.4715 7.4715 7.4921 7.4921 7.4934 7.4934 7.9223 7.9223 7.9243 7.9243 7.9813 7.9813 8.0115 8.0115 8.4689 8.4689 8.5546 8.5546 8.5800 8.5800 8.6927 8.6927 8.9121 8.9121 9.0496 9.0496 9.0991 9.0991 9.1435 9.1435 9.5252 9.5252 9.6420 9.6420 9.6975 9.6975 9.8674 9.8674 9.9847 9.9847 10.0460 10.0460 10.1079 10.1079 10.1453 10.1453 11.4544 11.4544 11.4619 11.4619 11.5243 11.5243 11.5316 11.5316 13.4655 13.4655 13.5221 13.5221 13.5794 13.5794 13.6206 13.6206 14.5503 14.5503 14.5858 14.5858 14.6607 14.6607 k = 0.4625 0.2985-0.0000 ( 8158 PWs) bands (ev): 2.6210 2.6210 2.6323 2.6323 2.7719 2.7719 2.7958 2.7958 5.9360 5.9360 6.0301 6.0301 6.0350 6.0350 6.1102 6.1102 7.4425 7.4425 7.4633 7.4633 7.4959 7.4959 7.4987 7.4987 7.8948 7.8948 7.9019 7.9019 7.9888 7.9888 8.0246 8.0246 8.4433 8.4433 8.5133 8.5133 8.6067 8.6067 8.7152 8.7152 8.8769 8.8769 9.0120 9.0120 9.1442 9.1442 9.1522 9.1522 9.5244 9.5244 9.6637 9.6637 9.6932 9.6932 9.8983 9.8983 9.9692 9.9692 10.0523 10.0523 10.1501 10.1501 10.1831 10.1831 11.4413 11.4413 11.4504 11.4504 11.5454 11.5454 11.5542 11.5542 13.4307 13.4307 13.4911 13.4911 13.5997 13.5997 13.6371 13.6371 14.5218 14.5218 14.5579 14.5579 14.6854 14.6854 k = 0.4500 0.2985-0.0000 ( 8166 PWs) bands (ev): 2.5890 2.5890 2.5984 2.5984 2.7895 2.7895 2.8155 2.8155 5.9276 5.9276 6.0282 6.0282 6.0514 6.0514 6.1263 6.1263 7.4299 7.4299 7.4539 7.4539 7.4970 7.4970 7.5040 7.5040 7.8667 7.8667 7.8759 7.8759 7.9943 7.9943 8.0321 8.0321 8.4204 8.4204 8.4720 8.4720 8.6323 8.6323 8.7311 8.7311 8.8478 8.8478 8.9735 8.9735 9.1374 9.1374 9.2032 9.2032 9.5311 9.5311 9.6375 9.6375 9.7465 9.7465 9.9125 9.9125 9.9637 9.9637 10.0827 10.0827 10.1964 10.1964 10.2241 10.2241 11.4301 11.4301 11.4414 11.4414 11.5679 11.5679 11.5785 11.5785 13.3942 13.3942 13.4584 13.4584 13.6161 13.6161 13.6498 13.6498 14.4936 14.4936 14.5307 14.5307 14.7082 14.7082 k = 0.4375 0.2985-0.0000 ( 8178 PWs) bands (ev): 2.5553 2.5553 2.5629 2.5629 2.8048 2.8048 2.8329 2.8329 5.9216 5.9216 6.0233 6.0233 6.0736 6.0736 6.1425 6.1425 7.4167 7.4167 7.4434 7.4434 7.4967 7.4967 7.5080 7.5080 7.8387 7.8387 7.8464 7.8464 7.9981 7.9981 8.0334 8.0334 8.4013 8.4013 8.4318 8.4318 8.6565 8.6565 8.7378 8.7378 8.8274 8.8274 8.9359 8.9359 9.1261 9.1261 9.2484 9.2484 9.5413 9.5413 9.6212 9.6212 9.7967 9.7967 9.9163 9.9163 9.9722 9.9722 10.1305 10.1305 10.2469 10.2469 10.2682 10.2682 11.4209 11.4209 11.4351 11.4351 11.5915 11.5915 11.6046 11.6046 13.3564 13.3564 13.4245 13.4245 13.6285 13.6285 13.6586 13.6586 14.4659 14.4659 14.5044 14.5044 14.7288 14.7288 k = 0.4250 0.2985-0.0000 ( 8182 PWs) bands (ev): 2.5201 2.5201 2.5261 2.5261 2.8178 2.8178 2.8480 2.8480 5.9178 5.9178 6.0204 6.0204 6.0961 6.0961 6.1584 6.1584 7.4028 7.4028 7.4316 7.4316 7.4949 7.4949 7.5104 7.5104 7.8116 7.8116 7.8140 7.8140 8.0005 8.0005 8.0280 8.0280 8.3866 8.3866 8.3936 8.3936 8.6790 8.6790 8.7326 8.7326 8.8188 8.8188 8.9003 8.9003 9.1129 9.1129 9.2837 9.2837 9.5515 9.5515 9.6169 9.6169 9.8381 9.8381 9.9190 9.9190 9.9991 9.9991 10.1860 10.1860 10.3017 10.3017 10.3159 10.3159 11.4139 11.4139 11.4313 11.4313 11.6162 11.6162 11.6321 11.6321 13.3178 13.3178 13.3896 13.3896 13.6369 13.6369 13.6635 13.6635 14.4389 14.4389 14.4790 14.4790 14.7470 14.7470 k = 0.4125 0.2985-0.0000 ( 8162 PWs) bands (ev): 2.4836 2.4836 2.4880 2.4880 2.8287 2.8287 2.8608 2.8608 5.9163 5.9163 6.0195 6.0195 6.1185 6.1185 6.1734 6.1734 7.3884 7.3884 7.4184 7.4184 7.4917 7.4917 7.5114 7.5114 7.7791 7.7791 7.7860 7.7860 8.0020 8.0020 8.0160 8.0160 8.3576 8.3576 8.3766 8.3766 8.6994 8.6994 8.7177 8.7177 8.8198 8.8198 8.8677 8.8677 9.0999 9.0999 9.3064 9.3064 9.5596 9.5596 9.6251 9.6251 9.8696 9.8696 9.9260 9.9260 10.0440 10.0440 10.2428 10.2428 10.3608 10.3608 10.3685 10.3685 11.4091 11.4091 11.4302 11.4302 11.6419 11.6419 11.6609 11.6609 13.2789 13.2789 13.3543 13.3543 13.6414 13.6414 13.6647 13.6647 14.4125 14.4125 14.4545 14.4545 14.7629 14.7629 k = 0.4000 0.2985-0.0000 ( 8152 PWs) bands (ev): 2.4459 2.4459 2.4489 2.4489 2.8374 2.8374 2.8714 2.8714 5.9168 5.9168 6.0204 6.0204 6.1403 6.1403 6.1871 6.1871 7.3735 7.3735 7.4036 7.4036 7.4872 7.4872 7.5109 7.5109 7.7429 7.7429 7.7626 7.7626 7.9982 7.9982 8.0025 8.0025 8.3242 8.3242 8.3711 8.3711 8.6987 8.6987 8.7173 8.7173 8.8253 8.8253 8.8390 8.8390 9.0882 9.0882 9.3171 9.3171 9.5647 9.5647 9.6427 9.6427 9.8957 9.8957 9.9405 9.9405 10.1006 10.1006 10.2974 10.2974 10.4243 10.4243 10.4271 10.4271 11.4065 11.4065 11.4315 11.4315 11.6685 11.6685 11.6910 11.6910 13.2399 13.2399 13.3190 13.3190 13.6423 13.6423 13.6625 13.6625 14.3867 14.3867 14.4308 14.4308 14.7763 14.7763 k = 0.3875 0.2985-0.0000 ( 8156 PWs) bands (ev): 2.4072 2.4072 2.4089 2.4089 2.8441 2.8441 2.8797 2.8797 5.9193 5.9193 6.0230 6.0230 6.1609 6.1609 6.1991 6.1991 7.3583 7.3583 7.3871 7.3871 7.4816 7.4816 7.5089 7.5089 7.7063 7.7063 7.7416 7.7416 7.9759 7.9759 8.0023 8.0023 8.2934 8.2934 8.3695 8.3695 8.6790 8.6790 8.7314 8.7314 8.8151 8.8151 8.8323 8.8323 9.0792 9.0792 9.3194 9.3194 9.5670 9.5670 9.6642 9.6642 9.9203 9.9203 9.9641 9.9641 10.1626 10.1626 10.3478 10.3478 10.4915 10.4915 10.4919 10.4919 11.4060 11.4060 11.4352 11.4352 11.6961 11.6961 11.7221 11.7221 13.2015 13.2015 13.2841 13.2841 13.6399 13.6399 13.6573 13.6573 14.3614 14.3614 14.4077 14.4077 14.7875 14.7875 k = 0.3750 0.2985-0.0000 ( 8160 PWs) bands (ev): 2.3676 2.3676 2.3681 2.3681 2.8487 2.8487 2.8860 2.8860 5.9235 5.9235 6.0271 6.0271 6.1797 6.1797 6.2089 6.2089 7.3427 7.3427 7.3690 7.3690 7.4754 7.4754 7.5055 7.5055 7.6707 7.6707 7.7232 7.7232 7.9505 7.9505 8.0010 8.0010 8.2653 8.2653 8.3710 8.3710 8.6600 8.6600 8.7389 8.7389 8.7987 8.7987 8.8396 8.8396 9.0734 9.0734 9.3173 9.3173 9.5673 9.5673 9.6848 9.6848 9.9449 9.9449 9.9968 9.9968 10.2269 10.2269 10.3941 10.3941 10.5618 10.5618 10.5619 10.5619 11.4075 11.4075 11.4409 11.4409 11.7246 11.7246 11.7542 11.7542 13.1640 13.1640 13.2499 13.2499 13.6349 13.6349 13.6497 13.6497 14.3365 14.3365 14.3852 14.3852 14.7965 14.7965 k = 0.3625 0.2985-0.0000 ( 8144 PWs) bands (ev): 2.3269 2.3269 2.3275 2.3275 2.8516 2.8516 2.8901 2.8901 5.9291 5.9291 6.0325 6.0325 6.1964 6.1964 6.2162 6.2162 7.3267 7.3267 7.3493 7.3493 7.4691 7.4691 7.5007 7.5007 7.6371 7.6371 7.7075 7.7075 7.9231 7.9231 7.9984 7.9984 8.2401 8.2401 8.3751 8.3751 8.6424 8.6424 8.7366 8.7366 8.7926 8.7926 8.8467 8.8467 9.0717 9.0717 9.3136 9.3136 9.5665 9.5665 9.7027 9.7027 9.9692 9.9692 10.0368 10.0368 10.2920 10.2920 10.4374 10.4374 10.6344 10.6344 10.6352 10.6352 11.4107 11.4107 11.4482 11.4482 11.7539 11.7539 11.7872 11.7872 13.1277 13.1277 13.2167 13.2167 13.6280 13.6280 13.6402 13.6402 14.3118 14.3118 14.3629 14.3629 14.8036 14.8036 k = 0.3500 0.2985-0.0000 ( 8144 PWs) bands (ev): 2.2853 2.2853 2.2869 2.2869 2.8526 2.8526 2.8924 2.8924 5.9359 5.9359 6.0385 6.0385 6.2104 6.2104 6.2210 6.2210 7.3103 7.3103 7.3280 7.3280 7.4631 7.4631 7.4947 7.4947 7.6070 7.6070 7.6941 7.6941 7.8950 7.8950 7.9938 7.9938 8.2184 8.2184 8.3812 8.3812 8.6266 8.6266 8.7268 8.7268 8.7941 8.7941 8.8535 8.8535 9.0745 9.0745 9.3103 9.3103 9.5651 9.5651 9.7176 9.7176 9.9930 9.9930 10.0810 10.0810 10.3572 10.3572 10.4788 10.4788 10.7077 10.7077 10.7103 10.7103 11.4154 11.4154 11.4568 11.4568 11.7842 11.7842 11.8209 11.8209 13.0932 13.0932 13.1850 13.1850 13.6197 13.6197 13.6295 13.6295 14.2875 14.2875 14.3408 14.3408 14.8089 14.8089 k = 0.3375 0.2985-0.0000 ( 8172 PWs) bands (ev): 2.2436 2.2436 2.2460 2.2460 2.8520 2.8520 2.8928 2.8928 5.9433 5.9433 6.0446 6.0446 6.2216 6.2216 6.2235 6.2235 7.2930 7.2930 7.3051 7.3051 7.4579 7.4579 7.4876 7.4876 7.5812 7.5812 7.6829 7.6829 7.8671 7.8671 7.9867 7.9867 8.2007 8.2007 8.3892 8.3892 8.6128 8.6128 8.7150 8.7150 8.7976 8.7976 8.8599 8.8599 9.0819 9.0819 9.3083 9.3083 9.5639 9.5639 9.7303 9.7303 10.0156 10.0156 10.1263 10.1263 10.4223 10.4223 10.5194 10.5194 10.7806 10.7806 10.7857 10.7857 11.4211 11.4211 11.4663 11.4663 11.8154 11.8154 11.8553 11.8553 13.0608 13.0608 13.1549 13.1549 13.6108 13.6108 13.6180 13.6180 14.2636 14.2636 14.3191 14.3191 14.8126 14.8126 k = 0.3250 0.2985-0.0000 ( 8174 PWs) bands (ev): 2.2019 2.2019 2.2050 2.2050 2.8500 2.8500 2.8915 2.8915 5.9508 5.9508 6.0499 6.0499 6.2245 6.2245 6.2299 6.2299 7.2746 7.2746 7.2808 7.2808 7.4539 7.4539 7.4794 7.4794 7.5609 7.5609 7.6733 7.6733 7.8401 7.8401 7.9767 7.9767 8.1874 8.1874 8.3988 8.3988 8.6013 8.6013 8.7037 8.7037 8.8007 8.8007 8.8661 8.8661 9.0938 9.0938 9.3084 9.3084 9.5630 9.5630 9.7420 9.7420 10.0369 10.0369 10.1701 10.1701 10.4872 10.4872 10.5603 10.5603 10.8517 10.8517 10.8601 10.8601 11.4276 11.4276 11.4761 11.4761 11.8476 11.8476 11.8902 11.8902 13.0308 13.0308 13.1267 13.1267 13.6019 13.6019 13.6063 13.6063 14.2407 14.2407 14.2978 14.2978 14.8150 14.8150 k = 0.3125 0.2985-0.0000 ( 8164 PWs) bands (ev): 2.1604 2.1604 2.1641 2.1641 2.8465 2.8465 2.8886 2.8886 5.9578 5.9578 6.0530 6.0530 6.2251 6.2251 6.2358 6.2358 7.2549 7.2549 7.2551 7.2551 7.4513 7.4513 7.4704 7.4704 7.5466 7.5466 7.6651 7.6651 7.8146 7.8146 7.9638 7.9638 8.1785 8.1785 8.4100 8.4100 8.5921 8.5921 8.6936 8.6936 8.8031 8.8031 8.8721 8.8721 9.1097 9.1097 9.3105 9.3105 9.5628 9.5628 9.7531 9.7531 10.0567 10.0567 10.2102 10.2102 10.5517 10.5517 10.6021 10.6021 10.9196 10.9196 10.9322 10.9322 11.4346 11.4346 11.4858 11.4858 11.8809 11.8809 11.9255 11.9255 13.0033 13.0033 13.1005 13.1005 13.5937 13.5937 13.5948 13.5948 14.2192 14.2192 14.2775 14.2775 14.8162 14.8162 k = 0.3000 0.2985-0.0000 ( 8180 PWs) bands (ev): 2.1192 2.1192 2.1235 2.1235 2.8419 2.8419 2.8843 2.8843 5.9633 5.9633 6.0526 6.0526 6.2270 6.2270 6.2400 6.2400 7.2279 7.2279 7.2337 7.2337 7.4501 7.4501 7.4605 7.4605 7.5384 7.5384 7.6577 7.6577 7.7913 7.7913 7.9483 7.9483 8.1737 8.1737 8.4227 8.4227 8.5854 8.5854 8.6848 8.6848 8.8054 8.8054 8.8782 8.8782 9.1288 9.1288 9.3148 9.3148 9.5633 9.5633 9.7643 9.7643 10.0750 10.0750 10.2452 10.2452 10.6155 10.6155 10.6453 10.6453 10.9830 10.9830 11.0008 11.0008 11.4419 11.4419 11.4954 11.4954 11.9153 11.9153 11.9611 11.9611 12.9787 12.9787 13.0764 13.0764 13.5834 13.5834 13.5864 13.5864 14.2000 14.2000 14.2588 14.2588 14.8164 14.8164 k = 0.2875 0.2985-0.0000 ( 8180 PWs) bands (ev): 2.0785 2.0785 2.0832 2.0832 2.8362 2.8362 2.8787 2.8787 5.9664 5.9664 6.0471 6.0471 6.2316 6.2316 6.2435 6.2435 7.1995 7.1995 7.2111 7.2111 7.4501 7.4501 7.4502 7.4502 7.5358 7.5358 7.6505 7.6505 7.7707 7.7707 7.9313 7.9313 8.1723 8.1723 8.4367 8.4367 8.5812 8.5812 8.6772 8.6772 8.8085 8.8085 8.8848 8.8848 9.1506 9.1506 9.3209 9.3209 9.5646 9.5646 9.7760 9.7760 10.0921 10.0921 10.2745 10.2745 10.6785 10.6785 10.6897 10.6897 11.0404 11.0404 11.0645 11.0645 11.4500 11.4500 11.5048 11.5048 11.9508 11.9508 11.9969 11.9969 12.9568 12.9568 13.0544 13.0544 13.5721 13.5721 13.5801 13.5801 14.1841 14.1841 14.2425 14.2425 14.8160 14.8160 k = 0.2750 0.2985-0.0000 ( 8172 PWs) bands (ev): 2.0385 2.0385 2.0436 2.0436 2.8295 2.8295 2.8719 2.8719 5.9660 5.9660 6.0360 6.0360 6.2401 6.2401 6.2475 6.2475 7.1698 7.1698 7.1873 7.1873 7.4390 7.4390 7.4512 7.4512 7.5378 7.5378 7.6430 7.6430 7.7536 7.7536 7.9138 7.9138 8.1737 8.1737 8.4516 8.4516 8.5795 8.5795 8.6705 8.6705 8.8133 8.8133 8.8920 8.8920 9.1744 9.1744 9.3284 9.3284 9.5668 9.5668 9.7883 9.7883 10.1080 10.1080 10.2982 10.2982 10.7346 10.7346 10.7402 10.7402 11.0904 11.0904 11.1217 11.1217 11.4596 11.4596 11.5147 11.5147 11.9874 11.9874 12.0327 12.0327 12.9376 12.9376 13.0345 13.0345 13.5606 13.5606 13.5747 13.5747 14.1725 14.1725 14.2296 14.2296 14.8150 14.8150 k = 0.2625 0.2985-0.0000 ( 8170 PWs) bands (ev): 1.9993 1.9993 2.0046 2.0046 2.8221 2.8221 2.8642 2.8642 5.9615 5.9615 6.0195 6.0195 6.2526 6.2526 6.2531 6.2531 7.1392 7.1392 7.1627 7.1627 7.4275 7.4275 7.4525 7.4525 7.5433 7.5433 7.6343 7.6343 7.7407 7.7407 7.8969 7.8969 8.1773 8.1773 8.4671 8.4671 8.5801 8.5801 8.6650 8.6650 8.8203 8.8203 8.9005 8.9005 9.1996 9.1996 9.3371 9.3371 9.5698 9.5698 9.8014 9.8014 10.1231 10.1231 10.3167 10.3167 10.7789 10.7789 10.8002 10.8002 11.1314 11.1314 11.1709 11.1709 11.4717 11.4717 11.5256 11.5256 12.0250 12.0250 12.0683 12.0683 12.9209 12.9209 13.0165 13.0165 13.5484 13.5484 13.5698 13.5698 14.1664 14.1664 14.2214 14.2214 14.8138 14.8138 k = 0.2500 0.2985-0.0000 ( 8170 PWs) bands (ev): 1.9610 1.9610 1.9665 1.9665 2.8140 2.8140 2.8555 2.8555 5.9524 5.9524 5.9985 5.9985 6.2614 6.2614 6.2686 6.2686 7.1079 7.1079 7.1377 7.1377 7.4154 7.4154 7.4537 7.4537 7.5507 7.5507 7.6239 7.6239 7.7325 7.7325 7.8815 7.8815 8.1825 8.1825 8.4824 8.4824 8.5830 8.5830 8.6610 8.6610 8.8299 8.8299 8.9104 8.9104 9.2257 9.2257 9.3464 9.3464 9.5737 9.5737 9.8154 9.8154 10.1375 10.1375 10.3306 10.3306 10.8211 10.8211 10.8578 10.8578 11.1625 11.1625 11.2110 11.2110 11.4876 11.4876 11.5386 11.5386 12.0636 12.0636 12.1036 12.1036 12.9065 12.9065 13.0003 13.0003 13.5348 13.5348 13.5645 13.5645 14.1669 14.1669 14.2190 14.2190 14.8124 14.8124 k = 0.2375 0.2985-0.0000 ( 8172 PWs) bands (ev): 1.9238 1.9238 1.9295 1.9295 2.8055 2.8055 2.8462 2.8462 5.9388 5.9388 5.9741 5.9741 6.2725 6.2725 6.2874 6.2874 7.0760 7.0760 7.1127 7.1127 7.4030 7.4030 7.4541 7.4541 7.5583 7.5583 7.6119 7.6119 7.7289 7.7289 7.8687 7.8687 8.1891 8.1891 8.4965 8.4965 8.5881 8.5881 8.6594 8.6594 8.8424 8.8424 8.9221 8.9221 9.2524 9.2524 9.3560 9.3560 9.5786 9.5786 9.8303 9.8303 10.1517 10.1517 10.3407 10.3407 10.8593 10.8593 10.9120 10.9120 11.1835 11.1835 11.2420 11.2420 11.5077 11.5077 11.5543 11.5543 12.1030 12.1030 12.1385 12.1385 12.8942 12.8942 12.9859 12.9859 13.5192 13.5192 13.5579 13.5579 14.1747 14.1747 14.2232 14.2232 14.8109 14.8109 k = 0.2250 0.2985-0.0000 ( 8176 PWs) bands (ev): 1.8878 1.8878 1.8935 1.8935 2.7965 2.7965 2.8363 2.8363 5.9211 5.9211 5.9474 5.9474 6.2865 6.2865 6.3085 6.3085 7.0439 7.0439 7.0880 7.0880 7.3901 7.3901 7.4533 7.4533 7.5647 7.5647 7.5989 7.5989 7.7294 7.7294 7.8593 7.8593 8.1970 8.1970 8.5080 8.5080 8.5952 8.5952 8.6613 8.6613 8.8576 8.8576 8.9359 8.9359 9.2793 9.2793 9.3655 9.3655 9.5845 9.5845 9.8460 9.8460 10.1658 10.1658 10.3479 10.3479 10.8917 10.8917 10.9610 10.9610 11.1958 11.1958 11.2658 11.2658 11.5313 11.5313 11.5725 11.5725 12.1430 12.1430 12.1731 12.1731 12.8836 12.8836 12.9732 12.9732 13.5014 13.5014 13.5493 13.5493 14.1900 14.1900 14.2346 14.2346 14.8094 14.8094 k = 0.2125 0.2985-0.0000 ( 8188 PWs) bands (ev): 1.8531 1.8531 1.8588 1.8588 2.7874 2.7874 2.8260 2.8260 5.9003 5.9003 5.9190 5.9190 6.3029 6.3029 6.3315 6.3315 7.0119 7.0119 7.0639 7.0639 7.3768 7.3768 7.4509 7.4509 7.5687 7.5687 7.5855 7.5855 7.7331 7.7331 7.8539 7.8539 8.2059 8.2059 8.5157 8.5157 8.6040 8.6040 8.6677 8.6677 8.8755 8.8755 8.9519 8.9519 9.3061 9.3061 9.3748 9.3748 9.5915 9.5915 9.8623 9.8623 10.1799 10.1799 10.3528 10.3528 10.9161 10.9161 11.0017 11.0017 11.2036 11.2036 11.2857 11.2857 11.5568 11.5568 11.5922 11.5922 12.1833 12.1833 12.2073 12.2073 12.8747 12.8747 12.9621 12.9621 13.4812 13.4812 13.5379 13.5379 14.2126 14.2126 14.2530 14.2530 14.8078 14.8079 k = 0.2000 0.2985-0.0000 ( 8186 PWs) bands (ev): 1.8199 1.8199 1.8255 1.8255 2.7781 2.7781 2.8154 2.8154 5.8772 5.8772 5.8899 5.8899 6.3212 6.3212 6.3558 6.3558 6.9803 6.9803 7.0406 7.0406 7.3631 7.3631 7.4463 7.4463 7.5695 7.5695 7.5725 7.5725 7.7393 7.7393 7.8524 7.8524 8.2160 8.2160 8.5192 8.5192 8.6146 8.6146 8.6788 8.6788 8.8956 8.8956 8.9702 8.9702 9.3325 9.3325 9.3836 9.3836 9.5998 9.5998 9.8790 9.8790 10.1943 10.1943 10.3559 10.3559 10.9309 10.9309 11.0290 11.0290 11.2133 11.2133 11.3048 11.3048 11.5821 11.5821 11.6122 11.6122 12.2237 12.2237 12.2412 12.2412 12.8674 12.8674 12.9527 12.9527 13.4590 13.4590 13.5237 13.5237 14.2416 14.2416 14.2774 14.2774 14.8062 14.8063 k = 0.1875 0.2985-0.0000 ( 8192 PWs) bands (ev): 1.7881 1.7881 1.7936 1.7936 2.7689 2.7689 2.8047 2.8047 5.8525 5.8525 5.8607 5.8607 6.3409 6.3409 6.3811 6.3811 6.9491 6.9491 7.0184 7.0184 7.3489 7.3489 7.4395 7.4395 7.5603 7.5603 7.5673 7.5673 7.7473 7.7473 7.8543 7.8543 8.2270 8.2270 8.5189 8.5189 8.6268 8.6268 8.6940 8.6940 8.9177 8.9177 8.9906 8.9906 9.3584 9.3584 9.3921 9.3921 9.6095 9.6095 9.8956 9.8956 10.2091 10.2091 10.3580 10.3580 10.9356 10.9356 11.0376 11.0376 11.2316 11.2316 11.3255 11.3255 11.6059 11.6059 11.6313 11.6313 12.2636 12.2636 12.2747 12.2747 12.8617 12.8617 12.9450 12.9450 13.4353 13.4353 13.5068 13.5068 14.2756 14.2756 14.3059 14.3059 14.8047 14.8048 k = 0.1750 0.2985-0.0000 ( 8200 PWs) bands (ev): 1.7580 1.7580 1.7634 1.7634 2.7598 2.7598 2.7939 2.7939 5.8271 5.8271 5.8317 5.8317 6.3616 6.3616 6.4073 6.4073 6.9188 6.9188 6.9973 6.9973 7.3344 7.3344 7.4303 7.4303 7.5493 7.5493 7.5624 7.5624 7.7566 7.7566 7.8588 7.8588 8.2389 8.2389 8.5158 8.5158 8.6403 8.6403 8.7119 8.7119 8.9414 8.9414 9.0128 9.0128 9.3834 9.3834 9.4002 9.4002 9.6209 9.6209 9.9116 9.9116 10.2243 10.2243 10.3594 10.3594 10.9307 10.9307 11.0281 11.0281 11.2596 11.2596 11.3483 11.3483 11.6273 11.6273 11.6485 11.6485 12.3025 12.3025 12.3075 12.3075 12.8577 12.8577 12.9392 12.9392 13.4107 13.4107 13.4877 13.4877 14.3129 14.3129 14.3360 14.3360 14.8036 14.8038 k = 0.1625 0.2985-0.0000 ( 8198 PWs) bands (ev): 1.7296 1.7296 1.7348 1.7348 2.7509 2.7509 2.7832 2.7832 5.8015 5.8015 5.8034 5.8034 6.3827 6.3827 6.4340 6.4340 6.8895 6.8895 6.9777 6.9777 7.3195 7.3195 7.4189 7.4189 7.5397 7.5397 7.5556 7.5556 7.7667 7.7667 7.8648 7.8648 8.2517 8.2517 8.5107 8.5107 8.6552 8.6552 8.7314 8.7314 8.9662 8.9662 9.0367 9.0367 9.4074 9.4074 9.4082 9.4082 9.6341 9.6341 9.9265 9.9265 10.2398 10.2398 10.3606 10.3606 10.9178 10.9178 11.0058 11.0058 11.2931 11.2931 11.3726 11.3726 11.6461 11.6461 11.6632 11.6632 12.3394 12.3394 12.3397 12.3397 12.8555 12.8555 12.9353 12.9353 13.3863 13.3863 13.4673 13.4673 14.3513 14.3513 14.3647 14.3647 14.8037 14.8038 k = 0.1500 0.2985-0.0000 ( 8198 PWs) bands (ev): 1.7030 1.7030 1.7079 1.7079 2.7424 2.7424 2.7728 2.7728 5.7762 5.7762 5.7763 5.7763 6.4038 6.4038 6.4611 6.4611 6.8613 6.8613 6.9595 6.9595 7.3044 7.3044 7.4055 7.4055 7.5314 7.5314 7.5477 7.5477 7.7773 7.7773 7.8712 7.8712 8.2651 8.2651 8.5045 8.5045 8.6713 8.6713 8.7513 8.7513 8.9917 8.9917 9.0615 9.0615 9.4164 9.4164 9.4302 9.4302 9.6493 9.6493 9.9398 9.9398 10.2557 10.2557 10.3620 10.3620 10.8988 10.8988 10.9756 10.9756 11.3282 11.3282 11.3973 11.3973 11.6624 11.6624 11.6754 11.6754 12.3697 12.3697 12.3743 12.3743 12.8555 12.8555 12.9332 12.9332 13.3628 13.3628 13.4464 13.4464 14.3882 14.3882 14.3892 14.3892 14.8061 14.8062 k = 0.1375 0.2985-0.0000 ( 8202 PWs) bands (ev): 1.6783 1.6783 1.6829 1.6829 2.7343 2.7343 2.7626 2.7626 5.7504 5.7504 5.7518 5.7518 6.4247 6.4247 6.4883 6.4883 6.8346 6.8346 6.9428 6.9428 7.2893 7.2893 7.3905 7.3905 7.5242 7.5242 7.5394 7.5394 7.7881 7.7881 7.8774 7.8774 8.2789 8.2789 8.4977 8.4977 8.6883 8.6883 8.7707 8.7707 9.0173 9.0173 9.0868 9.0868 9.4250 9.4250 9.4518 9.4518 9.6664 9.6664 9.9506 9.9506 10.2716 10.2716 10.3639 10.3639 10.8754 10.8754 10.9410 10.9410 11.3623 11.3623 11.4208 11.4208 11.6768 11.6768 11.6853 11.6853 12.3979 12.3979 12.4058 12.4058 12.8576 12.8576 12.9330 12.9330 13.3414 13.3414 13.4258 13.4258 14.4074 14.4074 14.4211 14.4211 14.8125 14.8125 k = 0.1250 0.2985-0.0000 ( 8194 PWs) bands (ev): 1.6555 1.6555 1.6598 1.6598 2.7268 2.7268 2.7529 2.7529 5.7262 5.7262 5.7286 5.7286 6.4450 6.4450 6.5153 6.5153 6.8094 6.8094 6.9276 6.9276 7.2744 7.2744 7.3743 7.3743 7.5179 7.5179 7.5311 7.5311 7.7988 7.7988 7.8829 7.8829 8.2928 8.2928 8.4905 8.4905 8.7059 8.7059 8.7891 8.7891 9.0428 9.0428 9.1117 9.1117 9.4347 9.4347 9.4722 9.4722 9.6850 9.6850 9.9585 9.9585 10.2875 10.2875 10.3665 10.3665 10.8495 10.8495 10.9041 10.9041 11.3940 11.3940 11.4421 11.4421 11.6897 11.6897 11.6934 11.6934 12.4234 12.4234 12.4333 12.4333 12.8620 12.8620 12.9342 12.9342 13.3231 13.3231 13.4064 13.4064 14.4184 14.4184 14.4472 14.4472 14.8245 14.8245 k = 0.1125 0.2985-0.0000 ( 8178 PWs) bands (ev): 1.6348 1.6348 1.6387 1.6387 2.7198 2.7198 2.7436 2.7436 5.7038 5.7038 5.7068 5.7068 6.4644 6.4644 6.5419 6.5419 6.7861 6.7861 6.9137 6.9137 7.2600 7.2600 7.3573 7.3573 7.5124 7.5124 7.5233 7.5233 7.8093 7.8093 7.8874 7.8874 8.3068 8.3068 8.4832 8.4832 8.7240 8.7240 8.8058 8.8058 9.0675 9.0675 9.1354 9.1354 9.4460 9.4460 9.4916 9.4916 9.7049 9.7049 9.9630 9.9630 10.3030 10.3030 10.3699 10.3699 10.8225 10.8225 10.8665 10.8665 11.4222 11.4222 11.4601 11.4601 11.7004 11.7004 11.7019 11.7019 12.4454 12.4454 12.4565 12.4565 12.8685 12.8685 12.9363 12.9363 13.3088 13.3088 13.3891 13.3891 14.4227 14.4227 14.4649 14.4649 14.8433 14.8433 k = 0.1000 0.2985-0.0000 ( 8174 PWs) bands (ev): 1.6161 1.6161 1.6197 1.6197 2.7136 2.7136 2.7350 2.7350 5.6835 5.6835 5.6866 5.6866 6.4828 6.4828 6.5674 6.5674 6.7650 6.7650 6.9011 6.9011 7.2465 7.2465 7.3398 7.3398 7.5076 7.5076 7.5161 7.5161 7.8194 7.8194 7.8908 7.8908 8.3206 8.3206 8.4759 8.4759 8.7422 8.7422 8.8207 8.8207 9.0911 9.0911 9.1570 9.1570 9.4593 9.4593 9.5102 9.5102 9.7253 9.7253 9.9636 9.9636 10.3180 10.3180 10.3740 10.3740 10.7954 10.7954 10.8296 10.8296 11.4461 11.4461 11.4744 11.4744 11.7073 11.7073 11.7138 11.7138 12.4638 12.4638 12.4752 12.4752 12.8764 12.8764 12.9385 12.9385 13.2995 13.2995 13.3745 13.3745 14.4217 14.4217 14.4735 14.4735 14.8692 14.8692 k = 0.0875 0.2985-0.0000 ( 8170 PWs) bands (ev): 1.5995 1.5995 1.6027 1.6027 2.7081 2.7081 2.7270 2.7270 5.6652 5.6652 5.6684 5.6684 6.5002 6.5002 6.5912 6.5912 6.7469 6.7469 6.8893 6.8893 7.2342 7.2342 7.3221 7.3221 7.5034 7.5034 7.5097 7.5097 7.8291 7.8291 7.8929 7.8929 8.3340 8.3340 8.4685 8.4685 8.7601 8.7601 8.8333 8.8333 9.1133 9.1133 9.1757 9.1757 9.4748 9.4748 9.5282 9.5282 9.7456 9.7456 9.9602 9.9602 10.3320 10.3320 10.3786 10.3786 10.7694 10.7694 10.7947 10.7947 11.4651 11.4651 11.4847 11.4847 11.7146 11.7146 11.7255 11.7255 12.4785 12.4785 12.4896 12.4896 12.8852 12.8852 12.9401 12.9401 13.2955 13.2955 13.3632 13.3632 14.4171 14.4171 14.4740 14.4740 14.9010 14.9010 k = 0.0750 0.2985-0.0000 ( 8158 PWs) bands (ev): 1.5851 1.5851 1.5878 1.5878 2.7034 2.7034 2.7197 2.7197 5.6492 5.6492 5.6523 5.6523 6.5164 6.5164 6.6115 6.6115 6.7332 6.7332 6.8779 6.8779 7.2239 7.2239 7.3046 7.3046 7.4997 7.4997 7.5042 7.5042 7.8382 7.8382 7.8940 7.8940 8.3469 8.3469 8.4610 8.4610 8.7774 8.7774 8.8435 8.8435 9.1337 9.1337 9.1909 9.1909 9.4926 9.4926 9.5455 9.5455 9.7650 9.7650 9.9530 9.9530 10.3450 10.3450 10.3832 10.3832 10.7453 10.7453 10.7627 10.7627 11.4792 11.4792 11.4915 11.4915 11.7230 11.7230 11.7370 11.7370 12.4897 12.4897 12.4999 12.4999 12.8940 12.8940 12.9404 12.9404 13.2967 13.2967 13.3554 13.3554 14.4106 14.4106 14.4681 14.4681 14.9372 14.9372 k = 0.0625 0.2985-0.0000 ( 8160 PWs) bands (ev): 1.5728 1.5728 1.5752 1.5752 2.6996 2.6996 2.7133 2.7133 5.6356 5.6356 5.6383 5.6383 6.5314 6.5314 6.6256 6.6256 6.7264 6.7264 6.8665 6.8665 7.2158 7.2158 7.2874 7.2874 7.4966 7.4966 7.4996 7.4996 7.8468 7.8468 7.8939 7.8939 8.3592 8.3592 8.4535 8.4535 8.7938 8.7938 8.8512 8.8512 9.1521 9.1521 9.2024 9.2024 9.5123 9.5123 9.5617 9.5617 9.7830 9.7830 9.9422 9.9422 10.3565 10.3565 10.3875 10.3875 10.7239 10.7239 10.7348 10.7348 11.4887 11.4887 11.4954 11.4954 11.7322 11.7322 11.7476 11.7476 12.4979 12.4979 12.5068 12.5068 12.9020 12.9020 12.9393 12.9393 13.3022 13.3022 13.3508 13.3508 14.4037 14.4037 14.4580 14.4580 14.9759 14.9759 k = 0.0500 0.2985-0.0000 ( 8168 PWs) bands (ev): 1.5628 1.5628 1.5647 1.5647 2.6966 2.6966 2.7077 2.7077 5.6244 5.6244 5.6267 5.6267 6.5456 6.5456 6.6305 6.6305 6.7294 6.7294 6.8544 6.8544 7.2104 7.2104 7.2711 7.2711 7.4939 7.4939 7.4959 7.4959 7.8547 7.8547 7.8928 7.8928 8.3710 8.3710 8.4459 8.4459 8.8088 8.8088 8.8563 8.8563 9.1683 9.1683 9.2102 9.2102 9.5327 9.5327 9.5762 9.5762 9.7996 9.7996 9.9285 9.9285 10.3664 10.3664 10.3909 10.3909 10.7055 10.7055 10.7115 10.7115 11.4943 11.4943 11.4972 11.4972 11.7420 11.7420 11.7569 11.7569 12.5036 12.5036 12.5111 12.5111 12.9088 12.9088 12.9372 12.9372 13.3106 13.3106 13.3489 13.3489 14.3976 14.3976 14.4453 14.4453 15.0156 15.0156 k = 0.0375 0.2985-0.0000 ( 8180 PWs) bands (ev): 1.5551 1.5551 1.5565 1.5565 2.6946 2.6946 2.7029 2.7029 5.6157 5.6157 5.6175 5.6175 6.5589 6.5589 6.6269 6.6269 6.7411 6.7411 6.8414 6.8414 7.2081 7.2081 7.2558 7.2558 7.4919 7.4919 7.4930 7.4930 7.8619 7.8619 7.8907 7.8907 8.3822 8.3822 8.4380 8.4380 8.8223 8.8223 8.8588 8.8588 9.1822 9.1822 9.2145 9.2145 9.5527 9.5527 9.5880 9.5880 9.8150 9.8150 9.9126 9.9126 10.3748 10.3748 10.3931 10.3931 10.6908 10.6908 10.6934 10.6934 11.4971 11.4971 11.4978 11.4978 11.7514 11.7514 11.7641 11.7641 12.5076 12.5076 12.5133 12.5133 12.9142 12.9142 12.9343 12.9343 13.3204 13.3204 13.3484 13.3484 14.3935 14.3935 14.4317 14.4317 15.0551 15.0551 k = 0.0250 0.2985-0.0000 ( 8178 PWs) bands (ev): 1.5496 1.5496 1.5505 1.5505 2.6936 2.6936 2.6991 2.6991 5.6096 5.6096 5.6108 5.6108 6.5717 6.5717 6.6184 6.6184 6.7576 6.7576 6.8269 6.8269 7.2091 7.2091 7.2419 7.2419 7.4904 7.4904 7.4910 7.4910 7.8685 7.8685 7.8878 7.8878 8.3928 8.3928 8.4298 8.4298 8.8339 8.8339 8.8587 8.8587 9.1937 9.1937 9.2156 9.2156 9.5707 9.5707 9.5957 9.5957 9.8297 9.8297 9.8954 9.8954 10.3816 10.3816 10.3938 10.3938 10.6799 10.6799 10.6807 10.6807 11.4979 11.4979 11.4981 11.4981 11.7597 11.7597 11.7689 11.7689 12.5102 12.5102 12.5141 12.5141 12.9184 12.9184 12.9312 12.9312 13.3299 13.3299 13.3482 13.3482 14.3920 14.3920 14.4188 14.4188 15.0929 15.0929 k = 0.0125 0.2985-0.0000 ( 8188 PWs) bands (ev): 1.5464 1.5464 1.5468 1.5468 2.6935 2.6935 2.6963 2.6963 5.6060 5.6060 5.6066 5.6066 6.5840 6.5840 6.6076 6.6076 6.7757 6.7757 6.8110 6.8110 7.2132 7.2132 7.2299 7.2299 7.4895 7.4895 7.4898 7.4898 7.8744 7.8744 7.8841 7.8841 8.4028 8.4028 8.4213 8.4213 8.8435 8.8435 8.8560 8.8560 9.2029 9.2029 9.2140 9.2140 9.5851 9.5851 9.5981 9.5981 9.8448 9.8448 9.8778 9.8778 10.3869 10.3869 10.3930 10.3930 10.6732 10.6732 10.6733 10.6733 11.4978 11.4978 11.4981 11.4981 11.7660 11.7660 11.7709 11.7709 12.5120 12.5120 12.5140 12.5140 12.9219 12.9219 12.9280 12.9280 13.3379 13.3379 13.3469 13.3469 14.3938 14.3938 14.4076 14.4076 15.1272 15.1272 k = 0.0000 0.2985-0.0000 ( 8180 PWs) bands (ev): 1.5455 1.5455 1.5455 1.5455 2.6944 2.6944 2.6944 2.6944 5.6050 5.6050 5.6050 5.6050 6.5960 6.5960 6.5960 6.5960 6.7938 6.7938 6.7938 6.7938 7.2202 7.2202 7.2202 7.2202 7.4893 7.4893 7.4893 7.4893 7.8797 7.8797 7.8797 7.8797 8.4123 8.4123 8.4123 8.4123 8.8510 8.8510 8.8510 8.8510 9.2097 9.2097 9.2097 9.2097 9.5945 9.5945 9.5945 9.5945 9.8608 9.8608 9.8608 9.8608 10.3907 10.3907 10.3907 10.3907 10.6709 10.6709 10.6709 10.6709 11.4979 11.4979 11.4979 11.4979 11.7699 11.7699 11.7699 11.7699 12.5133 12.5133 12.5133 12.5133 12.9250 12.9250 12.9250 12.9250 13.3437 13.3437 13.3437 13.3437 14.3991 14.3991 14.3991 14.3991 15.1558 15.1558 k = 0.0000 0.2985-0.0000 ( 8180 PWs) bands (ev): 1.5455 1.5455 1.5455 1.5455 2.6944 2.6944 2.6944 2.6944 5.6050 5.6050 5.6050 5.6050 6.5960 6.5960 6.5960 6.5960 6.7938 6.7938 6.7938 6.7938 7.2202 7.2202 7.2202 7.2202 7.4893 7.4893 7.4893 7.4893 7.8797 7.8797 7.8797 7.8797 8.4123 8.4123 8.4123 8.4123 8.8510 8.8510 8.8510 8.8510 9.2097 9.2097 9.2097 9.2097 9.5945 9.5945 9.5945 9.5945 9.8608 9.8608 9.8608 9.8608 10.3907 10.3907 10.3907 10.3907 10.6709 10.6709 10.6709 10.6709 11.4979 11.4979 11.4979 11.4979 11.7699 11.7699 11.7699 11.7699 12.5133 12.5133 12.5133 12.5133 12.9250 12.9250 12.9250 12.9250 13.3437 13.3437 13.3437 13.3437 14.3991 14.3991 14.3991 14.3991 15.1558 15.1558 k = 0.0000 0.2861-0.0000 ( 8176 PWs) bands (ev): 1.4904 1.4904 1.6015 1.6015 2.6884 2.6884 2.6996 2.6996 5.6051 5.6051 5.6081 5.6081 6.5811 6.5811 6.6101 6.6101 6.7832 6.7832 6.8054 6.8054 7.2147 7.2147 7.2262 7.2262 7.4813 7.4813 7.4974 7.4974 7.8707 7.8707 7.8881 7.8881 8.4053 8.4053 8.4160 8.4160 8.8391 8.8391 8.8640 8.8640 9.1926 9.1926 9.2256 9.2256 9.5810 9.5810 9.6082 9.6082 9.8314 9.8314 9.8877 9.8877 10.3472 10.3472 10.4311 10.4311 10.6703 10.6703 10.6800 10.6800 11.4776 11.4776 11.5168 11.5168 11.7599 11.7599 11.7741 11.7741 12.4757 12.4757 12.5523 12.5523 12.9036 12.9036 12.9483 12.9483 13.3019 13.3019 13.3877 13.3877 14.3536 14.3536 14.4403 14.4403 15.1155 15.1155 k = 0.0000 0.2736-0.0000 ( 8180 PWs) bands (ev): 1.4365 1.4365 1.6584 1.6584 2.6817 2.6817 2.7041 2.7041 5.6083 5.6083 5.6143 5.6143 6.5658 6.5658 6.6229 6.6229 6.7735 6.7735 6.8177 6.8177 7.2096 7.2096 7.2329 7.2329 7.4735 7.4735 7.5055 7.5055 7.8612 7.8612 7.8960 7.8960 8.3952 8.3952 8.4164 8.4164 8.8288 8.8288 8.8776 8.8776 9.1753 9.1753 9.2399 9.2399 9.5675 9.5675 9.6221 9.6221 9.8000 9.8000 9.9115 9.9115 10.3021 10.3021 10.4676 10.4676 10.6772 10.6772 10.6978 10.6978 11.4562 11.4562 11.5336 11.5336 11.7440 11.7440 11.7735 11.7735 12.4399 12.4399 12.5926 12.5926 12.8826 12.8826 12.9747 12.9747 13.2642 13.2642 13.4327 13.4327 14.3040 14.3040 14.4774 14.4774 15.0685 15.0685 k = 0.0000 0.2612-0.0000 ( 8182 PWs) bands (ev): 1.3839 1.3839 1.7158 1.7158 2.6744 2.6744 2.7077 2.7077 5.6146 5.6146 5.6236 5.6236 6.5504 6.5504 6.6341 6.6341 6.7647 6.7647 6.8308 6.8308 7.2048 7.2048 7.2404 7.2404 7.4659 7.4659 7.5136 7.5136 7.8512 7.8512 7.9034 7.9034 8.3821 8.3821 8.4137 8.4137 8.8202 8.8202 8.8913 8.8913 9.1584 9.1584 9.2515 9.2515 9.5540 9.5540 9.6361 9.6361 9.7674 9.7674 9.9316 9.9316 10.2574 10.2574 10.5003 10.5003 10.6908 10.6908 10.7233 10.7233 11.4340 11.4340 11.5474 11.5474 11.7229 11.7229 11.7693 11.7693 12.4058 12.4058 12.6339 12.6339 12.8598 12.8598 13.0045 13.0045 13.2328 13.2328 13.4779 13.4779 14.2502 14.2502 14.5104 14.5104 15.0165 15.0165 k = 0.0000 0.2488-0.0000 ( 8188 PWs) bands (ev): 1.3328 1.3328 1.7736 1.7736 2.6665 2.6665 2.7105 2.7105 5.6239 5.6239 5.6358 5.6358 6.5356 6.5356 6.6437 6.6437 6.7566 6.7566 6.8443 6.8443 7.2002 7.2002 7.2488 7.2488 7.4584 7.4584 7.5215 7.5215 7.8406 7.8406 7.9105 7.9105 8.3664 8.3664 8.4081 8.4081 8.8133 8.8133 8.9043 8.9043 9.1426 9.1426 9.2597 9.2597 9.5401 9.5401 9.6500 9.6500 9.7344 9.7344 9.9480 9.9480 10.2149 10.2149 10.5299 10.5299 10.7100 10.7100 10.7547 10.7547 11.4112 11.4112 11.5564 11.5564 11.6982 11.6982 11.7634 11.7634 12.3736 12.3736 12.6754 12.6754 12.8337 12.8337 13.0371 13.0371 13.2099 13.2099 13.5231 13.5231 14.1927 14.1927 14.5396 14.5396 14.9615 14.9615 k = 0.0000 0.2363-0.0000 ( 8196 PWs) bands (ev): 1.2834 1.2834 1.8314 1.8314 2.6581 2.6581 2.7126 2.7126 5.6360 5.6360 5.6507 5.6507 6.5216 6.5216 6.6516 6.6516 6.7494 6.7494 6.8580 6.8580 7.1958 7.1958 7.2584 7.2584 7.4510 7.4510 7.5291 7.5291 7.8292 7.8292 7.9172 7.9172 8.3484 8.3484 8.3999 8.3999 8.8082 8.8082 8.9157 8.9157 9.1288 9.1288 9.2637 9.2637 9.5254 9.5254 9.6629 9.6629 9.7024 9.7024 9.9604 9.9604 10.1767 10.1767 10.5572 10.5572 10.7339 10.7339 10.7900 10.7900 11.3879 11.3879 11.5574 11.5574 11.6736 11.6736 11.7578 11.7578 12.3434 12.3434 12.7142 12.7142 12.8057 12.8057 13.0716 13.0716 13.1968 13.1968 13.5684 13.5684 14.1317 14.1317 14.5652 14.5652 14.9047 14.9047 k = 0.0000 0.2239-0.0000 ( 8204 PWs) bands (ev): 1.2357 1.2357 1.8892 1.8892 2.6494 2.6494 2.7138 2.7138 5.6506 5.6506 5.6683 5.6683 6.5090 6.5090 6.6577 6.6577 6.7428 6.7428 6.8714 6.8714 7.1914 7.1914 7.2693 7.2693 7.4437 7.4437 7.5362 7.5362 7.8172 7.8172 7.9237 7.9237 8.3286 8.3286 8.3895 8.3895 8.8046 8.8046 8.9246 8.9246 9.1178 9.1178 9.2627 9.2627 9.5095 9.5095 9.6627 9.6627 9.6841 9.6841 9.9690 9.9690 10.1444 10.1444 10.5822 10.5822 10.7618 10.7618 10.8278 10.8278 11.3643 11.3643 11.5456 11.5456 11.6546 11.6546 11.7541 11.7541 12.3153 12.3153 12.7322 12.7322 12.7943 12.7943 13.1064 13.1064 13.1941 13.1941 13.6141 13.6141 14.0676 14.0676 14.5874 14.5874 14.8469 14.8469 k = 0.0000 0.2115-0.0000 ( 8208 PWs) bands (ev): 1.1900 1.1900 1.9465 1.9465 2.6403 2.6403 2.7144 2.7144 5.6677 5.6677 5.6882 5.6882 6.4982 6.4982 6.6621 6.6621 6.7369 6.7369 6.8841 6.8841 7.1871 7.1871 7.2815 7.2815 7.4364 7.4364 7.5426 7.5426 7.8041 7.8041 7.9302 7.9302 8.3075 8.3075 8.3772 8.3772 8.8022 8.8022 8.9302 8.9302 9.1103 9.1103 9.2562 9.2562 9.4915 9.4915 9.6357 9.6357 9.6943 9.6943 9.9741 9.9741 10.1196 10.1196 10.6040 10.6040 10.7932 10.7932 10.8675 10.8675 11.3405 11.3405 11.5192 11.5192 11.6444 11.6444 11.7538 11.7538 12.2892 12.2892 12.7052 12.7052 12.8243 12.8243 13.1386 13.1386 13.2020 13.2020 13.6607 13.6607 14.0010 14.0010 14.6065 14.6065 14.7888 14.7888 k = 0.0000 0.1990-0.0000 ( 8214 PWs) bands (ev): 1.1463 1.1463 2.0031 2.0031 2.6311 2.6311 2.7142 2.7142 5.6867 5.6867 5.7101 5.7101 6.4895 6.4895 6.6650 6.6650 6.7317 6.7317 6.8959 6.8959 7.1828 7.1828 7.2951 7.2951 7.4289 7.4289 7.5482 7.5482 7.7900 7.7900 7.9368 7.9368 8.2854 8.2854 8.3634 8.3634 8.8006 8.8006 8.9322 8.9322 9.1065 9.1065 9.2442 9.2442 9.4710 9.4710 9.6081 9.6081 9.7072 9.7072 9.9766 9.9766 10.1029 10.1029 10.6211 10.6211 10.8274 10.8274 10.9089 10.9089 11.3163 11.3163 11.4823 11.4823 11.6410 11.6410 11.7569 11.7569 12.2654 12.2654 12.6643 12.6643 12.8664 12.8664 13.1656 13.1656 13.2209 13.2209 13.7086 13.7086 13.9324 13.9324 14.6223 14.6223 14.7309 14.7309 k = 0.0000 0.1866-0.0000 ( 8206 PWs) bands (ev): 1.1048 1.1048 2.0587 2.0587 2.6218 2.6218 2.7134 2.7134 5.7074 5.7074 5.7338 5.7338 6.4833 6.4833 6.6664 6.6664 6.7271 6.7271 6.9064 6.9064 7.1785 7.1785 7.3099 7.3099 7.4212 7.4212 7.5529 7.5529 7.7746 7.7746 7.9436 7.9436 8.2630 8.2630 8.3486 8.3486 8.7994 8.7994 8.9306 8.9306 9.1056 9.1056 9.2278 9.2278 9.4474 9.4474 9.5829 9.5829 9.7205 9.7205 9.9777 9.9777 10.0936 10.0936 10.6317 10.6317 10.8640 10.8640 10.9525 10.9525 11.2919 11.2919 11.4402 11.4402 11.6419 11.6419 11.7629 11.7629 12.2437 12.2437 12.6208 12.6208 12.9106 12.9106 13.1877 13.1877 13.2481 13.2481 13.7577 13.7577 13.8626 13.8626 14.6340 14.6340 14.6743 14.6743 k = 0.0000 0.1741-0.0000 ( 8208 PWs) bands (ev): 1.0654 1.0654 2.1131 2.1131 2.6125 2.6125 2.7121 2.7121 5.7294 5.7294 5.7590 5.7590 6.4801 6.4801 6.6665 6.6665 6.7231 6.7231 6.9155 6.9155 7.1742 7.1742 7.3258 7.3258 7.4132 7.4132 7.5566 7.5566 7.7577 7.7577 7.9509 7.9509 8.2407 8.2407 8.3333 8.3333 8.7978 8.7978 8.9265 8.9265 9.1060 9.1060 9.2087 9.2087 9.4210 9.4210 9.5604 9.5604 9.7340 9.7340 9.9787 9.9787 10.0905 10.0905 10.6348 10.6348 10.9025 10.9025 10.9985 10.9985 11.2670 11.2670 11.3962 11.3962 11.6464 11.6464 11.7711 11.7711 12.2242 12.2242 12.5775 12.5775 12.9551 12.9551 13.2085 13.2085 13.2783 13.2783 13.7897 13.7897 13.8103 13.8103 14.6121 14.6121 14.6486 14.6486 k = 0.0000 0.1617-0.0000 ( 8210 PWs) bands (ev): 1.0285 1.0285 2.1658 2.1658 2.6033 2.6033 2.7102 2.7102 5.7522 5.7522 5.7851 5.7851 6.4800 6.4800 6.6657 6.6657 6.7196 6.7196 6.9230 6.9230 7.1700 7.1700 7.3422 7.3422 7.4049 7.4049 7.5592 7.5592 7.7391 7.7391 7.9587 7.9587 8.2189 8.2189 8.3178 8.3178 8.7950 8.7950 8.9208 8.9208 9.1049 9.1049 9.1908 9.1908 9.3923 9.3923 9.5402 9.5402 9.7479 9.7479 9.9805 9.9805 10.0922 10.0922 10.6297 10.6297 10.9425 10.9425 11.0467 11.0467 11.2415 11.2415 11.3528 11.3528 11.6541 11.6541 11.7806 11.7806 12.2068 12.2068 12.5360 12.5360 12.9991 12.9991 13.2299 13.2299 13.3082 13.3082 13.7209 13.7209 13.8594 13.8594 14.5568 14.5568 14.6532 14.6532 k = 0.0000 0.1493-0.0000 ( 8204 PWs) bands (ev): 0.9939 0.9939 2.2166 2.2166 2.5944 2.5944 2.7079 2.7079 5.7752 5.7752 5.8119 5.8119 6.4835 6.4835 6.6641 6.6641 6.7166 6.7166 6.9290 6.9290 7.1659 7.1659 7.3583 7.3583 7.3968 7.3968 7.5608 7.5608 7.7188 7.7188 7.9671 7.9671 8.1982 8.1982 8.3025 8.3025 8.7898 8.7898 8.9146 8.9146 9.0988 9.0988 9.1785 9.1785 9.3621 9.3621 9.5215 9.5215 9.7621 9.7621 9.9835 9.9835 10.0975 10.0975 10.6170 10.6170 10.9833 10.9833 11.0957 11.0957 11.2154 11.2154 11.3124 11.3124 11.6648 11.6648 11.7909 11.7909 12.1915 12.1915 12.4971 12.4971 13.0423 13.0423 13.2527 13.2527 13.3363 13.3363 13.6517 13.6517 13.9091 13.9091 14.5007 14.5007 14.6543 14.6543 k = 0.0000 0.1368-0.0000 ( 8208 PWs) bands (ev): 0.9619 0.9619 2.2652 2.2652 2.5858 2.5858 2.7052 2.7052 5.7981 5.7981 5.8389 5.8389 6.4905 6.4905 6.6619 6.6619 6.7140 6.7140 6.9333 6.9333 7.1620 7.1620 7.3692 7.3692 7.3930 7.3930 7.5615 7.5615 7.6969 7.6969 7.9758 7.9758 8.1790 8.1790 8.2880 8.2880 8.7811 8.7811 8.9086 8.9086 9.0872 9.0872 9.1744 9.1744 9.3313 9.3313 9.5039 9.5039 9.7766 9.7766 9.9876 9.9876 10.1054 10.1054 10.5977 10.5977 11.0242 11.0242 11.1414 11.1414 11.1898 11.1898 11.2786 11.2786 11.6779 11.6779 11.8017 11.8017 12.1781 12.1781 12.4613 12.4613 13.0840 13.0840 13.2769 13.2769 13.3618 13.3618 13.5850 13.5850 13.9563 13.9563 14.4449 14.4449 14.6477 14.6477 k = 0.0000 0.1244-0.0000 ( 8206 PWs) bands (ev): 0.9324 0.9324 2.3113 2.3113 2.5776 2.5776 2.7023 2.7023 5.8202 5.8202 5.8658 5.8658 6.5012 6.5012 6.6595 6.6595 6.7119 6.7119 6.9360 6.9360 7.1582 7.1582 7.3652 7.3652 7.4027 7.4027 7.5613 7.5613 7.6738 7.6738 7.9846 7.9846 8.1619 8.1619 8.2746 8.2746 8.7677 8.7677 8.9034 8.9034 9.0741 9.0741 9.1759 9.1759 9.3007 9.3007 9.4869 9.4869 9.7911 9.7911 9.9926 9.9926 10.1151 10.1151 10.5732 10.5732 11.0637 11.0637 11.1535 11.1535 11.1837 11.1837 11.2636 11.2636 11.6928 11.6928 11.8128 11.8128 12.1666 12.1666 12.4290 12.4290 13.1239 13.1239 13.3014 13.3014 13.3837 13.3837 13.5238 13.5238 13.9990 13.9990 14.3894 14.3894 14.6252 14.6252 k = 0.0000 0.1119-0.0000 ( 8212 PWs) bands (ev): 0.9055 0.9055 2.3544 2.3544 2.5700 2.5700 2.6990 2.6990 5.8412 5.8412 5.8921 5.8921 6.5153 6.5153 6.6570 6.6570 6.7105 6.7105 6.9371 6.9371 7.1547 7.1547 7.3533 7.3533 7.4183 7.4183 7.5604 7.5604 7.6500 7.6500 7.9929 7.9929 8.1472 8.1472 8.2627 8.2627 8.7490 8.7490 8.8993 8.8993 9.0635 9.0635 9.1796 9.1796 9.2716 9.2716 9.4701 9.4701 9.8055 9.8055 9.9982 9.9982 10.1258 10.1258 10.5450 10.5450 11.0939 11.0939 11.1365 11.1365 11.1796 11.1796 11.2876 11.2876 11.7087 11.7087 11.8240 11.8240 12.1568 12.1568 12.4002 12.4002 13.1612 13.1612 13.3221 13.3221 13.3995 13.3995 13.4760 13.4760 14.0351 14.0351 14.3342 14.3342 14.5829 14.5829 k = 0.0000 0.0995-0.0000 ( 8210 PWs) bands (ev): 0.8814 0.8814 2.3944 2.3944 2.5630 2.5630 2.6956 2.6956 5.8605 5.8605 5.9174 5.9174 6.5322 6.5322 6.6546 6.6546 6.7101 6.7101 6.9366 6.9366 7.1515 7.1515 7.3384 7.3384 7.4342 7.4342 7.5588 7.5588 7.6264 7.6264 7.9999 7.9999 8.1357 8.1357 8.2526 8.2526 8.7256 8.7256 8.8967 8.8967 9.0574 9.0574 9.1819 9.1819 9.2465 9.2465 9.4532 9.4532 9.8194 9.8194 10.0044 10.0044 10.1367 10.1367 10.5149 10.5149 11.0841 11.0841 11.1526 11.1526 11.1637 11.1637 11.3316 11.3316 11.7250 11.7250 11.8352 11.8352 12.1485 12.1485 12.3749 12.3749 13.1945 13.1945 13.3240 13.3240 13.4092 13.4092 13.4587 13.4587 14.0628 14.0628 14.2795 14.2795 14.5282 14.5282 k = 0.0000 0.0871-0.0000 ( 8221 PWs) bands (ev): 0.8599 0.8599 2.4309 2.4309 2.5567 2.5567 2.6919 2.6919 5.8779 5.8779 5.9412 5.9412 6.5509 6.5509 6.6525 6.6525 6.7116 6.7116 6.9344 6.9344 7.1487 7.1487 7.3212 7.3212 7.4493 7.4493 7.5563 7.5563 7.6043 7.6043 8.0051 8.0051 8.1276 8.1276 8.2448 8.2448 8.6988 8.6988 8.8957 8.8957 9.0556 9.0556 9.1772 9.1772 9.2307 9.2307 9.4362 9.4362 9.8326 9.8326 10.0111 10.0111 10.1468 10.1468 10.4846 10.4846 11.0581 11.0581 11.1389 11.1389 11.1916 11.1916 11.3781 11.3781 11.7411 11.7411 11.8464 11.8464 12.1414 12.1414 12.3529 12.3529 13.2191 13.2191 13.3004 13.3004 13.4300 13.4300 13.4669 13.4669 14.0804 14.0804 14.2262 14.2262 14.4690 14.4690 k = 0.0000 0.0746-0.0000 ( 8219 PWs) bands (ev): 0.8412 0.8412 2.4636 2.4636 2.5512 2.5512 2.6881 2.6881 5.8931 5.8931 5.9632 5.9632 6.5696 6.5696 6.6509 6.6509 6.7163 6.7163 6.9302 6.9302 7.1463 7.1463 7.3022 7.3022 7.4630 7.4630 7.5523 7.5523 7.5852 7.5852 8.0078 8.0078 8.1231 8.1231 8.2395 8.2395 8.6703 8.6703 8.8963 8.8963 9.0570 9.0570 9.1619 9.1619 9.2283 9.2283 9.4190 9.4190 9.8448 9.8448 10.0183 10.0183 10.1554 10.1554 10.4557 10.4557 11.0321 11.0321 11.1203 11.1203 11.2254 11.2254 11.4224 11.4224 11.7567 11.7567 11.8574 11.8574 12.1353 12.1353 12.3340 12.3340 13.2160 13.2160 13.2899 13.2899 13.4579 13.4579 13.4856 13.4856 14.0843 14.0843 14.1786 14.1786 14.4101 14.4101 k = 0.0000 0.0622-0.0000 ( 8219 PWs) bands (ev): 0.8254 0.8254 2.4921 2.4921 2.5467 2.5467 2.6842 2.6842 5.9060 5.9060 5.9829 5.9829 6.5863 6.5863 6.6498 6.6498 6.7256 6.7256 6.9237 6.9237 7.1443 7.1443 7.2820 7.2820 7.4751 7.4751 7.5454 7.5454 7.5716 7.5716 8.0082 8.0082 8.1215 8.1215 8.2367 8.2367 8.6419 8.6419 8.8986 8.8986 9.0598 9.0598 9.1423 9.1423 9.2339 9.2339 9.4016 9.4016 9.8557 9.8557 10.0258 10.0258 10.1615 10.1615 10.4298 10.4298 11.0086 11.0086 11.1038 11.1038 11.2564 11.2564 11.4623 11.4623 11.7712 11.7712 11.8679 11.8679 12.1301 12.1301 12.3180 12.3180 13.1842 13.1842 13.3053 13.3053 13.4780 13.4780 13.5182 13.5182 14.0640 14.0640 14.1486 14.1486 14.3548 14.3548 k = 0.0000 0.0498-0.0000 ( 8203 PWs) bands (ev): 0.8124 0.8124 2.5155 2.5155 2.5440 2.5440 2.6803 2.6803 5.9165 5.9165 5.9998 5.9998 6.5988 6.5988 6.6492 6.6492 6.7410 6.7410 6.9145 6.9145 7.1428 7.1428 7.2618 7.2618 7.4853 7.4853 7.5355 7.5355 7.5642 7.5642 8.0069 8.0069 8.1219 8.1219 8.2364 8.2364 8.6155 8.6155 8.9022 8.9022 9.0618 9.0618 9.1245 9.1245 9.2429 9.2429 9.3842 9.3842 9.8652 9.8652 10.0334 10.0334 10.1645 10.1645 10.4082 10.4082 10.9886 10.9886 11.0898 11.0898 11.2833 11.2833 11.4965 11.4965 11.7844 11.7844 11.8774 11.8774 12.1255 12.1255 12.3050 12.3050 13.1492 13.1492 13.3251 13.3251 13.4905 13.4905 13.5612 13.5612 14.0190 14.0190 14.1385 14.1385 14.3057 14.3057 k = 0.0000 0.0373-0.0000 ( 8197 PWs) bands (ev): 0.8022 0.8022 2.5300 2.5300 2.5464 2.5464 2.6765 2.6765 5.9246 5.9246 6.0134 6.0134 6.6068 6.6068 6.6488 6.6488 6.7623 6.7623 6.9021 6.9021 7.1417 7.1417 7.2431 7.2431 7.4934 7.4934 7.5257 7.5257 7.5603 7.5603 8.0049 8.0049 8.1231 8.1231 8.2380 8.2380 8.5925 8.5925 8.9066 8.9066 9.0606 9.0606 9.1121 9.1121 9.2537 9.2537 9.3671 9.3671 9.8728 9.8728 10.0409 10.0409 10.1646 10.1646 10.3918 10.3918 10.9725 10.9725 11.0787 11.0787 11.3051 11.3051 11.5239 11.5239 11.7956 11.7956 11.8857 11.8857 12.1218 12.1218 12.2948 12.2948 13.1190 13.1190 13.3425 13.3425 13.4993 13.4993 13.6093 13.6093 13.9643 13.9643 14.1353 14.1353 14.2650 14.2650 k = 0.0000 0.0249-0.0000 ( 8211 PWs) bands (ev): 0.7949 0.7949 2.5326 2.5326 2.5566 2.5566 2.6732 2.6732 5.9304 5.9304 6.0235 6.0235 6.6112 6.6112 6.6486 6.6486 6.7875 6.7875 6.8860 6.8860 7.1410 7.1410 7.2278 7.2278 7.4992 7.4992 7.5182 7.5182 7.5582 7.5582 8.0028 8.0028 8.1243 8.1243 8.2405 8.2405 8.5747 8.5747 8.9111 8.9111 9.0557 9.0557 9.1062 9.1062 9.2653 9.2653 9.3511 9.3511 9.8785 9.8785 10.0474 10.0474 10.1624 10.1624 10.3807 10.3807 10.9608 10.9608 11.0706 11.0706 11.3213 11.3213 11.5440 11.5440 11.8043 11.8043 11.8921 11.8921 12.1189 12.1189 12.2875 12.2875 13.0962 13.0962 13.3558 13.3558 13.5054 13.5054 13.6600 13.6600 13.9075 13.9075 14.1338 14.1338 14.2345 14.2345 k = 0.0000 0.0124-0.0000 ( 8205 PWs) bands (ev): 0.7906 0.7906 2.5322 2.5322 2.5650 2.5650 2.6708 2.6708 5.9339 5.9339 6.0297 6.0297 6.6133 6.6133 6.6485 6.6485 6.8139 6.8139 6.8664 6.8664 7.1406 7.1406 7.2177 7.2177 7.5024 7.5024 7.5138 7.5138 7.5570 7.5570 8.0014 8.0014 8.1251 8.1251 8.2427 8.2427 8.5633 8.5633 8.9145 8.9145 9.0503 9.0503 9.1045 9.1045 9.2756 9.2756 9.3381 9.3381 9.8820 9.8820 10.0521 10.0521 10.1599 10.1599 10.3744 10.3744 10.9536 10.9536 11.0657 11.0657 11.3312 11.3312 11.5561 11.5561 11.8098 11.8098 11.8962 11.8962 12.1170 12.1170 12.2830 12.2830 13.0821 13.0821 13.3640 13.3640 13.5090 13.5090 13.7099 13.7099 13.8536 13.8536 14.1329 14.1329 14.2156 14.2156 k = 0.0000 0.0000 0.0000 ( 8189 PWs) bands (ev): 0.7891 0.7891 2.5319 2.5319 2.5681 2.5681 2.6700 2.6700 5.9350 5.9350 6.0318 6.0318 6.6139 6.6139 6.6484 6.6484 6.8335 6.8335 6.8493 6.8493 7.1405 7.1405 7.2142 7.2142 7.5033 7.5033 7.5125 7.5125 7.5566 7.5566 8.0009 8.0009 8.1254 8.1254 8.2435 8.2435 8.5593 8.5593 8.9158 8.9158 9.0481 9.0481 9.1042 9.1042 9.2804 9.2804 9.3324 9.3324 9.8831 9.8831 10.0539 10.0539 10.1588 10.1588 10.3724 10.3724 10.9512 10.9512 11.0641 11.0641 11.3346 11.3346 11.5602 11.5602 11.8117 11.8117 11.8976 11.8976 12.1164 12.1164 12.2816 12.2816 13.0773 13.0773 13.3668 13.3668 13.5102 13.5102 13.7397 13.7397 13.8225 13.8225 14.1326 14.1326 14.2092 14.2092 k = 0.0000 0.0000 0.0000 ( 8189 PWs) bands (ev): 0.7891 0.7891 2.5319 2.5319 2.5681 2.5681 2.6700 2.6700 5.9350 5.9350 6.0318 6.0318 6.6139 6.6139 6.6484 6.6484 6.8335 6.8335 6.8493 6.8493 7.1405 7.1405 7.2142 7.2142 7.5033 7.5033 7.5125 7.5125 7.5566 7.5566 8.0009 8.0009 8.1254 8.1254 8.2435 8.2435 8.5593 8.5593 8.9158 8.9158 9.0481 9.0481 9.1042 9.1042 9.2804 9.2804 9.3324 9.3324 9.8831 9.8831 10.0539 10.0539 10.1588 10.1588 10.3724 10.3724 10.9512 10.9512 11.0641 11.0641 11.3346 11.3346 11.5602 11.5602 11.8117 11.8117 11.8976 11.8976 12.1164 12.1164 12.2816 12.2816 13.0773 13.0773 13.3668 13.3668 13.5102 13.5102 13.7397 13.7397 13.8225 13.8225 14.1326 14.1326 14.2092 14.2092 k = 0.0000 0.0000 0.0123 ( 8197 PWs) bands (ev): 0.7906 0.7906 2.5043 2.5043 2.5926 2.5926 2.6706 2.6706 5.9353 5.9353 6.0354 6.0354 6.6111 6.6111 6.6499 6.6499 6.8250 6.8250 6.8564 6.8564 7.1407 7.1407 7.2145 7.2145 7.5049 7.5049 7.5116 7.5116 7.5570 7.5570 8.0008 8.0008 8.1258 8.1258 8.2427 8.2427 8.5588 8.5588 8.9105 8.9105 9.0527 9.0527 9.1049 9.1049 9.2735 9.2735 9.3432 9.3432 9.8817 9.8817 10.0536 10.0536 10.1570 10.1570 10.3687 10.3687 10.9457 10.9457 11.0656 11.0656 11.3356 11.3356 11.5619 11.5619 11.8145 11.8145 11.8995 11.8995 12.1169 12.1169 12.2784 12.2784 13.0741 13.0741 13.3655 13.3655 13.5120 13.5120 13.7320 13.7320 13.8246 13.8246 14.1395 14.1395 14.2099 14.2099 k = 0.0000 0.0000 0.0247 ( 8193 PWs) bands (ev): 0.7950 0.7950 2.4616 2.4616 2.6259 2.6259 2.6728 2.6728 5.9366 5.9366 6.0458 6.0458 6.6036 6.6036 6.6533 6.6533 6.8106 6.8106 6.8667 6.8667 7.1413 7.1413 7.2156 7.2156 7.5086 7.5086 7.5097 7.5097 7.5583 7.5583 8.0003 8.0003 8.1269 8.1269 8.2404 8.2404 8.5572 8.5572 8.8963 8.8963 9.0643 9.0643 9.1069 9.1069 9.2618 9.2618 9.3669 9.3669 9.8772 9.8772 10.0529 10.0529 10.1516 10.1516 10.3583 10.3583 10.9294 10.9294 11.0701 11.0701 11.3385 11.3385 11.5667 11.5667 11.8213 11.8213 11.9061 11.9061 12.1187 12.1187 12.2689 12.2689 13.0643 13.0643 13.3615 13.3615 13.5166 13.5166 13.7138 13.7138 13.8286 13.8286 14.1578 14.1578 14.2124 14.2124 k = 0.0000 0.0000 0.0370 ( 8215 PWs) bands (ev): 0.8024 0.8024 2.4150 2.4150 2.6547 2.6547 2.6785 2.6785 5.9393 5.9393 6.0621 6.0621 6.5933 6.5933 6.6567 6.6567 6.7952 6.7952 6.8757 6.8757 7.1423 7.1423 7.2174 7.2174 7.5044 7.5044 7.5160 7.5160 7.5613 7.5613 7.9997 7.9997 8.1289 8.1289 8.2365 8.2365 8.5546 8.5546 8.8769 8.8769 9.0790 9.0790 9.1097 9.1097 9.2533 9.2533 9.3962 9.3962 9.8697 9.8697 10.0513 10.0513 10.1426 10.1426 10.3431 10.3431 10.9035 10.9035 11.0766 11.0766 11.3433 11.3433 11.5741 11.5741 11.8280 11.8280 11.9200 11.9200 12.1215 12.1215 12.2538 12.2538 13.0483 13.0483 13.3555 13.3555 13.5223 13.5223 13.6937 13.6937 13.8322 13.8322 14.1804 14.1804 14.2195 14.2195 k = 0.0000 0.0000 0.0494 ( 8207 PWs) bands (ev): 0.8127 0.8127 2.3658 2.3658 2.6702 2.6702 2.6956 2.6956 5.9442 5.9442 6.0836 6.0836 6.5810 6.5810 6.6590 6.6590 6.7799 6.7799 6.8832 6.8832 7.1435 7.1435 7.2199 7.2199 7.4983 7.4983 7.5230 7.5230 7.5671 7.5671 7.9989 7.9989 8.1317 8.1317 8.2312 8.2312 8.5507 8.5507 8.8545 8.8545 9.0936 9.0936 9.1127 9.1127 9.2513 9.2513 9.4286 9.4286 9.8589 9.8589 10.0482 10.0482 10.1305 10.1305 10.3258 10.3258 10.8696 10.8696 11.0843 11.0843 11.3498 11.3498 11.5834 11.5834 11.8303 11.8303 11.9439 11.9439 12.1256 12.1256 12.2338 12.2338 13.0263 13.0263 13.3481 13.3481 13.5261 13.5261 13.6779 13.6779 13.8368 13.8368 14.1960 14.1960 14.2381 14.2381 k = 0.0000 0.0000 0.0617 ( 8211 PWs) bands (ev): 0.8260 0.8260 2.3142 2.3142 2.6767 2.6767 2.7196 2.7196 5.9515 5.9515 6.1093 6.1093 6.5674 6.5674 6.6596 6.6596 6.7658 6.7658 6.8888 6.8888 7.1450 7.1450 7.2233 7.2233 7.4903 7.4903 7.5284 7.5284 7.5772 7.5772 7.9979 7.9979 8.1354 8.1354 8.2245 8.2245 8.5457 8.5457 8.8305 8.8305 9.1055 9.1055 9.1161 9.1161 9.2573 9.2573 9.4630 9.4630 9.8446 9.8446 10.0420 10.0420 10.1170 10.1170 10.3090 10.3090 10.8292 10.8292 11.0919 11.0919 11.3579 11.3579 11.5940 11.5940 11.8264 11.8264 11.9769 11.9769 12.1312 12.1312 12.2098 12.2098 12.9990 12.9990 13.3403 13.3403 13.5253 13.5253 13.6699 13.6699 13.8452 13.8452 14.2027 14.2027 14.2667 14.2667 k = 0.0000 0.0000 0.0741 ( 8207 PWs) bands (ev): 0.8421 0.8421 2.2607 2.2607 2.6821 2.6821 2.7424 2.7424 5.9615 5.9615 6.1384 6.1384 6.5526 6.5526 6.6578 6.6578 6.7540 6.7540 6.8926 6.8926 7.1465 7.1465 7.2276 7.2276 7.4807 7.4807 7.5313 7.5313 7.5923 7.5923 7.9968 7.9968 8.1401 8.1401 8.2165 8.2165 8.5392 8.5392 8.8056 8.8056 9.1095 9.1095 9.1245 9.1245 9.2709 9.2709 9.4985 9.4985 9.8265 9.8265 10.0306 10.0306 10.1052 10.1052 10.2946 10.2946 10.7839 10.7839 11.0984 11.0984 11.3674 11.3674 11.6054 11.6054 11.8170 11.8170 12.0159 12.0159 12.1392 12.1392 12.1828 12.1828 12.9670 12.9670 13.3329 13.3329 13.5183 13.5183 13.6702 13.6702 13.8604 13.8604 14.2061 14.2061 14.2976 14.2976 k = 0.0000 0.0000 0.0864 ( 8199 PWs) bands (ev): 0.8610 0.8610 2.2055 2.2055 2.6879 2.6879 2.7626 2.7626 5.9740 5.9740 6.1701 6.1701 6.5370 6.5370 6.6533 6.6533 6.7453 6.7453 6.8944 6.8944 7.1480 7.1480 7.2330 7.2330 7.4695 7.4695 7.5320 7.5320 7.6112 7.6112 7.9957 7.9957 8.1457 8.1457 8.2075 8.2075 8.5312 8.5312 8.7801 8.7801 9.1081 9.1081 9.1364 9.1364 9.2905 9.2905 9.5340 9.5340 9.8044 9.8044 10.0132 10.0132 10.0980 10.0980 10.2836 10.2836 10.7349 10.7349 11.1031 11.1031 11.3781 11.3781 11.6171 11.6171 11.8033 11.8033 12.0560 12.0560 12.1485 12.1485 12.1573 12.1573 12.9311 12.9311 13.3268 13.3268 13.5046 13.5046 13.6786 13.6786 13.8839 13.8839 14.2081 14.2081 14.3275 14.3275 k = 0.0000 0.0000 0.0988 ( 8179 PWs) bands (ev): 0.8828 0.8828 2.1488 2.1488 2.6943 2.6943 2.7800 2.7800 5.9889 5.9889 6.2038 6.2038 6.5209 6.5209 6.6467 6.6467 6.7399 6.7399 6.8942 6.8942 7.1495 7.1495 7.2396 7.2396 7.4568 7.4568 7.5312 7.5312 7.6331 7.6331 7.9948 7.9948 8.1523 8.1523 8.1978 8.1978 8.5215 8.5215 8.7541 8.7541 9.1053 9.1053 9.1494 9.1494 9.3139 9.3139 9.5683 9.5683 9.7787 9.7787 9.9917 9.9917 10.0954 10.0954 10.2766 10.2766 10.6835 10.6835 11.1051 11.1051 11.3898 11.3898 11.6285 11.6285 11.7868 11.7868 12.0896 12.0896 12.1220 12.1220 12.1772 12.1772 12.8921 12.8921 13.3230 13.3230 13.4842 13.4842 13.6952 13.6952 13.9149 13.9149 14.2086 14.2086 14.3553 14.3553 k = 0.0000 0.0000 0.1111 ( 8179 PWs) bands (ev): 0.9074 0.9074 2.0910 2.0910 2.7012 2.7012 2.7947 2.7947 6.0060 6.0060 6.2383 6.2383 6.5049 6.5049 6.6389 6.6389 6.7372 6.7372 6.8920 6.8920 7.1510 7.1510 7.2475 7.2475 7.4427 7.4427 7.5292 7.5292 7.6570 7.6570 7.9940 7.9940 8.1594 8.1594 8.1879 8.1879 8.5098 8.5098 8.7277 8.7277 9.1026 9.1026 9.1631 9.1631 9.3390 9.3390 9.5998 9.5998 9.7503 9.7503 9.9692 9.9692 10.0960 10.0960 10.2739 10.2739 10.6308 10.6308 11.1035 11.1035 11.4025 11.4025 11.6390 11.6390 11.7691 11.7691 12.0869 12.0869 12.1157 12.1157 12.2158 12.2158 12.8506 12.8506 13.3223 13.3223 13.4573 13.4573 13.7204 13.7204 13.9518 13.9518 14.2069 14.2069 14.3806 14.3806 k = 0.0000 0.0000 0.1235 ( 8185 PWs) bands (ev): 0.9347 0.9347 2.0323 2.0323 2.7087 2.7087 2.8066 2.8066 6.0250 6.0250 6.2724 6.2724 6.4895 6.4895 6.6314 6.6314 6.7363 6.7363 6.8876 6.8876 7.1525 7.1525 7.2568 7.2568 7.4273 7.4273 7.5262 7.5262 7.6823 7.6823 7.9936 7.9936 8.1646 8.1646 8.1807 8.1807 8.4961 8.4961 8.7008 8.7008 9.1007 9.1007 9.1775 9.1775 9.3643 9.3643 9.6265 9.6265 9.7216 9.7216 9.9479 9.9479 10.0983 10.0983 10.2762 10.2762 10.5778 10.5778 11.0978 11.0978 11.4160 11.4160 11.6479 11.6479 11.7521 11.7521 12.0551 12.0551 12.1299 12.1299 12.2654 12.2654 12.8073 12.8073 13.3255 13.3255 13.4249 13.4249 13.7535 13.7535 13.9925 13.9925 14.2023 14.2023 14.4031 14.4031 k = 0.0000 0.0000 0.1358 ( 8183 PWs) bands (ev): 0.9647 0.9647 1.9729 1.9729 2.7166 2.7166 2.8160 2.8160 6.0454 6.0454 6.3043 6.3043 6.4761 6.4761 6.6253 6.6253 6.7363 6.7363 6.8811 6.8811 7.1543 7.1543 7.2676 7.2676 7.4109 7.4109 7.5222 7.5222 7.7086 7.7086 7.9935 7.9935 8.1601 8.1601 8.1845 8.1845 8.4802 8.4802 8.6735 8.6735 9.1001 9.1001 9.1923 9.1923 9.3880 9.3880 9.6438 9.6438 9.6978 9.6978 9.9289 9.9289 10.1012 10.1012 10.2840 10.2840 10.5258 10.5258 11.0872 11.0872 11.4302 11.4302 11.6542 11.6542 11.7378 11.7378 12.0226 12.0226 12.1418 12.1418 12.3203 12.3203 12.7627 12.7627 13.3325 13.3325 13.3888 13.3888 13.7932 13.7932 14.0349 14.0349 14.1938 14.1938 14.4226 14.4226 k = 0.0000 0.0000 0.1482 ( 8179 PWs) bands (ev): 0.9972 0.9972 1.9131 1.9131 2.7251 2.7251 2.8230 2.8230 6.0669 6.0669 6.3311 6.3311 6.4670 6.4670 6.6217 6.6217 6.7367 6.7367 6.8726 6.8726 7.1566 7.1566 7.2796 7.2796 7.3937 7.3937 7.5172 7.5172 7.7354 7.7354 7.9938 7.9938 8.1509 8.1509 8.1949 8.1949 8.4620 8.4620 8.6456 8.6456 9.1010 9.1010 9.2069 9.2069 9.4084 9.4084 9.6415 9.6415 9.6907 9.6907 9.9127 9.9127 10.1038 10.1038 10.2974 10.2974 10.4768 10.4768 11.0713 11.0713 11.4450 11.4450 11.6574 11.6574 11.7276 11.7276 11.9905 11.9905 12.1535 12.1535 12.3775 12.3775 12.7174 12.7174 13.3333 13.3333 13.3609 13.3609 13.8377 13.8377 14.0768 14.0768 14.1806 14.1806 14.4386 14.4386 k = 0.0000 0.0000 0.1605 ( 8178 PWs) bands (ev): 1.0323 1.0323 1.8532 1.8532 2.7339 2.7339 2.8277 2.8277 6.0890 6.0890 6.3480 6.3480 6.4664 6.4664 6.6210 6.6210 6.7368 6.7368 6.8620 6.8620 7.1595 7.1595 7.2928 7.2928 7.3758 7.3758 7.5111 7.5111 7.7622 7.7622 7.9943 7.9943 8.1420 8.1420 8.2075 8.2075 8.4417 8.4417 8.6171 8.6171 9.1038 9.1038 9.2208 9.2208 9.4235 9.4235 9.6263 9.6263 9.6963 9.6963 9.8992 9.8992 10.1053 10.1053 10.3135 10.3135 10.4350 10.4350 11.0498 11.0498 11.4604 11.4604 11.6573 11.6573 11.7221 11.7221 11.9594 11.9594 12.1658 12.1658 12.4357 12.4357 12.6719 12.6719 13.2975 13.2975 13.3727 13.3727 13.8851 13.8851 14.1118 14.1118 14.1669 14.1669 14.4508 14.4508 k = 0.0000 0.0000 0.1729 ( 8170 PWs) bands (ev): 1.0699 1.0699 1.7933 1.7933 2.7429 2.7429 2.8303 2.8303 6.1113 6.1113 6.3520 6.3520 6.4768 6.4768 6.6236 6.6236 6.7362 6.7362 6.8498 6.8498 7.1634 7.1634 7.3070 7.3070 7.3575 7.3575 7.5038 7.5038 7.7887 7.7887 7.9945 7.9945 8.1351 8.1351 8.2218 8.2218 8.4194 8.4194 8.5878 8.5878 9.1084 9.1084 9.2329 9.2329 9.4322 9.4322 9.6128 9.6128 9.7026 9.7026 9.8880 9.8880 10.1057 10.1057 10.3193 10.3193 10.4139 10.4139 11.0228 11.0228 11.4764 11.4764 11.6550 11.6550 11.7204 11.7204 11.9296 11.9296 12.1796 12.1796 12.4939 12.4939 12.6270 12.6270 13.2524 13.2524 13.3978 13.3978 13.9337 13.9337 14.1113 14.1113 14.1798 14.1798 14.4591 14.4591 k = 0.0000 0.0000 0.1852 ( 8168 PWs) bands (ev): 1.1099 1.1099 1.7338 1.7338 2.7522 2.7522 2.8310 2.8310 6.1334 6.1334 6.3455 6.3455 6.4953 6.4953 6.6293 6.6293 6.7348 6.7348 6.8362 6.8362 7.1686 7.1686 7.3212 7.3212 7.3399 7.3399 7.4954 7.4954 7.8144 7.8144 7.9938 7.9938 8.1317 8.1317 8.2375 8.2375 8.3954 8.3954 8.5580 8.5580 9.1151 9.1151 9.2415 9.2415 9.4359 9.4359 9.6030 9.6030 9.7086 9.7086 9.8783 9.8783 10.1056 10.1056 10.2991 10.2991 10.4290 10.4290 10.9906 10.9906 11.4929 11.4929 11.6514 11.6514 11.7212 11.7212 11.9013 11.9013 12.1953 12.1953 12.5485 12.5485 12.5861 12.5861 13.2048 13.2048 13.4300 13.4300 13.9807 13.9807 14.0804 14.0804 14.2146 14.2146 14.4632 14.4632 k = 0.0000 0.0000 0.1976 ( 8168 PWs) bands (ev): 1.1521 1.1521 1.6747 1.6747 2.7615 2.7615 2.8300 2.8300 6.1550 6.1550 6.3334 6.3334 6.5173 6.5173 6.6371 6.6371 6.7324 6.7324 6.8218 6.8218 7.1752 7.1752 7.3182 7.3182 7.3402 7.3402 7.4858 7.4858 7.8389 7.8389 7.9910 7.9910 8.1332 8.1332 8.2542 8.2542 8.3705 8.3705 8.5277 8.5277 9.1237 9.1237 9.2452 9.2452 9.4382 9.4382 9.5938 9.5938 9.7168 9.7168 9.8689 9.8689 10.1058 10.1058 10.2668 10.2668 10.4655 10.4655 10.9535 10.9535 11.5099 11.5099 11.6468 11.6468 11.7238 11.7238 11.8747 11.8747 12.2133 12.2133 12.5347 12.5347 12.6144 12.6144 13.1556 13.1556 13.4683 13.4683 14.0075 14.0075 14.0577 14.0577 14.2506 14.2506 14.4624 14.4627 k = 0.0000 0.0000 0.2099 ( 8168 PWs) bands (ev): 1.1966 1.1966 1.6164 1.6164 2.7707 2.7707 2.8274 2.8274 6.1759 6.1759 6.3187 6.3187 6.5399 6.5399 6.6450 6.6450 6.7298 6.7298 6.8070 6.8070 7.1833 7.1833 7.3004 7.3004 7.3557 7.3557 7.4750 7.4750 7.8619 7.8619 7.9855 7.9855 8.1405 8.1405 8.2708 8.2708 8.3462 8.3462 8.4973 8.4973 9.1342 9.1342 9.2427 9.2427 9.4433 9.4433 9.5818 9.5818 9.7288 9.7288 9.8588 9.8588 10.1071 10.1071 10.2341 10.2341 10.5108 10.5108 10.9123 10.9123 11.5272 11.5272 11.6407 11.6407 11.7285 11.7285 11.8500 11.8500 12.2338 12.2338 12.4934 12.4934 12.6710 12.6710 13.1052 13.1052 13.5124 13.5124 13.9698 13.9698 14.0911 14.0911 14.2836 14.2836 14.4481 14.4482 k = 0.0000 0.0000 0.2223 ( 8178 PWs) bands (ev): 1.2431 1.2431 1.5590 1.5590 2.7799 2.7799 2.8234 2.8234 6.1960 6.1960 6.3027 6.3027 6.5623 6.5623 6.6497 6.6497 6.7289 6.7289 6.7923 6.7923 7.1932 7.1932 7.2824 7.2824 7.3721 7.3721 7.4630 7.4630 7.8832 7.8832 7.9770 7.9770 8.1537 8.1537 8.2807 8.2807 8.3294 8.3294 8.4669 8.4669 9.1464 9.1464 9.2345 9.2345 9.4532 9.4532 9.5661 9.5661 9.7444 9.7444 9.8470 9.8470 10.1104 10.1104 10.2044 10.2044 10.5605 10.5605 10.8675 10.8675 11.5447 11.5447 11.6326 11.6326 11.7354 11.7354 11.8272 11.8272 12.2570 12.2570 12.4529 12.4529 12.7278 12.7278 13.0538 13.0538 13.5615 13.5615 13.9144 13.9144 14.1362 14.1362 14.3099 14.3099 14.4203 14.4203 k = 0.0000 0.0000 0.2346 ( 8166 PWs) bands (ev): 1.2916 1.2916 1.5027 1.5027 2.7887 2.7887 2.8182 2.8182 6.2152 6.2152 6.2861 6.2861 6.5840 6.5840 6.6478 6.6478 6.7323 6.7323 6.7781 6.7781 7.2047 7.2047 7.2649 7.2649 7.3886 7.3886 7.4499 7.4499 7.9029 7.9029 7.9658 7.9658 8.1722 8.1722 8.2694 8.2694 8.3353 8.3353 8.4371 8.4371 9.1602 9.1602 9.2220 9.2220 9.4678 9.4678 9.5474 9.5474 9.7624 9.7624 9.8333 9.8333 10.1167 10.1167 10.1787 10.1787 10.6125 10.6125 10.8198 10.8198 11.5620 11.5620 11.6221 11.6221 11.7449 11.7449 11.8065 11.8065 12.2831 12.2831 12.4142 12.4142 12.7840 12.7840 13.0015 13.0015 13.6151 13.6151 13.8546 13.8546 14.1812 14.1812 14.3196 14.3196 14.4012 14.4012 k = 0.0000 0.0000 0.2470 ( 8162 PWs) bands (ev): 1.3419 1.3419 1.4476 1.4476 2.7971 2.7971 2.8120 2.8120 6.2337 6.2337 6.2690 6.2690 6.6046 6.6046 6.6384 6.6384 6.7404 6.7404 6.7644 6.7644 7.2179 7.2179 7.2482 7.2482 7.4049 7.4049 7.4357 7.4357 7.9210 7.9210 7.9526 7.9526 8.1946 8.1946 8.2455 8.2455 8.3557 8.3557 8.4082 8.4082 9.1753 9.1753 9.2070 9.2070 9.4858 9.4858 9.5269 9.5269 9.7813 9.7813 9.8174 9.8174 10.1263 10.1263 10.1571 10.1571 10.6653 10.6653 10.7697 10.7697 11.5789 11.5789 11.6094 11.6094 11.7569 11.7569 11.7878 11.7878 12.3119 12.3119 12.3776 12.3776 12.8395 12.8395 12.9483 12.9483 13.6722 13.6722 13.7932 13.7932 14.2248 14.2248 14.3009 14.3009 14.4054 14.4054 k = 0.0000 0.0000 0.2593 ( 8168 PWs) bands (ev): 1.3940 1.3940 1.3940 1.3940 2.8049 2.8049 2.8049 2.8049 6.2516 6.2516 6.2516 6.2516 6.6232 6.6232 6.6232 6.6232 6.7516 6.7516 6.7516 6.7516 7.2324 7.2324 7.2324 7.2324 7.4206 7.4206 7.4206 7.4206 7.9375 7.9375 7.9375 7.9375 8.2196 8.2196 8.2196 8.2196 8.3808 8.3808 8.3808 8.3808 9.1911 9.1911 9.1911 9.1911 9.5060 9.5060 9.5060 9.5060 9.7999 9.7999 9.7999 9.7999 10.1397 10.1397 10.1397 10.1397 10.7180 10.7180 10.7180 10.7180 11.5948 11.5948 11.5948 11.5948 11.7712 11.7712 11.7712 11.7712 12.3435 12.3435 12.3435 12.3435 12.8943 12.8943 12.8943 12.8943 13.7320 13.7320 13.7320 13.7320 14.2657 14.2657 14.2657 14.2657 14.4210 14.4210 k = 0.0000 0.0000 0.2593 ( 8168 PWs) bands (ev): 1.3940 1.3940 1.3940 1.3940 2.8049 2.8049 2.8049 2.8049 6.2516 6.2516 6.2516 6.2516 6.6232 6.6232 6.6232 6.6232 6.7516 6.7516 6.7516 6.7516 7.2324 7.2324 7.2324 7.2324 7.4206 7.4206 7.4206 7.4206 7.9375 7.9375 7.9375 7.9375 8.2196 8.2196 8.2196 8.2196 8.3808 8.3808 8.3808 8.3808 9.1911 9.1911 9.1911 9.1911 9.5060 9.5060 9.5060 9.5060 9.7999 9.7999 9.7999 9.7999 10.1397 10.1397 10.1397 10.1397 10.7180 10.7180 10.7180 10.7180 11.5948 11.5948 11.5948 11.5948 11.7712 11.7712 11.7712 11.7712 12.3435 12.3435 12.3435 12.3435 12.8943 12.8943 12.8943 12.8943 13.7320 13.7320 13.7320 13.7320 14.2657 14.2657 14.2657 14.2657 14.4210 14.4210 k = 0.0125-0.0000 0.2593 ( 8166 PWs) bands (ev): 1.3952 1.3952 1.3954 1.3954 2.8050 2.8050 2.8053 2.8053 6.2510 6.2510 6.2528 6.2528 6.6209 6.6209 6.6260 6.6260 6.7460 6.7460 6.7584 6.7584 7.2203 7.2203 7.2456 7.2456 7.4200 7.4200 7.4214 7.4214 7.9279 7.9279 7.9471 7.9471 8.2141 8.2141 8.2241 8.2241 8.3791 8.3791 8.3827 8.3827 9.1754 9.1754 9.2033 9.2033 9.4933 9.4933 9.5129 9.5129 9.7909 9.7909 9.8167 9.8167 10.1373 10.1373 10.1415 10.1415 10.7134 10.7134 10.7203 10.7203 11.5783 11.5783 11.6021 11.6021 11.7643 11.7643 11.7803 11.7803 12.3282 12.3282 12.3569 12.3569 12.8889 12.8889 12.9014 12.9014 13.7245 13.7245 13.7423 13.7423 14.2636 14.2636 14.2682 14.2682 14.4192 14.4212 k = 0.0250-0.0000 0.2593 ( 8170 PWs) bands (ev): 1.3991 1.3991 1.3994 1.3994 2.8055 2.8055 2.8062 2.8062 6.2510 6.2510 6.2547 6.2547 6.6187 6.6187 6.6294 6.6294 6.7419 6.7419 6.7658 6.7658 7.2096 7.2096 7.2594 7.2594 7.4193 7.4193 7.4227 7.4227 7.9183 7.9183 7.9564 7.9564 8.2075 8.2075 8.2279 8.2279 8.3775 8.3775 8.3853 8.3853 9.1565 9.1565 9.2122 9.2122 9.4771 9.4771 9.5124 9.5124 9.7915 9.7915 9.8388 9.8388 10.1345 10.1345 10.1430 10.1430 10.7068 10.7068 10.7204 10.7204 11.5548 11.5548 11.5983 11.5983 11.7612 11.7612 11.7893 11.7893 12.3120 12.3120 12.3678 12.3678 12.8858 12.8858 12.9097 12.9097 13.7202 13.7202 13.7553 13.7553 14.2616 14.2616 14.2710 14.2710 14.4187 14.4193 k = 0.0375-0.0000 0.2593 ( 8170 PWs) bands (ev): 1.4055 1.4055 1.4061 1.4061 2.8065 2.8065 2.8076 2.8076 6.2515 6.2515 6.2572 6.2572 6.6165 6.6165 6.6336 6.6336 6.7399 6.7399 6.7736 6.7736 7.2007 7.2007 7.2733 7.2733 7.4183 7.4183 7.4248 7.4248 7.9090 7.9090 7.9653 7.9653 8.1998 8.1998 8.2310 8.2310 8.3756 8.3756 8.3884 8.3884 9.1347 9.1347 9.2178 9.2178 9.4591 9.4591 9.5040 9.5040 9.8020 9.8020 9.8641 9.8641 10.1311 10.1311 10.1441 10.1441 10.6983 10.6983 10.7182 10.7182 11.5259 11.5259 11.5835 11.5835 11.7619 11.7619 11.7967 11.7967 12.2953 12.2953 12.3752 12.3752 12.8852 12.8852 12.9187 12.9187 13.7191 13.7191 13.7708 13.7708 14.2585 14.2585 14.2733 14.2733 14.4208 14.4221 k = 0.0500-0.0000 0.2593 ( 8176 PWs) bands (ev): 1.4147 1.4147 1.4154 1.4154 2.8080 2.8080 2.8094 2.8094 6.2525 6.2525 6.2603 6.2603 6.6141 6.6141 6.6385 6.6385 6.7401 6.7401 6.7815 6.7815 7.1937 7.1937 7.2864 7.2864 7.4172 7.4172 7.4285 7.4285 7.9001 7.9001 7.9735 7.9735 8.1913 8.1913 8.2334 8.2334 8.3733 8.3733 8.3923 8.3923 9.1106 9.1106 9.2202 9.2202 9.4404 9.4404 9.4894 9.4894 9.8206 9.8206 9.8910 9.8910 10.1271 10.1271 10.1451 10.1451 10.6883 10.6883 10.7139 10.7139 11.4930 11.4930 11.5599 11.5599 11.7648 11.7648 11.8016 11.8016 12.2787 12.2787 12.3786 12.3786 12.8874 12.8874 12.9279 12.9279 13.7216 13.7216 13.7888 13.7888 14.2531 14.2531 14.2736 14.2736 14.4264 14.4265 k = 0.0625-0.0000 0.2593 ( 8180 PWs) bands (ev): 1.4264 1.4264 1.4273 1.4273 2.8099 2.8099 2.8116 2.8116 6.2538 6.2538 6.2638 6.2638 6.6115 6.6115 6.6443 6.6443 6.7429 6.7429 6.7893 6.7893 7.1888 7.1888 7.2980 7.2980 7.4158 7.4158 7.4343 7.4343 7.8918 7.8918 7.9808 7.9808 8.1821 8.1821 8.2349 8.2349 8.3707 8.3707 8.3968 8.3968 9.0849 9.0849 9.2198 9.2198 9.4214 9.4214 9.4707 9.4707 9.8450 9.8450 9.9180 9.9180 10.1226 10.1226 10.1460 10.1460 10.6770 10.6770 10.7077 10.7077 11.4569 11.4569 11.5295 11.5295 11.7679 11.7679 11.8035 11.8035 12.2622 12.2622 12.3774 12.3774 12.8922 12.8922 12.9368 12.9368 13.7278 13.7278 13.8091 13.8091 14.2446 14.2446 14.2708 14.2708 14.4363 14.4366 k = 0.0750-0.0000 0.2593 ( 8192 PWs) bands (ev): 1.4406 1.4406 1.4418 1.4418 2.8122 2.8122 2.8142 2.8142 6.2552 6.2552 6.2676 6.2676 6.6089 6.6089 6.6508 6.6508 6.7482 6.7482 6.7970 6.7970 7.1858 7.1858 7.3074 7.3074 7.4141 7.4141 7.4430 7.4430 7.8843 7.8843 7.9867 7.9867 8.1728 8.1728 8.2352 8.2352 8.3682 8.3682 8.4016 8.4016 9.0584 9.0584 9.2165 9.2165 9.4023 9.4023 9.4501 9.4501 9.8729 9.8729 9.9441 9.9441 10.1176 10.1176 10.1469 10.1469 10.6649 10.6649 10.6996 10.6996 11.4183 11.4183 11.4944 11.4944 11.7698 11.7698 11.8022 11.8022 12.2462 12.2462 12.3717 12.3717 12.8989 12.8989 12.9452 12.9452 13.7380 13.7380 13.8317 13.8317 14.2325 14.2325 14.2640 14.2640 14.4507 14.4508 k = 0.0875-0.0000 0.2593 ( 8188 PWs) bands (ev): 1.4574 1.4574 1.4588 1.4588 2.8149 2.8149 2.8172 2.8172 6.2566 6.2566 6.2716 6.2716 6.6064 6.6064 6.6580 6.6580 6.7558 6.7558 6.8045 6.8045 7.1846 7.1846 7.3139 7.3139 7.4125 7.4125 7.4549 7.4549 7.8777 7.8777 7.9907 7.9907 8.1640 8.1640 8.2336 8.2336 8.3662 8.3662 8.4066 8.4066 9.0321 9.0321 9.2106 9.2106 9.3832 9.3832 9.4293 9.4293 9.9022 9.9022 9.9685 9.9685 10.1124 10.1124 10.1481 10.1481 10.6525 10.6525 10.6901 10.6901 11.3776 11.3776 11.4557 11.4557 11.7697 11.7697 11.7977 11.7977 12.2305 12.2305 12.3616 12.3616 12.9069 12.9069 12.9527 12.9527 13.7523 13.7523 13.8565 13.8565 14.2173 14.2173 14.2532 14.2532 14.4691 14.4692 k = 0.1000-0.0000 0.2593 ( 8188 PWs) bands (ev): 1.4767 1.4767 1.4782 1.4782 2.8180 2.8180 2.8205 2.8205 6.2577 6.2577 6.2757 6.2757 6.6044 6.6044 6.6657 6.6657 6.7654 6.7654 6.8120 6.8120 7.1851 7.1851 7.3178 7.3178 7.4109 7.4109 7.4699 7.4699 7.8723 7.8723 7.9921 7.9921 8.1565 8.1565 8.2293 8.2293 8.3657 8.3657 8.4113 8.4113 9.0067 9.0067 9.2020 9.2020 9.3638 9.3638 9.4096 9.4096 9.9316 9.9316 9.9902 9.9902 10.1071 10.1071 10.1499 10.1499 10.6402 10.6402 10.6793 10.6793 11.3355 11.3355 11.4143 11.4143 11.7673 11.7673 11.7898 11.7898 12.2151 12.2151 12.3476 12.3476 12.9149 12.9149 12.9590 12.9590 13.7709 13.7709 13.8834 13.8834 14.1995 14.1995 14.2390 14.2390 14.4909 14.4909 k = 0.1125-0.0000 0.2593 ( 8164 PWs) bands (ev): 1.4984 1.4984 1.5002 1.5002 2.8213 2.8213 2.8242 2.8242 6.2582 6.2582 6.2795 6.2795 6.6032 6.6032 6.6737 6.6737 6.7767 6.7767 6.8196 6.8196 7.1869 7.1869 7.3194 7.3194 7.4098 7.4098 7.4876 7.4876 7.8681 7.8681 7.9904 7.9904 8.1511 8.1511 8.2214 8.2214 8.3674 8.3674 8.4156 8.4156 8.9832 8.9832 9.1908 9.1908 9.3443 9.3443 9.3917 9.3917 9.9595 9.9595 10.0081 10.0081 10.1023 10.1023 10.1524 10.1524 10.6284 10.6284 10.6674 10.6674 11.2924 11.2924 11.3711 11.3711 11.7626 11.7626 11.7788 11.7788 12.1996 12.1996 12.3303 12.3303 12.9221 12.9221 12.9640 12.9640 13.7938 13.7938 13.9120 13.9120 14.1797 14.1797 14.2221 14.2221 14.5151 14.5151 k = 0.1250-0.0000 0.2593 ( 8156 PWs) bands (ev): 1.5225 1.5225 1.5244 1.5244 2.8250 2.8250 2.8280 2.8280 6.2580 6.2580 6.2830 6.2830 6.6031 6.6031 6.6818 6.6818 6.7892 6.7892 6.8276 6.8276 7.1894 7.1894 7.3193 7.3193 7.4095 7.4095 7.5074 7.5074 7.8652 7.8652 7.9850 7.9850 8.1481 8.1481 8.2097 8.2097 8.3719 8.3719 8.4193 8.4193 8.9622 8.9622 9.1772 9.1772 9.3246 9.3246 9.3764 9.3764 9.9846 9.9846 10.0211 10.0211 10.0984 10.0984 10.1562 10.1562 10.6175 10.6175 10.6547 10.6547 11.2487 11.2487 11.3267 11.3267 11.7557 11.7557 11.7647 11.7647 12.1840 12.1840 12.3102 12.3102 12.9275 12.9275 12.9674 12.9674 13.8208 13.8208 13.9418 13.9418 14.1588 14.1588 14.2036 14.2036 14.5410 14.5412 k = 0.1375-0.0000 0.2593 ( 8176 PWs) bands (ev): 1.5489 1.5489 1.5511 1.5511 2.8288 2.8288 2.8320 2.8320 6.2569 6.2569 6.2857 6.2857 6.6044 6.6044 6.6900 6.6900 6.8027 6.8027 6.8360 6.8360 7.1921 7.1921 7.3180 7.3180 7.4104 7.4104 7.5288 7.5288 7.8639 7.8639 7.9760 7.9760 8.1478 8.1478 8.1943 8.1943 8.3792 8.3792 8.4221 8.4221 8.9443 8.9443 9.1617 9.1617 9.3049 9.3049 9.3640 9.3640 10.0057 10.0057 10.0284 10.0284 10.0960 10.0960 10.1617 10.1617 10.6079 10.6079 10.6413 10.6413 11.2048 11.2048 11.2815 11.2815 11.7465 11.7465 11.7476 11.7476 12.1679 12.1679 12.2879 12.2879 12.9306 12.9306 12.9694 12.9694 13.8516 13.8516 13.9720 13.9720 14.1371 14.1371 14.1849 14.1849 14.5678 14.5678 k = 0.1500-0.0000 0.2593 ( 8186 PWs) bands (ev): 1.5776 1.5776 1.5799 1.5799 2.8329 2.8329 2.8362 2.8362 6.2545 6.2545 6.2876 6.2876 6.6073 6.6073 6.6979 6.6979 6.8166 6.8166 6.8450 6.8450 7.1947 7.1947 7.3162 7.3162 7.4128 7.4128 7.5513 7.5513 7.8640 7.8640 7.9635 7.9635 8.1498 8.1498 8.1755 8.1755 8.3892 8.3892 8.4243 8.4243 8.9301 8.9301 9.1448 9.1448 9.2851 9.2851 9.3543 9.3543 10.0216 10.0216 10.0299 10.0299 10.0948 10.0948 10.1692 10.1692 10.5995 10.5995 10.6273 10.6273 11.1614 11.1614 11.2362 11.2362 11.7277 11.7277 11.7353 11.7353 12.1511 12.1511 12.2640 12.2640 12.9310 12.9310 12.9699 12.9699 13.8857 13.8857 14.0007 14.0007 14.1152 14.1152 14.1680 14.1680 14.5948 14.5949 k = 0.1625-0.0000 0.2593 ( 8190 PWs) bands (ev): 1.6085 1.6085 1.6109 1.6109 2.8370 2.8370 2.8404 2.8404 6.2506 6.2506 6.2884 6.2884 6.6117 6.6117 6.7055 6.7055 6.8305 6.8305 6.8547 6.8547 7.1967 7.1967 7.3142 7.3142 7.4172 7.4172 7.5745 7.5745 7.8655 7.8655 7.9481 7.9481 8.1535 8.1535 8.1542 8.1542 8.4015 8.4015 8.4260 8.4260 8.9200 8.9200 9.1270 9.1270 9.2657 9.2657 9.3475 9.3475 10.0267 10.0267 10.0319 10.0319 10.0936 10.0936 10.1785 10.1785 10.5923 10.5923 10.6129 10.6129 11.1189 11.1189 11.1912 11.1912 11.7050 11.7050 11.7221 11.7221 12.1335 12.1335 12.2387 12.2387 12.9285 12.9285 12.9690 12.9690 13.9221 13.9221 14.0240 14.0240 14.0936 14.0936 14.1567 14.1567 14.6211 14.6212 k = 0.1750-0.0000 0.2593 ( 8186 PWs) bands (ev): 1.6414 1.6414 1.6440 1.6440 2.8412 2.8412 2.8447 2.8447 6.2452 6.2452 6.2877 6.2877 6.6177 6.6177 6.7126 6.7126 6.8439 6.8439 6.8650 6.8650 7.1978 7.1978 7.3125 7.3125 7.4239 7.4239 7.5982 7.5982 7.8684 7.8684 7.9305 7.9305 8.1311 8.1311 8.1584 8.1584 8.4158 8.4158 8.4275 8.4275 8.9139 8.9139 9.1090 9.1090 9.2467 9.2467 9.3433 9.3433 10.0202 10.0202 10.0365 10.0365 10.0908 10.0908 10.1889 10.1889 10.5861 10.5861 10.5979 10.5979 11.0779 11.0779 11.1469 11.1469 11.6796 11.6796 11.7072 11.7072 12.1148 12.1148 12.2126 12.2126 12.9235 12.9235 12.9669 12.9669 13.9597 13.9597 14.0354 14.0354 14.0730 14.0730 14.1575 14.1575 14.6457 14.6516 k = 0.1875-0.0000 0.2593 ( 8194 PWs) bands (ev): 1.6763 1.6763 1.6791 1.6791 2.8455 2.8455 2.8490 2.8490 6.2380 6.2380 6.2853 6.2853 6.6253 6.6253 6.7190 6.7190 6.8565 6.8565 6.8760 6.8760 7.1982 7.1982 7.3114 7.3114 7.4328 7.4328 7.6222 7.6222 7.8725 7.8725 7.9110 7.9110 8.1070 8.1070 8.1640 8.1640 8.4294 8.4294 8.4319 8.4319 8.9120 8.9120 9.0914 9.0914 9.2286 9.2286 9.3416 9.3416 10.0114 10.0114 10.0362 10.0362 10.0857 10.0857 10.1992 10.1992 10.5803 10.5803 10.5822 10.5822 11.0388 11.0388 11.1039 11.1039 11.6516 11.6516 11.6904 11.6904 12.0950 12.0950 12.1859 12.1859 12.9163 12.9163 12.9639 12.9639 13.9945 13.9945 14.0316 14.0316 14.0569 14.0569 14.1736 14.1736 14.6667 14.6674 k = 0.2000-0.0000 0.2593 ( 8198 PWs) bands (ev): 1.7131 1.7131 1.7161 1.7161 2.8496 2.8496 2.8531 2.8531 6.2290 6.2290 6.2811 6.2811 6.6342 6.6342 6.7245 6.7245 6.8679 6.8679 6.8874 6.8874 7.1980 7.1980 7.3113 7.3113 7.4437 7.4437 7.6461 7.6461 7.8775 7.8775 7.8904 7.8904 8.0826 8.0826 8.1700 8.1700 8.4321 8.4321 8.4497 8.4497 8.9140 8.9140 9.0745 9.0745 9.2115 9.2115 9.3424 9.3424 10.0009 10.0009 10.0316 10.0316 10.0779 10.0779 10.2080 10.2080 10.5655 10.5655 10.5743 10.5743 11.0024 11.0024 11.0627 11.0627 11.6212 11.6212 11.6720 11.6720 12.0740 12.0740 12.1589 12.1589 12.9073 12.9073 12.9601 12.9601 14.0085 14.0085 14.0173 14.0173 14.0623 14.0623 14.1999 14.1999 14.6828 14.6829 k = 0.2125-0.0000 0.2593 ( 8202 PWs) bands (ev): 1.7517 1.7517 1.7548 1.7548 2.8537 2.8537 2.8571 2.8571 6.2181 6.2181 6.2747 6.2747 6.6442 6.6442 6.7290 6.7290 6.8777 6.8777 6.8993 6.8993 7.1977 7.1977 7.3123 7.3123 7.4564 7.4564 7.6697 7.6697 7.8694 7.8694 7.8832 7.8832 8.0591 8.0591 8.1760 8.1760 8.4360 8.4360 8.4690 8.4690 8.9196 8.9196 9.0589 9.0589 9.1960 9.1960 9.3455 9.3455 9.9887 9.9887 10.0231 10.0231 10.0677 10.0677 10.2143 10.2143 10.5477 10.5477 10.5673 10.5673 10.9689 10.9689 11.0234 11.0234 11.5883 11.5883 11.6518 11.6518 12.0520 12.0520 12.1318 12.1318 12.8972 12.8972 12.9560 12.9560 13.9956 13.9956 13.9980 13.9980 14.0947 14.0947 14.2304 14.2304 14.6934 14.6934 k = 0.2250-0.0000 0.2593 ( 8200 PWs) bands (ev): 1.7919 1.7919 1.7951 1.7951 2.8577 2.8577 2.8609 2.8609 6.2051 6.2051 6.2659 6.2659 6.6550 6.6550 6.7322 6.7322 6.8860 6.8860 6.9114 6.9114 7.1977 7.1977 7.3146 7.3146 7.4705 7.4705 7.6921 7.6921 7.8491 7.8491 7.8889 7.8889 8.0373 8.0373 8.1818 8.1818 8.4418 8.4418 8.4898 8.4898 8.9284 8.9284 9.0447 9.0447 9.1823 9.1823 9.3510 9.3510 9.9748 9.9748 10.0112 10.0112 10.0556 10.0556 10.2177 10.2177 10.5285 10.5285 10.5588 10.5588 10.9388 10.9388 10.9866 10.9866 11.5532 11.5532 11.6297 11.6297 12.0290 12.0290 12.1048 12.1048 12.8865 12.8865 12.9518 12.9518 13.9766 13.9766 13.9769 13.9769 14.1323 14.1323 14.2621 14.2621 14.7001 14.7002 k = 0.2375-0.0000 0.2593 ( 8192 PWs) bands (ev): 1.8336 1.8336 1.8368 1.8368 2.8614 2.8614 2.8645 2.8645 6.1901 6.1901 6.2546 6.2546 6.6660 6.6660 6.7338 6.7338 6.8928 6.8928 6.9238 6.9238 7.1985 7.1985 7.3182 7.3182 7.4852 7.4852 7.7117 7.7117 7.8316 7.8316 7.8940 7.8940 8.0187 8.0187 8.1873 8.1873 8.4495 8.4495 8.5121 8.5121 8.9399 8.9399 9.0323 9.0323 9.1710 9.1710 9.3587 9.3587 9.9589 9.9589 9.9962 9.9962 10.0422 10.0422 10.2175 10.2175 10.5077 10.5077 10.5480 10.5480 10.9121 10.9121 10.9524 10.9524 11.5159 11.5159 11.6058 11.6058 12.0052 12.0052 12.0780 12.0780 12.8760 12.8760 12.9479 12.9479 13.9543 13.9543 13.9572 13.9572 14.1698 14.1698 14.2931 14.2931 14.7046 14.7046 k = 0.2500-0.0000 0.2593 ( 8194 PWs) bands (ev): 1.8766 1.8766 1.8799 1.8799 2.8649 2.8649 2.8677 2.8677 6.1729 6.1729 6.2406 6.2406 6.6768 6.6768 6.7336 6.7336 6.8986 6.8986 6.9365 6.9365 7.2005 7.2005 7.3227 7.3227 7.5002 7.5002 7.7250 7.7250 7.8210 7.8210 7.8978 7.8978 8.0043 8.0043 8.1924 8.1924 8.4595 8.4595 8.5357 8.5357 8.9535 8.9535 9.0219 9.0219 9.1625 9.1625 9.3687 9.3687 9.9407 9.9407 9.9781 9.9781 10.0283 10.0283 10.2137 10.2137 10.4855 10.4855 10.5346 10.5346 10.8885 10.8885 10.9208 10.9208 11.4768 11.4768 11.5799 11.5799 11.9809 11.9809 12.0515 12.0515 12.8661 12.8661 12.9445 12.9445 13.9318 13.9318 13.9374 13.9374 14.2056 14.2056 14.3227 14.3227 14.7076 14.7076 k = 0.2625-0.0000 0.2593 ( 8178 PWs) bands (ev): 1.9208 1.9208 1.9242 1.9242 2.8681 2.8681 2.8706 2.8706 6.1536 6.1536 6.2238 6.2238 6.6867 6.6867 6.7315 6.7315 6.9039 6.9039 6.9495 6.9495 7.2039 7.2039 7.3279 7.3279 7.5149 7.5149 7.7269 7.7269 7.8229 7.8229 7.8997 7.8997 7.9955 7.9955 8.1970 8.1970 8.4718 8.4718 8.5608 8.5608 8.9687 8.9687 9.0136 9.0136 9.1573 9.1573 9.3809 9.3809 9.9199 9.9199 9.9572 9.9572 10.0143 10.0143 10.2063 10.2063 10.4620 10.4620 10.5184 10.5184 10.8675 10.8675 10.8916 10.8916 11.4360 11.4360 11.5519 11.5519 11.9563 11.9563 12.0254 12.0254 12.8575 12.8575 12.9420 12.9420 13.9093 13.9093 13.9178 13.9178 14.2392 14.2392 14.3503 14.3503 14.7099 14.7099 k = 0.2750-0.0000 0.2593 ( 8178 PWs) bands (ev): 1.9660 1.9660 1.9694 1.9694 2.8708 2.8708 2.8731 2.8731 6.1322 6.1322 6.2040 6.2040 6.6950 6.6950 6.7276 6.7276 6.9095 6.9095 6.9628 6.9628 7.2087 7.2087 7.3333 7.3333 7.5287 7.5287 7.7184 7.7184 7.8368 7.8368 7.9000 7.9000 7.9922 7.9922 8.2007 8.2007 8.4865 8.4865 8.5872 8.5872 8.9847 8.9847 9.0076 9.0076 9.1561 9.1561 9.3950 9.3950 9.8967 9.8967 9.9336 9.9336 10.0007 10.0007 10.1952 10.1952 10.4377 10.4377 10.4996 10.4996 10.8485 10.8485 10.8646 10.8646 11.3940 11.3940 11.5218 11.5218 11.9317 11.9317 11.9997 11.9997 12.8506 12.8506 12.9406 12.9406 13.8872 13.8872 13.8986 13.8986 14.2702 14.2702 14.3754 14.3754 14.7118 14.7118 k = 0.2875-0.0000 0.2593 ( 8178 PWs) bands (ev): 2.0120 2.0120 2.0153 2.0153 2.8732 2.8732 2.8751 2.8751 6.1088 6.1088 6.1814 6.1814 6.7011 6.7011 6.7220 6.7220 6.9163 6.9163 6.9762 6.9762 7.2150 7.2150 7.3382 7.3382 7.5415 7.5415 7.7056 7.7056 7.8573 7.8573 7.9000 7.9000 7.9935 7.9935 8.2036 8.2036 8.5034 8.5034 8.6148 8.6148 9.0011 9.0011 9.0040 9.0040 9.1592 9.1592 9.4108 9.4108 9.8711 9.8711 9.9076 9.9076 9.9877 9.9877 10.1806 10.1806 10.4133 10.4133 10.4783 10.4783 10.8304 10.8304 10.8392 10.8392 11.3511 11.3511 11.4896 11.4896 11.9074 11.9074 11.9745 11.9745 12.8458 12.8458 12.9404 12.9404 13.8655 13.8655 13.8797 13.8797 14.2987 14.2987 14.3979 14.3979 14.7135 14.7135 k = 0.3000-0.0000 0.2593 ( 8166 PWs) bands (ev): 2.0585 2.0585 2.0618 2.0618 2.8751 2.8751 2.8765 2.8765 6.0833 6.0833 6.1560 6.1560 6.7046 6.7046 6.7151 6.7151 6.9248 6.9248 6.9896 6.9896 7.2224 7.2224 7.3421 7.3421 7.5530 7.5530 7.6930 7.6930 7.8804 7.8804 7.9014 7.9014 7.9979 7.9979 8.2055 8.2055 8.5225 8.5225 8.6435 8.6435 9.0031 9.0031 9.0173 9.0173 9.1670 9.1670 9.4281 9.4281 9.8437 9.8437 9.8794 9.8794 9.9751 9.9751 10.1628 10.1628 10.3893 10.3893 10.4552 10.4552 10.8124 10.8124 10.8150 10.8150 11.3079 11.3079 11.4555 11.4555 11.8836 11.8836 11.9497 11.9497 12.8433 12.8433 12.9418 12.9418 13.8443 13.8443 13.8611 13.8611 14.3245 14.3245 14.4178 14.4178 14.7155 14.7155 k = 0.3125-0.0000 0.2593 ( 8166 PWs) bands (ev): 2.1054 2.1054 2.1086 2.1086 2.8764 2.8764 2.8774 2.8774 6.0562 6.0562 6.1280 6.1280 6.7053 6.7053 6.7071 6.7071 6.9353 6.9353 7.0026 7.0026 7.2309 7.2309 7.3445 7.3445 7.5635 7.5635 7.6827 7.6827 7.9044 7.9044 7.9052 7.9052 8.0040 8.0040 8.2062 8.2062 8.5437 8.5437 8.6728 8.6728 9.0050 9.0050 9.0331 9.0331 9.1795 9.1795 9.4464 9.4464 9.8148 9.8148 9.8496 9.8496 9.9630 9.9630 10.1422 10.1422 10.3662 10.3662 10.4305 10.4305 10.7914 10.7914 10.7937 10.7937 11.2648 11.2648 11.4195 11.4195 11.8604 11.8604 11.9253 11.9253 12.8435 12.8435 12.9446 12.9446 13.8236 13.8236 13.8430 13.8430 14.3478 14.3478 14.4352 14.4352 14.7177 14.7177 k = 0.3250-0.0000 0.2593 ( 8166 PWs) bands (ev): 2.1524 2.1524 2.1554 2.1554 2.8772 2.8772 2.8777 2.8777 6.0275 6.0275 6.0977 6.0977 6.6986 6.6986 6.7035 6.7035 6.9478 6.9478 7.0151 7.0151 7.2400 7.2400 7.3449 7.3449 7.5736 7.5736 7.6761 7.6761 7.9118 7.9118 7.9280 7.9280 8.0109 8.0109 8.2055 8.2055 8.5668 8.5668 8.7024 8.7024 9.0100 9.0100 9.0488 9.0488 9.1960 9.1960 9.4652 9.4652 9.7852 9.7852 9.8184 9.8184 9.9511 9.9511 10.1191 10.1191 10.3444 10.3444 10.4050 10.4050 10.7681 10.7681 10.7736 10.7736 11.2226 11.2226 11.3820 11.3820 11.8381 11.8381 11.9014 11.9014 12.8463 12.8463 12.9490 12.9490 13.8036 13.8036 13.8253 13.8253 14.3688 14.3688 14.4501 14.4501 14.7204 14.7204 k = 0.3375-0.0000 0.2593 ( 8158 PWs) bands (ev): 2.1993 2.1993 2.2020 2.2020 2.8773 2.8773 2.8773 2.8773 5.9976 5.9976 6.0655 6.0655 6.6899 6.6899 6.6997 6.6997 6.9617 6.9617 7.0266 7.0266 7.2494 7.2494 7.3432 7.3432 7.5839 7.5839 7.6737 7.6737 7.9209 7.9209 7.9507 7.9507 8.0180 8.0180 8.2035 8.2035 8.5915 8.5915 8.7317 8.7317 9.0183 9.0183 9.0649 9.0649 9.2159 9.2159 9.4838 9.4838 9.7555 9.7555 9.7864 9.7864 9.9395 9.9395 10.0942 10.0942 10.3241 10.3241 10.3790 10.3790 10.7448 10.7448 10.7514 10.7514 11.1819 11.1819 11.3433 11.3433 11.8166 11.8166 11.8779 11.8779 12.8518 12.8518 12.9549 12.9549 13.7842 13.7842 13.8079 13.8079 14.3876 14.3876 14.4629 14.4629 14.7238 14.7238 k = 0.3500-0.0000 0.2593 ( 8162 PWs) bands (ev): 2.2456 2.2456 2.2481 2.2481 2.8762 2.8762 2.8767 2.8767 5.9670 5.9670 6.0317 6.0317 6.6813 6.6813 6.6943 6.6943 6.9766 6.9766 7.0368 7.0368 7.2587 7.2587 7.3396 7.3396 7.5953 7.5953 7.6759 7.6759 7.9321 7.9321 7.9717 7.9717 8.0252 8.0252 8.2001 8.2001 8.6176 8.6176 8.7600 8.7600 9.0303 9.0303 9.0816 9.0816 9.2378 9.2378 9.5015 9.5015 9.7261 9.7261 9.7543 9.7543 9.9279 9.9279 10.0681 10.0681 10.3057 10.3057 10.3532 10.3532 10.7212 10.7212 10.7268 10.7268 11.1433 11.1433 11.3038 11.3038 11.7961 11.7961 11.8548 11.8548 12.8600 12.8600 12.9621 12.9621 13.7654 13.7654 13.7909 13.7909 14.4046 14.4046 14.4738 14.4738 14.7277 14.7277 k = 0.3625-0.0000 0.2593 ( 8152 PWs) bands (ev): 2.2912 2.2912 2.2934 2.2934 2.8743 2.8743 2.8754 2.8754 5.9360 5.9360 5.9971 5.9971 6.6731 6.6731 6.6879 6.6879 6.9919 6.9919 7.0457 7.0457 7.2676 7.2676 7.3343 7.3343 7.6086 7.6086 7.6824 7.6824 7.9442 7.9442 7.9904 7.9904 8.0323 8.0323 8.1954 8.1954 8.6449 8.6449 8.7866 8.7866 9.0459 9.0459 9.0994 9.0994 9.2609 9.2609 9.5172 9.5172 9.6979 9.6979 9.7229 9.7229 9.9165 9.9165 10.0414 10.0414 10.2894 10.2894 10.3279 10.3279 10.6974 10.6974 10.6997 10.6997 11.1073 11.1073 11.2640 11.2640 11.7767 11.7767 11.8323 11.8323 12.8705 12.8705 12.9706 12.9706 13.7474 13.7474 13.7742 13.7742 14.4198 14.4198 14.4830 14.4830 14.7324 14.7324 k = 0.3750-0.0000 0.2593 ( 8152 PWs) bands (ev): 2.3357 2.3357 2.3375 2.3375 2.8717 2.8717 2.8732 2.8732 5.9053 5.9053 5.9622 5.9622 6.6654 6.6654 6.6810 6.6810 7.0067 7.0067 7.0532 7.0532 7.2757 7.2757 7.3281 7.3281 7.6243 7.6243 7.6931 7.6931 7.9563 7.9563 8.0060 8.0060 8.0395 8.0395 8.1897 8.1897 8.6730 8.6730 8.8108 8.8108 9.0654 9.0654 9.1185 9.1185 9.2838 9.2838 9.5293 9.5293 9.6717 9.6717 9.6935 9.6935 9.9052 9.9052 10.0147 10.0147 10.2756 10.2756 10.3038 10.3038 10.6701 10.6701 10.6732 10.6732 11.0744 11.0744 11.2244 11.2244 11.7583 11.7583 11.8105 11.8105 12.8832 12.8832 12.9800 12.9800 13.7301 13.7301 13.7579 13.7579 14.4335 14.4335 14.4908 14.4908 14.7377 14.7377 k = 0.3875-0.0000 0.2593 ( 8146 PWs) bands (ev): 2.3788 2.3788 2.3802 2.3802 2.8682 2.8682 2.8702 2.8702 5.8753 5.8753 5.9276 5.9276 6.6584 6.6584 6.6740 6.6740 7.0208 7.0208 7.0592 7.0592 7.2827 7.2827 7.3215 7.3215 7.6427 7.6427 7.7072 7.7072 7.9671 7.9671 8.0180 8.0180 8.0471 8.0471 8.1833 8.1833 8.7018 8.7018 8.8322 8.8322 9.0883 9.0883 9.1385 9.1385 9.3056 9.3056 9.5357 9.5357 9.6482 9.6482 9.6679 9.6679 9.8940 9.8940 9.9887 9.9887 10.2646 10.2646 10.2814 10.2814 10.6383 10.6383 10.6488 10.6488 11.0449 11.0449 11.1855 11.1855 11.7412 11.7412 11.7894 11.7894 12.8976 12.8976 12.9899 12.9899 13.7137 13.7137 13.7420 13.7420 14.4459 14.4459 14.4972 14.4972 14.7436 14.7436 k = 0.4000-0.0000 0.2593 ( 8130 PWs) bands (ev): 2.4200 2.4200 2.4209 2.4209 2.8638 2.8638 2.8663 2.8663 5.8468 5.8468 5.8941 5.8941 6.6521 6.6521 6.6671 6.6671 7.0335 7.0335 7.0640 7.0640 7.2885 7.2885 7.3151 7.3151 7.6641 7.6641 7.7244 7.7244 7.9755 7.9755 8.0255 8.0255 8.0557 8.0557 8.1767 8.1767 8.7306 8.7306 8.8508 8.8508 9.1140 9.1140 9.1591 9.1591 9.3252 9.3252 9.5340 9.5340 9.6286 9.6286 9.6485 9.6485 9.8831 9.8831 9.9638 9.9638 10.2566 10.2566 10.2612 10.2612 10.6050 10.6050 10.6242 10.6242 11.0190 11.0190 11.1479 11.1479 11.7255 11.7255 11.7693 11.7693 12.9135 12.9135 13.0001 13.0001 13.6982 13.6982 13.7265 13.7265 14.4570 14.4570 14.5025 14.5025 14.7500 14.7500 k = 0.4125-0.0000 0.2593 ( 8134 PWs) bands (ev): 2.4590 2.4590 2.4594 2.4594 2.8587 2.8587 2.8615 2.8615 5.8201 5.8201 5.8622 5.8622 6.6467 6.6467 6.6605 6.6605 7.0446 7.0446 7.0676 7.0676 7.2931 7.2931 7.3094 7.3094 7.6882 7.6882 7.7439 7.7439 7.9804 7.9804 8.0278 8.0278 8.0655 8.0655 8.1704 8.1704 8.7592 8.7592 8.8665 8.8665 9.1414 9.1414 9.1798 9.1798 9.3415 9.3415 9.5229 9.5229 9.6135 9.6135 9.6365 9.6365 9.8726 9.8726 9.9406 9.9406 10.2440 10.2440 10.2518 10.2518 10.5710 10.5710 10.5994 10.5994 10.9968 10.9968 11.1120 11.1120 11.7113 11.7113 11.7504 11.7504 12.9304 12.9304 13.0100 13.0100 13.6840 13.6840 13.7115 13.7115 14.4670 14.4670 14.5068 14.5068 14.7568 14.7568 k = 0.4250-0.0000 0.2593 ( 8128 PWs) bands (ev): 2.4952 2.4952 2.4952 2.4952 2.8528 2.8528 2.8558 2.8558 5.7961 5.7961 5.8326 5.8326 6.6421 6.6421 6.6544 6.6544 7.0538 7.0538 7.0703 7.0703 7.2964 7.2964 7.3047 7.3047 7.7145 7.7145 7.7653 7.7653 7.9815 7.9815 8.0245 8.0245 8.0763 8.0763 8.1650 8.1650 8.7870 8.7870 8.8795 8.8795 9.1693 9.1693 9.1999 9.1999 9.3541 9.3541 9.5044 9.5044 9.6036 9.6036 9.6301 9.6301 9.8628 9.8628 9.9193 9.9193 10.2303 10.2303 10.2502 10.2502 10.5375 10.5375 10.5747 10.5747 10.9784 10.9784 11.0785 11.0785 11.6989 11.6989 11.7330 11.7330 12.9477 12.9477 13.0191 13.0191 13.6712 13.6712 13.6972 13.6972 14.4760 14.4760 14.5101 14.5101 14.7637 14.7638 k = 0.4375-0.0000 0.2593 ( 8134 PWs) bands (ev): 2.5278 2.5278 2.5282 2.5282 2.8463 2.8463 2.8494 2.8494 5.7752 5.7752 5.8059 5.8059 6.6384 6.6384 6.6490 6.6490 7.0612 7.0612 7.0723 7.0723 7.2985 7.2985 7.3012 7.3012 7.7426 7.7426 7.7877 7.7877 7.9788 7.9788 8.0157 8.0157 8.0878 8.0878 8.1605 8.1605 8.8132 8.8132 8.8899 8.8899 9.1963 9.1963 9.2187 9.2187 9.3630 9.3630 9.4822 9.4822 9.5986 9.5986 9.6262 9.6262 9.8540 9.8540 9.9001 9.9001 10.2208 10.2208 10.2511 10.2511 10.5058 10.5058 10.5502 10.5502 10.9638 10.9638 11.0478 11.0478 11.6884 11.6884 11.7172 11.7172 12.9649 12.9649 13.0269 13.0269 13.6601 13.6601 13.6838 13.6838 14.4840 14.4840 14.5124 14.5124 14.7708 14.7710 k = 0.4500-0.0000 0.2593 ( 8122 PWs) bands (ev): 2.5566 2.5566 2.5572 2.5572 2.8396 2.8396 2.8425 2.8425 5.7579 5.7579 5.7826 5.7826 6.6356 6.6356 6.6443 6.6443 7.0668 7.0668 7.0737 7.0737 7.2990 7.2990 7.2997 7.2997 7.7717 7.7717 7.8104 7.8104 7.9727 7.9727 8.0021 8.0021 8.0992 8.0992 8.1566 8.1566 8.8373 8.8373 8.8977 8.8977 9.2211 9.2211 9.2356 9.2356 9.3690 9.3690 9.4592 9.4592 9.5978 9.5978 9.6230 9.6230 9.8467 9.8467 9.8831 9.8831 10.2159 10.2159 10.2533 10.2533 10.4780 10.4780 10.5261 10.5261 10.9531 10.9531 11.0205 11.0205 11.6801 11.6801 11.7034 11.7034 12.9814 12.9814 13.0329 13.0329 13.6511 13.6511 13.6715 13.6715 14.4911 14.4911 14.5138 14.5138 14.7778 14.7780 k = 0.4625-0.0000 0.2593 ( 8124 PWs) bands (ev): 2.5807 2.5807 2.5815 2.5815 2.8331 2.8331 2.8357 2.8357 5.7446 5.7446 5.7633 5.7633 6.6337 6.6337 6.6403 6.6403 7.0707 7.0707 7.0748 7.0748 7.2978 7.2978 7.3001 7.3001 7.8010 7.8010 7.8326 7.8326 7.9637 7.9637 7.9846 7.9846 8.1102 8.1102 8.1527 8.1527 8.8584 8.8584 8.9028 8.9028 9.2423 9.2423 9.2499 9.2499 9.3734 9.3734 9.4373 9.4373 9.5996 9.5996 9.6199 9.6199 9.8413 9.8413 9.8685 9.8685 10.2159 10.2159 10.2546 10.2546 10.4565 10.4565 10.5029 10.5029 10.9465 10.9465 10.9969 10.9969 11.6741 11.6741 11.6917 11.6917 12.9967 12.9967 13.0365 13.0365 13.6445 13.6445 13.6607 13.6607 14.4972 14.4972 14.5143 14.5143 14.7842 14.7847 k = 0.4750-0.0000 0.2593 ( 8126 PWs) bands (ev): 2.5993 2.5993 2.6000 2.6000 2.8275 2.8275 2.8295 2.8295 5.7358 5.7358 5.7483 5.7483 6.6326 6.6326 6.6371 6.6371 7.0733 7.0733 7.0754 7.0754 7.2975 7.2975 7.2999 7.2999 7.8293 7.8293 7.8527 7.8527 7.9529 7.9529 7.9650 7.9650 8.1202 8.1202 8.1483 8.1483 8.8759 8.8759 8.9049 8.9049 9.2585 9.2585 9.2614 9.2614 9.3775 9.3775 9.4179 9.4179 9.6028 9.6028 9.6167 9.6167 9.8383 9.8383 9.8565 9.8565 10.2203 10.2203 10.2530 10.2530 10.4439 10.4439 10.4814 10.4814 10.9439 10.9439 10.9775 10.9775 11.6705 11.6705 11.6823 11.6823 13.0102 13.0102 13.0373 13.0373 13.6404 13.6404 13.6518 13.6518 14.5024 14.5024 14.5138 14.5138 14.7907 14.7918 k = 0.4875-0.0000 0.2593 ( 8114 PWs) bands (ev): 2.6112 2.6112 2.6117 2.6117 2.8239 2.8239 2.8250 2.8250 5.7316 5.7316 5.7379 5.7379 6.6325 6.6325 6.6347 6.6347 7.0748 7.0748 7.0757 7.0757 7.2978 7.2978 7.2993 7.2993 7.8542 7.8542 7.8675 7.8675 7.9422 7.9422 7.9469 7.9469 8.1291 8.1291 8.1431 8.1431 8.8893 8.8893 8.9036 8.9036 9.2685 9.2685 9.2691 9.2691 9.3827 9.3827 9.4021 9.4021 9.6064 9.6064 9.6134 9.6134 9.8382 9.8382 9.8473 9.8473 10.2282 10.2282 10.2471 10.2471 10.4415 10.4415 10.4626 10.4626 10.9457 10.9457 10.9624 10.9624 11.6695 11.6695 11.6755 11.6755 13.0213 13.0213 13.0350 13.0350 13.6392 13.6392 13.6450 13.6450 14.5067 14.5067 14.5124 14.5124 14.7962 14.7969 k = 0.5000-0.0000 0.2593 ( 8116 PWs) bands (ev): 2.6155 2.6155 2.6155 2.6155 2.8230 2.8230 2.8230 2.8230 5.7323 5.7323 5.7323 5.7323 6.6332 6.6332 6.6332 6.6332 7.0755 7.0755 7.0755 7.0755 7.2985 7.2985 7.2985 7.2985 7.8695 7.8695 7.8695 7.8695 7.9377 7.9377 7.9377 7.9377 8.1367 8.1367 8.1367 8.1367 8.8986 8.8986 8.8986 8.8986 9.2719 9.2719 9.2719 9.2719 9.3905 9.3905 9.3905 9.3905 9.6099 9.6099 9.6099 9.6099 9.8411 9.8411 9.8411 9.8411 10.2380 10.2380 10.2380 10.2380 10.4486 10.4486 10.4486 10.4486 10.9518 10.9518 10.9518 10.9518 11.6712 11.6712 11.6712 11.6712 13.0297 13.0297 13.0297 13.0297 13.6407 13.6407 13.6407 13.6407 14.5100 14.5100 14.5100 14.5100 14.8007 14.8007 k = 0.5000-0.0000 0.2593 ( 8116 PWs) bands (ev): 2.6155 2.6155 2.6155 2.6155 2.8230 2.8230 2.8230 2.8230 5.7323 5.7323 5.7323 5.7323 6.6332 6.6332 6.6332 6.6332 7.0755 7.0755 7.0755 7.0755 7.2985 7.2985 7.2985 7.2985 7.8695 7.8695 7.8695 7.8695 7.9377 7.9377 7.9377 7.9377 8.1367 8.1367 8.1367 8.1367 8.8986 8.8986 8.8986 8.8986 9.2719 9.2719 9.2719 9.2719 9.3905 9.3905 9.3905 9.3905 9.6099 9.6099 9.6099 9.6099 9.8411 9.8411 9.8411 9.8411 10.2380 10.2380 10.2380 10.2380 10.4486 10.4486 10.4486 10.4486 10.9518 10.9518 10.9518 10.9518 11.6712 11.6712 11.6712 11.6712 13.0297 13.0297 13.0297 13.0297 13.6407 13.6407 13.6407 13.6407 14.5100 14.5100 14.5100 14.5100 14.8007 14.8007 k = 0.5000 0.0124 0.2593 ( 8124 PWs) bands (ev): 2.6158 2.6158 2.6158 2.6158 2.8228 2.8228 2.8228 2.8228 5.7328 5.7328 5.7328 5.7328 6.6320 6.6320 6.6320 6.6320 7.0761 7.0761 7.0761 7.0761 7.2988 7.2988 7.2988 7.2988 7.8692 7.8692 7.8692 7.8692 7.9368 7.9368 7.9368 7.9368 8.1375 8.1375 8.1375 8.1375 8.8974 8.8974 8.8974 8.8974 9.2710 9.2710 9.2710 9.2710 9.3907 9.3907 9.3907 9.3907 9.6096 9.6096 9.6096 9.6096 9.8410 9.8410 9.8410 9.8410 10.2382 10.2382 10.2382 10.2382 10.4476 10.4476 10.4476 10.4476 10.9557 10.9557 10.9557 10.9557 11.6722 11.6722 11.6722 11.6722 13.0288 13.0288 13.0288 13.0288 13.6408 13.6408 13.6408 13.6408 14.5098 14.5098 14.5098 14.5098 14.7976 14.7976 k = 0.5000 0.0249 0.2593 ( 8140 PWs) bands (ev): 2.6166 2.6166 2.6166 2.6166 2.8224 2.8224 2.8224 2.8224 5.7343 5.7343 5.7343 5.7343 6.6283 6.6283 6.6283 6.6283 7.0777 7.0777 7.0777 7.0777 7.2995 7.2995 7.2995 7.2995 7.8683 7.8683 7.8683 7.8683 7.9340 7.9340 7.9340 7.9340 8.1401 8.1401 8.1401 8.1401 8.8938 8.8938 8.8938 8.8938 9.2685 9.2685 9.2685 9.2685 9.3913 9.3913 9.3913 9.3913 9.6085 9.6085 9.6085 9.6085 9.8406 9.8406 9.8406 9.8406 10.2387 10.2387 10.2387 10.2387 10.4451 10.4451 10.4451 10.4451 10.9672 10.9672 10.9672 10.9672 11.6751 11.6751 11.6751 11.6751 13.0262 13.0262 13.0262 13.0262 13.6410 13.6410 13.6410 13.6410 14.5091 14.5091 14.5091 14.5091 14.7897 14.7897 k = 0.5000 0.0373 0.2593 ( 8136 PWs) bands (ev): 2.6180 2.6180 2.6180 2.6180 2.8218 2.8218 2.8218 2.8218 5.7367 5.7367 5.7367 5.7367 6.6222 6.6222 6.6222 6.6222 7.0803 7.0803 7.0803 7.0803 7.3007 7.3007 7.3007 7.3007 7.8666 7.8666 7.8666 7.8666 7.9295 7.9295 7.9295 7.9295 8.1444 8.1444 8.1444 8.1444 8.8881 8.8881 8.8881 8.8881 9.2643 9.2643 9.2643 9.2643 9.3922 9.3922 9.3922 9.3922 9.6064 9.6064 9.6064 9.6064 9.8400 9.8400 9.8400 9.8400 10.2391 10.2391 10.2391 10.2391 10.4421 10.4421 10.4421 10.4421 10.9854 10.9854 10.9854 10.9854 11.6798 11.6798 11.6798 11.6798 13.0221 13.0221 13.0221 13.0221 13.6411 13.6411 13.6411 13.6411 14.5083 14.5083 14.5083 14.5083 14.7794 14.7794 k = 0.5000 0.0498 0.2593 ( 8128 PWs) bands (ev): 2.6200 2.6200 2.6200 2.6200 2.8208 2.8208 2.8208 2.8208 5.7401 5.7401 5.7401 5.7401 6.6137 6.6137 6.6137 6.6137 7.0839 7.0839 7.0839 7.0839 7.3024 7.3024 7.3024 7.3024 7.8643 7.8643 7.8643 7.8643 7.9236 7.9236 7.9236 7.9236 8.1505 8.1505 8.1505 8.1505 8.8806 8.8806 8.8806 8.8806 9.2583 9.2583 9.2583 9.2583 9.3933 9.3933 9.3933 9.3933 9.6031 9.6031 9.6031 9.6031 9.8395 9.8395 9.8395 9.8395 10.2390 10.2390 10.2390 10.2390 10.4398 10.4398 10.4398 10.4398 11.0094 11.0094 11.0094 11.0094 11.6863 11.6863 11.6863 11.6863 13.0167 13.0167 13.0167 13.0167 13.6411 13.6411 13.6411 13.6411 14.5074 14.5074 14.5074 14.5074 14.7686 14.7686 k = 0.5000 0.0622 0.2593 ( 8132 PWs) bands (ev): 2.6224 2.6224 2.6224 2.6224 2.8196 2.8196 2.8196 2.8196 5.7446 5.7446 5.7446 5.7446 6.6028 6.6028 6.6028 6.6028 7.0884 7.0884 7.0884 7.0884 7.3045 7.3045 7.3045 7.3045 7.8610 7.8610 7.8610 7.8610 7.9165 7.9165 7.9165 7.9165 8.1585 8.1585 8.1585 8.1585 8.8716 8.8716 8.8716 8.8716 9.2505 9.2505 9.2505 9.2505 9.3946 9.3946 9.3946 9.3946 9.5981 9.5981 9.5981 9.5981 9.8390 9.8390 9.8390 9.8390 10.2381 10.2381 10.2381 10.2381 10.4396 10.4396 10.4396 10.4396 11.0381 11.0381 11.0381 11.0381 11.6942 11.6942 11.6942 11.6942 13.0104 13.0104 13.0104 13.0104 13.6407 13.6407 13.6407 13.6407 14.5069 14.5069 14.5069 14.5069 14.7581 14.7581 k = 0.5000 0.0746 0.2593 ( 8132 PWs) bands (ev): 2.6254 2.6254 2.6254 2.6254 2.8180 2.8180 2.8180 2.8180 5.7502 5.7502 5.7502 5.7502 6.5895 6.5895 6.5895 6.5895 7.0936 7.0936 7.0936 7.0936 7.3072 7.3072 7.3072 7.3072 7.8568 7.8568 7.8568 7.8568 7.9084 7.9084 7.9084 7.9084 8.1683 8.1683 8.1683 8.1683 8.8616 8.8616 8.8616 8.8616 9.2408 9.2408 9.2408 9.2408 9.3957 9.3957 9.3957 9.3957 9.5912 9.5912 9.5912 9.5912 9.8386 9.8386 9.8386 9.8386 10.2365 10.2365 10.2365 10.2365 10.4422 10.4422 10.4422 10.4422 11.0703 11.0703 11.0703 11.0703 11.7034 11.7034 11.7034 11.7034 13.0038 13.0038 13.0038 13.0038 13.6396 13.6396 13.6396 13.6396 14.5070 14.5070 14.5070 14.5070 14.7485 14.7485 k = 0.5000 0.0871 0.2593 ( 8128 PWs) bands (ev): 2.6289 2.6289 2.6289 2.6289 2.8162 2.8162 2.8162 2.8162 5.7570 5.7570 5.7570 5.7570 6.5739 6.5739 6.5739 6.5739 7.0994 7.0994 7.0994 7.0994 7.3103 7.3103 7.3103 7.3103 7.8514 7.8514 7.8514 7.8514 7.8999 7.8999 7.8999 7.8999 8.1802 8.1802 8.1802 8.1802 8.8509 8.8509 8.8509 8.8509 9.2295 9.2295 9.2295 9.2295 9.3966 9.3966 9.3966 9.3966 9.5822 9.5822 9.5822 9.5822 9.8381 9.8381 9.8381 9.8381 10.2346 10.2346 10.2346 10.2346 10.4477 10.4477 10.4477 10.4477 11.1051 11.1051 11.1051 11.1051 11.7136 11.7136 11.7136 11.7136 12.9972 12.9972 12.9972 12.9972 13.6375 13.6375 13.6375 13.6375 14.5080 14.5080 14.5080 14.5080 14.7400 14.7400 k = 0.5000 0.0995 0.2593 ( 8120 PWs) bands (ev): 2.6328 2.6328 2.6328 2.6328 2.8141 2.8141 2.8141 2.8141 5.7650 5.7650 5.7650 5.7650 6.5560 6.5560 6.5560 6.5560 7.1058 7.1058 7.1058 7.1058 7.3138 7.3138 7.3138 7.3138 7.8447 7.8447 7.8447 7.8447 7.8913 7.8913 7.8913 7.8913 8.1941 8.1941 8.1941 8.1941 8.8399 8.8399 8.8399 8.8399 9.2166 9.2166 9.2166 9.2166 9.3968 9.3968 9.3968 9.3968 9.5713 9.5713 9.5713 9.5713 9.8370 9.8370 9.8370 9.8370 10.2334 10.2334 10.2334 10.2334 10.4559 10.4559 10.4559 10.4559 11.1418 11.1418 11.1418 11.1418 11.7243 11.7243 11.7243 11.7243 12.9914 12.9914 12.9914 12.9914 13.6341 13.6341 13.6341 13.6341 14.5103 14.5103 14.5103 14.5103 14.7325 14.7325 k = 0.5000 0.1119 0.2593 ( 8128 PWs) bands (ev): 2.6373 2.6373 2.6373 2.6373 2.8116 2.8116 2.8116 2.8116 5.7742 5.7742 5.7742 5.7742 6.5359 6.5359 6.5359 6.5359 7.1126 7.1126 7.1126 7.1126 7.3177 7.3177 7.3177 7.3177 7.8368 7.8368 7.8368 7.8368 7.8828 7.8828 7.8828 7.8828 8.2100 8.2100 8.2100 8.2100 8.8290 8.8290 8.8290 8.8290 9.2023 9.2023 9.2023 9.2023 9.3958 9.3958 9.3958 9.3958 9.5588 9.5588 9.5588 9.5588 9.8350 9.8350 9.8350 9.8350 10.2338 10.2338 10.2338 10.2338 10.4661 10.4661 10.4661 10.4661 11.1797 11.1797 11.1797 11.1797 11.7351 11.7351 11.7351 11.7351 12.9868 12.9868 12.9868 12.9868 13.6291 13.6291 13.6291 13.6291 14.5140 14.5140 14.5140 14.5140 14.7262 14.7262 k = 0.5000 0.1244 0.2593 ( 8136 PWs) bands (ev): 2.6421 2.6421 2.6421 2.6421 2.8089 2.8089 2.8089 2.8089 5.7848 5.7848 5.7848 5.7848 6.5137 6.5137 6.5137 6.5137 7.1197 7.1197 7.1197 7.1197 7.3219 7.3219 7.3219 7.3219 7.8276 7.8276 7.8276 7.8276 7.8747 7.8747 7.8747 7.8747 8.2281 8.2281 8.2281 8.2281 8.8183 8.8183 8.8183 8.8183 9.1869 9.1869 9.1869 9.1869 9.3927 9.3927 9.3927 9.3927 9.5458 9.5458 9.5458 9.5458 9.8316 9.8316 9.8316 9.8316 10.2367 10.2367 10.2367 10.2367 10.4776 10.4776 10.4776 10.4776 11.2183 11.2183 11.2183 11.2183 11.7455 11.7455 11.7455 11.7455 12.9841 12.9841 12.9841 12.9841 13.6223 13.6223 13.6223 13.6223 14.5193 14.5193 14.5193 14.5193 14.7209 14.7209 k = 0.5000 0.1368 0.2593 ( 8148 PWs) bands (ev): 2.6474 2.6474 2.6474 2.6474 2.8057 2.8057 2.8057 2.8057 5.7968 5.7968 5.7968 5.7968 6.4895 6.4895 6.4895 6.4895 7.1270 7.1270 7.1270 7.1270 7.3263 7.3263 7.3263 7.3263 7.8176 7.8176 7.8176 7.8176 7.8670 7.8670 7.8670 7.8670 8.2481 8.2481 8.2481 8.2481 8.8083 8.8083 8.8083 8.8083 9.1707 9.1707 9.1707 9.1707 9.3866 9.3866 9.3866 9.3866 9.5336 9.5336 9.5336 9.5336 9.8264 9.8264 9.8264 9.8264 10.2426 10.2426 10.2426 10.2426 10.4897 10.4897 10.4897 10.4897 11.2570 11.2570 11.2570 11.2570 11.7551 11.7551 11.7551 11.7551 12.9840 12.9840 12.9840 12.9840 13.6135 13.6135 13.6135 13.6135 14.5263 14.5263 14.5263 14.5263 14.7165 14.7165 k = 0.5000 0.1493 0.2593 ( 8144 PWs) bands (ev): 2.6530 2.6530 2.6530 2.6530 2.8023 2.8023 2.8023 2.8023 5.8102 5.8102 5.8102 5.8102 6.4636 6.4636 6.4636 6.4636 7.1344 7.1344 7.1344 7.1344 7.3309 7.3309 7.3309 7.3309 7.8071 7.8071 7.8071 7.8071 7.8595 7.8595 7.8595 7.8595 8.2702 8.2702 8.2702 8.2702 8.7991 8.7991 8.7991 8.7991 9.1537 9.1537 9.1537 9.1537 9.3761 9.3761 9.3761 9.3761 9.5237 9.5237 9.5237 9.5237 9.8193 9.8193 9.8193 9.8193 10.2517 10.2517 10.2517 10.2517 10.5017 10.5017 10.5017 10.5017 11.2956 11.2956 11.2956 11.2956 11.7634 11.7634 11.7634 11.7634 12.9869 12.9869 12.9869 12.9869 13.6023 13.6023 13.6023 13.6023 14.5348 14.5348 14.5348 14.5348 14.7130 14.7130 k = 0.5000 0.1617 0.2593 ( 8164 PWs) bands (ev): 2.6589 2.6589 2.6589 2.6589 2.7985 2.7985 2.7985 2.7985 5.8251 5.8251 5.8251 5.8251 6.4361 6.4361 6.4361 6.4361 7.1417 7.1417 7.1417 7.1417 7.3354 7.3354 7.3354 7.3354 7.7964 7.7964 7.7964 7.7964 7.8523 7.8523 7.8523 7.8523 8.2939 8.2939 8.2939 8.2939 8.7910 8.7910 8.7910 8.7910 9.1363 9.1363 9.1363 9.1363 9.3605 9.3605 9.3605 9.3605 9.5172 9.5172 9.5172 9.5172 9.8102 9.8102 9.8102 9.8102 10.2638 10.2638 10.2638 10.2638 10.5130 10.5130 10.5130 10.5130 11.3337 11.3337 11.3337 11.3337 11.7699 11.7699 11.7699 11.7699 12.9932 12.9932 12.9932 12.9932 13.5887 13.5887 13.5887 13.5887 14.5447 14.5447 14.5447 14.5447 14.7101 14.7101 k = 0.5000 0.1741 0.2593 ( 8160 PWs) bands (ev): 2.6652 2.6652 2.6652 2.6652 2.7944 2.7944 2.7944 2.7944 5.8415 5.8415 5.8415 5.8415 6.4072 6.4072 6.4072 6.4072 7.1490 7.1490 7.1490 7.1490 7.3398 7.3398 7.3398 7.3398 7.7859 7.7859 7.7859 7.7859 7.8453 7.8453 7.8453 7.8453 8.3193 8.3193 8.3193 8.3193 8.7840 8.7840 8.7840 8.7840 9.1186 9.1186 9.1186 9.1186 9.3401 9.3401 9.3401 9.3401 9.5146 9.5146 9.5146 9.5146 9.7995 9.7995 9.7995 9.7995 10.2784 10.2784 10.2784 10.2784 10.5233 10.5233 10.5233 10.5233 11.3710 11.3710 11.3710 11.3710 11.7743 11.7743 11.7743 11.7743 13.0033 13.0033 13.0033 13.0033 13.5727 13.5727 13.5727 13.5727 14.5559 14.5559 14.5559 14.5559 14.7078 14.7078 k = 0.5000 0.1866 0.2593 ( 8164 PWs) bands (ev): 2.6717 2.6717 2.6717 2.6717 2.7899 2.7899 2.7899 2.7899 5.8595 5.8595 5.8595 5.8595 6.3770 6.3770 6.3770 6.3770 7.1560 7.1560 7.1560 7.1560 7.3439 7.3439 7.3439 7.3439 7.7759 7.7759 7.7759 7.7759 7.8386 7.8386 7.8386 7.8386 8.3458 8.3458 8.3458 8.3458 8.7784 8.7784 8.7784 8.7784 9.1007 9.1007 9.1007 9.1007 9.3158 9.3158 9.3158 9.3158 9.5154 9.5154 9.5154 9.5154 9.7874 9.7874 9.7874 9.7874 10.2952 10.2952 10.2952 10.2952 10.5321 10.5321 10.5321 10.5321 11.4073 11.4073 11.4073 11.4073 11.7761 11.7761 11.7761 11.7761 13.0174 13.0174 13.0174 13.0174 13.5540 13.5540 13.5540 13.5540 14.5680 14.5680 14.5680 14.5680 14.7058 14.7058 k = 0.5000 0.1990 0.2593 ( 8156 PWs) bands (ev): 2.6784 2.6784 2.6784 2.6784 2.7851 2.7851 2.7851 2.7851 5.8789 5.8789 5.8789 5.8789 6.3460 6.3460 6.3460 6.3460 7.1628 7.1628 7.1628 7.1628 7.3477 7.3477 7.3477 7.3477 7.7666 7.7666 7.7666 7.7666 7.8320 7.8320 7.8320 7.8320 8.3730 8.3730 8.3730 8.3730 8.7743 8.7743 8.7743 8.7743 9.0828 9.0828 9.0828 9.0828 9.2890 9.2890 9.2890 9.2890 9.5189 9.5189 9.5189 9.5189 9.7742 9.7742 9.7742 9.7742 10.3133 10.3133 10.3133 10.3133 10.5392 10.5392 10.5392 10.5392 11.4426 11.4426 11.4426 11.4426 11.7753 11.7753 11.7753 11.7753 13.0355 13.0355 13.0355 13.0355 13.5327 13.5327 13.5327 13.5327 14.5807 14.5807 14.5807 14.5807 14.7040 14.7040 k = 0.5000 0.2115 0.2593 ( 8148 PWs) bands (ev): 2.6853 2.6853 2.6853 2.6853 2.7800 2.7800 2.7800 2.7800 5.8999 5.8999 5.8999 5.8999 6.3142 6.3142 6.3142 6.3142 7.1691 7.1691 7.1691 7.1691 7.3510 7.3510 7.3510 7.3510 7.7582 7.7582 7.7582 7.7582 7.8258 7.8258 7.8258 7.8258 8.4004 8.4004 8.4004 8.4004 8.7719 8.7719 8.7719 8.7719 9.0647 9.0647 9.0647 9.0647 9.2612 9.2612 9.2612 9.2612 9.5243 9.5243 9.5243 9.5243 9.7605 9.7605 9.7605 9.7605 10.3322 10.3322 10.3322 10.3322 10.5444 10.5444 10.5444 10.5444 11.4766 11.4766 11.4766 11.4766 11.7716 11.7716 11.7716 11.7716 13.0575 13.0575 13.0575 13.0575 13.5089 13.5089 13.5089 13.5089 14.5936 14.5936 14.5936 14.5936 14.7023 14.7023 k = 0.5000 0.2239 0.2593 ( 8156 PWs) bands (ev): 2.6924 2.6924 2.6924 2.6924 2.7745 2.7745 2.7745 2.7745 5.9223 5.9223 5.9223 5.9223 6.2819 6.2819 6.2819 6.2819 7.1750 7.1750 7.1750 7.1750 7.3539 7.3539 7.3539 7.3539 7.7509 7.7509 7.7509 7.7509 7.8201 7.8201 7.8201 7.8201 8.4273 8.4273 8.4273 8.4273 8.7714 8.7714 8.7714 8.7714 9.0465 9.0465 9.0465 9.0465 9.2338 9.2338 9.2338 9.2338 9.5311 9.5311 9.5311 9.5311 9.7466 9.7466 9.7466 9.7466 10.3512 10.3512 10.3512 10.3512 10.5477 10.5477 10.5477 10.5477 11.5092 11.5092 11.5092 11.5092 11.7650 11.7650 11.7650 11.7650 13.0830 13.0830 13.0830 13.0830 13.4826 13.4826 13.4826 13.4826 14.6064 14.6064 14.6064 14.6064 14.7005 14.7005 k = 0.5000 0.2363 0.2593 ( 8152 PWs) bands (ev): 2.6995 2.6995 2.6995 2.6995 2.7688 2.7688 2.7688 2.7688 5.9462 5.9462 5.9462 5.9462 6.2494 6.2494 6.2494 6.2494 7.1802 7.1802 7.1802 7.1802 7.3562 7.3562 7.3562 7.3562 7.7447 7.7447 7.7447 7.7447 7.8149 7.8149 7.8149 7.8149 8.4527 8.4527 8.4527 8.4527 8.7728 8.7728 8.7728 8.7728 9.0281 9.0281 9.0281 9.0281 9.2082 9.2082 9.2082 9.2082 9.5388 9.5388 9.5388 9.5388 9.7329 9.7329 9.7329 9.7329 10.3697 10.3697 10.3697 10.3697 10.5491 10.5491 10.5491 10.5491 11.5404 11.5404 11.5404 11.5404 11.7557 11.7557 11.7557 11.7557 13.1117 13.1117 13.1117 13.1117 13.4540 13.4540 13.4540 13.4540 14.6187 14.6187 14.6188 14.6188 14.6984 14.6984 k = 0.5000 0.2488 0.2593 ( 8164 PWs) bands (ev): 2.7066 2.7066 2.7066 2.7066 2.7628 2.7628 2.7628 2.7628 5.9713 5.9713 5.9713 5.9713 6.2169 6.2169 6.2169 6.2169 7.1847 7.1847 7.1847 7.1847 7.3581 7.3581 7.3581 7.3581 7.7397 7.7397 7.7397 7.7397 7.8103 7.8103 7.8103 7.8103 8.4757 8.4757 8.4757 8.4757 8.7763 8.7763 8.7763 8.7763 9.0097 9.0097 9.0097 9.0097 9.1856 9.1856 9.1856 9.1856 9.5468 9.5468 9.5468 9.5468 9.7199 9.7199 9.7199 9.7199 10.3867 10.3867 10.3867 10.3867 10.5489 10.5489 10.5489 10.5489 11.5701 11.5701 11.5701 11.5701 11.7438 11.7438 11.7438 11.7438 13.1431 13.1431 13.1431 13.1431 13.4232 13.4232 13.4232 13.4232 14.6303 14.6303 14.6303 14.6303 14.6959 14.6959 k = 0.5000 0.2612 0.2593 ( 8172 PWs) bands (ev): 2.7138 2.7138 2.7138 2.7138 2.7566 2.7566 2.7566 2.7566 5.9976 5.9976 5.9976 5.9976 6.1848 6.1848 6.1848 6.1848 7.1883 7.1883 7.1883 7.1883 7.3594 7.3594 7.3594 7.3594 7.7359 7.7359 7.7359 7.7359 7.8066 7.8066 7.8066 7.8066 8.4951 8.4951 8.4951 8.4951 8.7814 8.7814 8.7814 8.7814 8.9920 8.9920 8.9920 8.9920 9.1672 9.1672 9.1672 9.1672 9.5545 9.5545 9.5545 9.5545 9.7083 9.7083 9.7083 9.7083 10.4017 10.4017 10.4017 10.4017 10.5475 10.5475 10.5475 10.5475 11.5981 11.5981 11.5981 11.5981 11.7293 11.7293 11.7293 11.7293 13.1765 13.1765 13.1765 13.1765 13.3906 13.3906 13.3906 13.3906 14.6406 14.6406 14.6406 14.6406 14.6930 14.6930 k = 0.5000 0.2736 0.2593 ( 8172 PWs) bands (ev): 2.7208 2.7208 2.7208 2.7208 2.7503 2.7503 2.7503 2.7503 6.0246 6.0246 6.0246 6.0246 6.1536 6.1536 6.1536 6.1536 7.1910 7.1910 7.1910 7.1910 7.3603 7.3603 7.3603 7.3603 7.7332 7.7332 7.7332 7.7332 7.8039 7.8039 7.8039 7.8039 8.5098 8.5098 8.5098 8.5098 8.7872 8.7872 8.7872 8.7872 8.9765 8.9765 8.9765 8.9765 9.1537 9.1537 9.1537 9.1537 9.5611 9.5611 9.5611 9.5611 9.6989 9.6989 9.6989 9.6989 10.4136 10.4136 10.4136 10.4136 10.5455 10.5455 10.5455 10.5455 11.6246 11.6246 11.6246 11.6246 11.7125 11.7125 11.7125 11.7125 13.2115 13.2115 13.2115 13.2115 13.3565 13.3565 13.3565 13.3565 14.6493 14.6493 14.6493 14.6493 14.6899 14.6899 k = 0.5000 0.2861 0.2593 ( 8184 PWs) bands (ev): 2.7272 2.7272 2.7272 2.7272 2.7443 2.7443 2.7443 2.7443 6.0509 6.0509 6.0509 6.0509 6.1247 6.1247 6.1247 6.1247 7.1927 7.1927 7.1927 7.1927 7.3609 7.3609 7.3609 7.3609 7.7315 7.7315 7.7315 7.7315 7.8022 7.8022 7.8022 7.8022 8.5189 8.5189 8.5189 8.5189 8.7921 8.7921 8.7921 8.7921 8.9655 8.9655 8.9655 8.9655 9.1455 9.1455 9.1455 9.1455 9.5656 9.5656 9.5656 9.5656 9.6927 9.6927 9.6927 9.6927 10.4213 10.4213 10.4213 10.4213 10.5438 10.5438 10.5438 10.5438 11.6492 11.6492 11.6492 11.6492 11.6937 11.6937 11.6937 11.6937 13.2470 13.2470 13.2470 13.2470 13.3215 13.3215 13.3215 13.3215 14.6556 14.6556 14.6556 14.6556 14.6871 14.6871 k = 0.5000 0.2985 0.2593 ( 8192 PWs) bands (ev): 2.7310 2.7310 2.7310 2.7310 2.7407 2.7407 2.7407 2.7407 6.0668 6.0668 6.0668 6.0668 6.1079 6.1079 6.1079 6.1079 7.1932 7.1932 7.1932 7.1932 7.3610 7.3610 7.3610 7.3610 7.7310 7.7310 7.7310 7.7310 7.8016 7.8016 7.8016 7.8016 8.5221 8.5221 8.5221 8.5221 8.7941 8.7941 8.7941 8.7941 8.9614 8.9614 8.9614 8.9614 9.1428 9.1428 9.1428 9.1428 9.5673 9.5673 9.5673 9.5673 9.6905 9.6905 9.6905 9.6905 10.4240 10.4240 10.4240 10.4240 10.5431 10.5431 10.5431 10.5431 11.6690 11.6690 11.6690 11.6690 11.6757 11.6757 11.6757 11.6757 13.2757 13.2757 13.2757 13.2757 13.2931 13.2931 13.2931 13.2931 14.6580 14.6580 14.6580 14.6580 14.6859 14.6859 k = 0.5000 0.2985 0.2593 ( 8192 PWs) bands (ev): 2.7310 2.7310 2.7310 2.7310 2.7407 2.7407 2.7407 2.7407 6.0668 6.0668 6.0668 6.0668 6.1079 6.1079 6.1079 6.1079 7.1932 7.1932 7.1932 7.1932 7.3610 7.3610 7.3610 7.3610 7.7310 7.7310 7.7310 7.7310 7.8016 7.8016 7.8016 7.8016 8.5221 8.5221 8.5221 8.5221 8.7941 8.7941 8.7941 8.7941 8.9614 8.9614 8.9614 8.9614 9.1428 9.1428 9.1428 9.1428 9.5673 9.5673 9.5673 9.5673 9.6905 9.6905 9.6905 9.6905 10.4240 10.4240 10.4240 10.4240 10.5431 10.5431 10.5431 10.5431 11.6690 11.6690 11.6690 11.6690 11.6757 11.6757 11.6757 11.6757 13.2757 13.2757 13.2757 13.2757 13.2931 13.2931 13.2931 13.2931 14.6580 14.6580 14.6580 14.6581 14.6859 14.6859 k = 0.4875 0.2985 0.2593 ( 8192 PWs) bands (ev): 2.7207 2.7207 2.7207 2.7207 2.7485 2.7485 2.7485 2.7485 6.0664 6.0664 6.0664 6.0664 6.1100 6.1100 6.1100 6.1100 7.1923 7.1923 7.1923 7.1923 7.3613 7.3613 7.3613 7.3613 7.7299 7.7299 7.7299 7.7299 7.8031 7.8031 7.8031 7.8031 8.5177 8.5177 8.5177 8.5177 8.7932 8.7932 8.7932 8.7932 8.9608 8.9608 8.9608 8.9608 9.1436 9.1436 9.1436 9.1436 9.5652 9.5652 9.5652 9.5652 9.6952 9.6952 9.6952 9.6952 10.4180 10.4180 10.4180 10.4180 10.5544 10.5544 10.5544 10.5544 11.6634 11.6634 11.6634 11.6634 11.6846 11.6846 11.6846 11.6846 13.2685 13.2685 13.2685 13.2685 13.2992 13.2992 13.2992 13.2992 14.6482 14.6482 14.6482 14.6482 14.6921 14.6921 k = 0.4750 0.2985 0.2593 ( 8184 PWs) bands (ev): 2.7046 2.7046 2.7046 2.7046 2.7573 2.7573 2.7573 2.7573 6.0656 6.0656 6.0656 6.0656 6.1156 6.1156 6.1156 6.1156 7.1897 7.1897 7.1897 7.1897 7.3620 7.3620 7.3620 7.3620 7.7266 7.7266 7.7266 7.7266 7.8073 7.8073 7.8073 7.8073 8.5051 8.5051 8.5051 8.5051 8.7901 8.7901 8.7901 8.7901 8.9586 8.9586 8.9586 8.9586 9.1465 9.1465 9.1465 9.1465 9.5600 9.5600 9.5600 9.5600 9.7082 9.7082 9.7082 9.7082 10.4047 10.4047 10.4047 10.4047 10.5833 10.5833 10.5833 10.5833 11.6585 11.6585 11.6585 11.6585 11.6992 11.6992 11.6992 11.6992 13.2557 13.2557 13.2557 13.2557 13.3090 13.3090 13.3090 13.3090 14.6291 14.6291 14.6291 14.6291 14.7006 14.7006 k = 0.4625 0.2985 0.2593 ( 8180 PWs) bands (ev): 2.6859 2.6859 2.6859 2.6859 2.7638 2.7638 2.7638 2.7638 6.0653 6.0653 6.0653 6.0653 6.1240 6.1240 6.1240 6.1240 7.1854 7.1854 7.1854 7.1854 7.3630 7.3630 7.3630 7.3630 7.7215 7.7215 7.7215 7.7215 7.8138 7.8138 7.8138 7.8138 8.4855 8.4855 8.4855 8.4855 8.7847 8.7847 8.7847 8.7847 8.9541 8.9541 8.9541 8.9541 9.1521 9.1521 9.1521 9.1521 9.5534 9.5534 9.5534 9.5534 9.7273 9.7273 9.7273 9.7273 10.3909 10.3909 10.3909 10.3909 10.6227 10.6227 10.6227 10.6227 11.6566 11.6566 11.6566 11.6566 11.7172 11.7172 11.7172 11.7172 13.2414 13.2414 13.2414 13.2414 13.3183 13.3183 13.3183 13.3183 14.6066 14.6066 14.6066 14.6066 14.7053 14.7053 k = 0.4500 0.2985 0.2593 ( 8188 PWs) bands (ev): 2.6650 2.6650 2.6650 2.6650 2.7679 2.7679 2.7679 2.7679 6.0660 6.0660 6.0660 6.0660 6.1342 6.1342 6.1342 6.1342 7.1798 7.1798 7.1798 7.1798 7.3641 7.3641 7.3641 7.3641 7.7152 7.7152 7.7152 7.7152 7.8222 7.8222 7.8222 7.8222 8.4603 8.4603 8.4603 8.4603 8.7766 8.7766 8.7766 8.7766 8.9469 8.9469 8.9469 8.9469 9.1611 9.1611 9.1611 9.1611 9.5469 9.5469 9.5469 9.5469 9.7504 9.7504 9.7504 9.7504 10.3795 10.3795 10.3795 10.3795 10.6689 10.6689 10.6689 10.6689 11.6579 11.6579 11.6579 11.6579 11.7385 11.7385 11.7385 11.7385 13.2265 13.2265 13.2265 13.2265 13.3267 13.3267 13.3267 13.3267 14.5825 14.5825 14.5825 14.5825 14.7046 14.7046 k = 0.4375 0.2985 0.2593 ( 8184 PWs) bands (ev): 2.6422 2.6422 2.6422 2.6422 2.7694 2.7694 2.7694 2.7694 6.0681 6.0681 6.0681 6.0681 6.1456 6.1456 6.1456 6.1456 7.1731 7.1731 7.1731 7.1731 7.3650 7.3650 7.3650 7.3650 7.7077 7.7077 7.7077 7.7077 7.8322 7.8322 7.8322 7.8322 8.4313 8.4313 8.4313 8.4313 8.7657 8.7657 8.7657 8.7657 8.9368 8.9368 8.9368 8.9368 9.1736 9.1736 9.1736 9.1736 9.5410 9.5410 9.5410 9.5410 9.7758 9.7758 9.7758 9.7758 10.3716 10.3716 10.3716 10.3716 10.7198 10.7198 10.7198 10.7198 11.6623 11.6623 11.6623 11.6623 11.7629 11.7629 11.7629 11.7629 13.2112 13.2112 13.2112 13.2112 13.3338 13.3338 13.3338 13.3338 14.5575 14.5575 14.5575 14.5575 14.6981 14.6981 k = 0.4250 0.2985 0.2593 ( 8180 PWs) bands (ev): 2.6175 2.6175 2.6175 2.6175 2.7685 2.7685 2.7685 2.7685 6.0718 6.0718 6.0718 6.0718 6.1578 6.1578 6.1578 6.1578 7.1654 7.1654 7.1654 7.1654 7.3655 7.3655 7.3655 7.3655 7.6993 7.6993 7.6993 7.6993 7.8436 7.8436 7.8436 7.8436 8.4000 8.4000 8.4000 8.4000 8.7524 8.7524 8.7524 8.7524 8.9244 8.9244 8.9244 8.9244 9.1891 9.1891 9.1891 9.1891 9.5361 9.5361 9.5361 9.5361 9.8024 9.8024 9.8024 9.8024 10.3675 10.3675 10.3675 10.3675 10.7740 10.7740 10.7740 10.7740 11.6697 11.6697 11.6697 11.6697 11.7907 11.7907 11.7907 11.7907 13.1961 13.1961 13.1961 13.1961 13.3399 13.3399 13.3399 13.3399 14.5324 14.5324 14.5324 14.5324 14.6853 14.6853 k = 0.4125 0.2985 0.2593 ( 8176 PWs) bands (ev): 2.5912 2.5912 2.5912 2.5912 2.7650 2.7650 2.7650 2.7650 6.0769 6.0769 6.0769 6.0769 6.1704 6.1704 6.1704 6.1704 7.1570 7.1570 7.1570 7.1570 7.3653 7.3653 7.3653 7.3653 7.6900 7.6900 7.6900 7.6900 7.8563 7.8563 7.8563 7.8563 8.3676 8.3676 8.3676 8.3676 8.7369 8.7369 8.7369 8.7369 8.9108 8.9108 8.9108 8.9108 9.2071 9.2071 9.2071 9.2071 9.5323 9.5323 9.5323 9.5323 9.8291 9.8291 9.8291 9.8291 10.3675 10.3675 10.3675 10.3675 10.8304 10.8304 10.8304 10.8304 11.6799 11.6799 11.6799 11.6799 11.8217 11.8217 11.8217 11.8217 13.1813 13.1813 13.1813 13.1813 13.3450 13.3450 13.3450 13.3450 14.5076 14.5076 14.5076 14.5076 14.6665 14.6665 k = 0.4000 0.2985 0.2593 ( 8180 PWs) bands (ev): 2.5634 2.5634 2.5634 2.5634 2.7593 2.7593 2.7593 2.7593 6.0835 6.0835 6.0835 6.0835 6.1829 6.1829 6.1829 6.1829 7.1480 7.1480 7.1480 7.1480 7.3644 7.3644 7.3644 7.3644 7.6798 7.6798 7.6798 7.6798 7.8701 7.8701 7.8701 7.8701 8.3353 8.3353 8.3353 8.3353 8.7197 8.7197 8.7197 8.7197 8.8969 8.8969 8.8969 8.8969 9.2266 9.2266 9.2266 9.2266 9.5294 9.5294 9.5294 9.5294 9.8551 9.8551 9.8551 9.8551 10.3714 10.3714 10.3714 10.3714 10.8878 10.8878 10.8878 10.8878 11.6928 11.6928 11.6928 11.6928 11.8560 11.8560 11.8560 11.8560 13.1672 13.1672 13.1672 13.1672 13.3494 13.3494 13.3494 13.3494 14.4832 14.4832 14.4832 14.4832 14.6420 14.6420 k = 0.3875 0.2985 0.2593 ( 8176 PWs) bands (ev): 2.5343 2.5343 2.5343 2.5343 2.7513 2.7513 2.7513 2.7513 6.0912 6.0912 6.0912 6.0912 6.1952 6.1952 6.1952 6.1952 7.1385 7.1385 7.1385 7.1385 7.3626 7.3626 7.3626 7.3626 7.6688 7.6688 7.6688 7.6688 7.8848 7.8848 7.8848 7.8848 8.3042 8.3042 8.3042 8.3042 8.7014 8.7014 8.7014 8.7014 8.8836 8.8836 8.8836 8.8836 9.2469 9.2469 9.2469 9.2469 9.5276 9.5276 9.5276 9.5276 9.8798 9.8798 9.8798 9.8798 10.3790 10.3790 10.3790 10.3790 10.9450 10.9450 10.9450 10.9450 11.7080 11.7080 11.7080 11.7080 11.8934 11.8934 11.8934 11.8934 13.1543 13.1543 13.1543 13.1543 13.3532 13.3532 13.3532 13.3532 14.4596 14.4596 14.4596 14.4596 14.6122 14.6122 k = 0.3750 0.2985 0.2593 ( 8168 PWs) bands (ev): 2.5041 2.5041 2.5041 2.5041 2.7412 2.7412 2.7412 2.7412 6.0999 6.0999 6.0999 6.0999 6.2068 6.2068 6.2068 6.2068 7.1286 7.1286 7.1286 7.1286 7.3601 7.3601 7.3601 7.3601 7.6570 7.6570 7.6570 7.6570 7.9000 7.9000 7.9000 7.9000 8.2754 8.2754 8.2754 8.2754 8.6827 8.6827 8.6827 8.6827 8.8716 8.8716 8.8716 8.8716 9.2674 9.2674 9.2674 9.2674 9.5269 9.5269 9.5269 9.5269 9.9026 9.9026 9.9026 9.9026 10.3901 10.3901 10.3901 10.3901 11.0012 11.0012 11.0012 11.0012 11.7252 11.7252 11.7252 11.7252 11.9338 11.9338 11.9338 11.9338 13.1428 13.1428 13.1428 13.1428 13.3571 13.3571 13.3571 13.3571 14.4368 14.4368 14.4368 14.4368 14.5777 14.5777 k = 0.3625 0.2985 0.2593 ( 8168 PWs) bands (ev): 2.4730 2.4730 2.4730 2.4730 2.7291 2.7291 2.7291 2.7291 6.1091 6.1091 6.1091 6.1091 6.2177 6.2177 6.2177 6.2177 7.1183 7.1183 7.1183 7.1183 7.3567 7.3567 7.3567 7.3567 7.6443 7.6443 7.6443 7.6443 7.9154 7.9154 7.9154 7.9154 8.2499 8.2499 8.2499 8.2499 8.6643 8.6643 8.6643 8.6643 8.8611 8.8611 8.8611 8.8611 9.2875 9.2875 9.2875 9.2875 9.5273 9.5273 9.5273 9.5273 9.9233 9.9233 9.9233 9.9233 10.4045 10.4045 10.4045 10.4045 11.0554 11.0554 11.0554 11.0554 11.7441 11.7441 11.7441 11.7441 11.9769 11.9769 11.9769 11.9769 13.1331 13.1331 13.1331 13.1331 13.3613 13.3613 13.3613 13.3613 14.4147 14.4147 14.4147 14.4147 14.5393 14.5393 k = 0.3500 0.2985 0.2593 ( 8180 PWs) bands (ev): 2.4412 2.4412 2.4412 2.4412 2.7153 2.7153 2.7153 2.7153 6.1185 6.1185 6.1185 6.1185 6.2278 6.2278 6.2278 6.2278 7.1075 7.1075 7.1075 7.1075 7.3527 7.3527 7.3527 7.3527 7.6310 7.6310 7.6310 7.6310 7.9303 7.9303 7.9303 7.9303 8.2286 8.2286 8.2286 8.2286 8.6469 8.6469 8.6469 8.6469 8.8524 8.8524 8.8524 8.8524 9.3070 9.3070 9.3070 9.3070 9.5290 9.5290 9.5290 9.5290 9.9417 9.9417 9.9417 9.9417 10.4216 10.4216 10.4216 10.4216 11.1069 11.1069 11.1069 11.1069 11.7643 11.7643 11.7643 11.7643 12.0222 12.0222 12.0222 12.0222 13.1255 13.1255 13.1255 13.1255 13.3666 13.3666 13.3666 13.3666 14.3929 14.3929 14.3929 14.3929 14.4978 14.4978 k = 0.3375 0.2985 0.2593 ( 8184 PWs) bands (ev): 2.4089 2.4089 2.4089 2.4089 2.6998 2.6998 2.6998 2.6998 6.1275 6.1275 6.1275 6.1275 6.2370 6.2370 6.2370 6.2370 7.0962 7.0962 7.0962 7.0962 7.3482 7.3482 7.3482 7.3482 7.6172 7.6172 7.6172 7.6172 7.9440 7.9440 7.9440 7.9440 8.2126 8.2126 8.2126 8.2126 8.6311 8.6311 8.6311 8.6311 8.8454 8.8454 8.8454 8.8454 9.3254 9.3254 9.3254 9.3254 9.5321 9.5321 9.5321 9.5321 9.9580 9.9580 9.9580 9.9580 10.4408 10.4408 10.4408 10.4408 11.1550 11.1550 11.1550 11.1550 11.7854 11.7854 11.7854 11.7854 12.0688 12.0688 12.0688 12.0688 13.1206 13.1206 13.1206 13.1206 13.3737 13.3737 13.3737 13.3737 14.3703 14.3703 14.3703 14.3703 14.4548 14.4548 k = 0.3250 0.2985 0.2593 ( 8172 PWs) bands (ev): 2.3761 2.3761 2.3761 2.3761 2.6830 2.6830 2.6830 2.6830 6.1354 6.1354 6.1354 6.1354 6.2454 6.2454 6.2454 6.2454 7.0844 7.0844 7.0844 7.0844 7.3433 7.3433 7.3433 7.3433 7.6029 7.6029 7.6029 7.6029 7.9558 7.9558 7.9558 7.9558 8.2028 8.2028 8.2028 8.2028 8.6176 8.6176 8.6176 8.6176 8.8402 8.8402 8.8402 8.8402 9.3427 9.3427 9.3427 9.3427 9.5366 9.5366 9.5366 9.5366 9.9724 9.9724 9.9724 9.9724 10.4616 10.4616 10.4616 10.4616 11.1995 11.1995 11.1995 11.1995 11.8069 11.8069 11.8069 11.8069 12.1157 12.1157 12.1157 12.1157 13.1184 13.1184 13.1184 13.1184 13.3832 13.3832 13.3832 13.3832 14.3445 14.3445 14.3445 14.3445 14.4134 14.4134 k = 0.3125 0.2985 0.2593 ( 8176 PWs) bands (ev): 2.3432 2.3432 2.3432 2.3432 2.6649 2.6649 2.6649 2.6649 6.1418 6.1418 6.1418 6.1418 6.2534 6.2534 6.2534 6.2534 7.0720 7.0720 7.0720 7.0720 7.3383 7.3383 7.3383 7.3383 7.5885 7.5885 7.5885 7.5885 7.9648 7.9648 7.9648 7.9648 8.1998 8.1998 8.1998 8.1998 8.6067 8.6067 8.6067 8.6067 8.8365 8.8365 8.8365 8.8365 9.3586 9.3586 9.3586 9.3586 9.5426 9.5426 9.5426 9.5426 9.9852 9.9852 9.9852 9.9852 10.4833 10.4833 10.4833 10.4833 11.2400 11.2400 11.2400 11.2400 11.8287 11.8287 11.8287 11.8287 12.1618 12.1618 12.1618 12.1618 13.1193 13.1193 13.1193 13.1193 13.3961 13.3961 13.3961 13.3961 14.3103 14.3103 14.3103 14.3103 14.3790 14.3790 k = 0.3000 0.2985 0.2593 ( 8176 PWs) bands (ev): 2.3102 2.3102 2.3102 2.3102 2.6458 2.6458 2.6458 2.6458 6.1459 6.1459 6.1459 6.1459 6.2609 6.2609 6.2609 6.2609 7.0591 7.0591 7.0591 7.0591 7.3332 7.3332 7.3332 7.3332 7.5740 7.5740 7.5740 7.5740 7.9710 7.9710 7.9710 7.9710 8.2038 8.2038 8.2038 8.2038 8.5990 8.5990 8.5990 8.5990 8.8343 8.8343 8.8343 8.8343 9.3732 9.3732 9.3732 9.3732 9.5503 9.5503 9.5503 9.5503 9.9968 9.9968 9.9968 9.9968 10.5053 10.5053 10.5053 10.5053 11.2763 11.2763 11.2763 11.2763 11.8502 11.8502 11.8502 11.8502 12.2056 12.2056 12.2056 12.2056 13.1235 13.1235 13.1235 13.1235 13.4131 13.4131 13.4131 13.4131 14.2657 14.2657 14.2657 14.2657 14.3541 14.3541 k = 0.2875 0.2985 0.2593 ( 8172 PWs) bands (ev): 2.2774 2.2774 2.2774 2.2774 2.6259 2.6259 2.6259 2.6259 6.1473 6.1473 6.1473 6.1473 6.2683 6.2683 6.2683 6.2683 7.0458 7.0458 7.0458 7.0458 7.3283 7.3283 7.3283 7.3283 7.5597 7.5597 7.5597 7.5597 7.9747 7.9747 7.9747 7.9747 8.2142 8.2142 8.2142 8.2142 8.5947 8.5947 8.5947 8.5947 8.8333 8.8333 8.8333 8.8333 9.3864 9.3864 9.3864 9.3864 9.5596 9.5596 9.5596 9.5596 10.0075 10.0075 10.0075 10.0075 10.5270 10.5270 10.5270 10.5270 11.3085 11.3085 11.3085 11.3085 11.8714 11.8714 11.8714 11.8714 12.2457 12.2457 12.2457 12.2457 13.1310 13.1310 13.1310 13.1310 13.4351 13.4351 13.4351 13.4351 14.2141 14.2141 14.2141 14.2141 14.3359 14.3359 k = 0.2750 0.2985 0.2593 ( 8168 PWs) bands (ev): 2.2448 2.2448 2.2448 2.2448 2.6053 2.6053 2.6053 2.6053 6.1459 6.1459 6.1459 6.1459 6.2755 6.2755 6.2755 6.2755 7.0321 7.0321 7.0321 7.0321 7.3236 7.3236 7.3236 7.3236 7.5458 7.5458 7.5458 7.5458 7.9766 7.9766 7.9766 7.9766 8.2298 8.2298 8.2298 8.2298 8.5941 8.5941 8.5941 8.5941 8.8334 8.8334 8.8334 8.8334 9.3986 9.3986 9.3986 9.3986 9.5704 9.5704 9.5704 9.5704 10.0177 10.0177 10.0177 10.0177 10.5479 10.5479 10.5479 10.5479 11.3366 11.3366 11.3366 11.3366 11.8920 11.8920 11.8920 11.8920 12.2808 12.2808 12.2808 12.2808 13.1415 13.1415 13.1415 13.1415 13.4626 13.4626 13.4626 13.4626 14.1591 14.1591 14.1591 14.1591 14.3213 14.3213 k = 0.2625 0.2985 0.2593 ( 8172 PWs) bands (ev): 2.2127 2.2127 2.2127 2.2127 2.5843 2.5843 2.5843 2.5843 6.1415 6.1415 6.1415 6.1415 6.2824 6.2824 6.2824 6.2824 7.0182 7.0182 7.0182 7.0182 7.3193 7.3193 7.3193 7.3193 7.5323 7.5323 7.5323 7.5323 7.9775 7.9775 7.9775 7.9775 8.2494 8.2494 8.2494 8.2494 8.5971 8.5971 8.5971 8.5971 8.8345 8.8345 8.8345 8.8345 9.4098 9.4098 9.4098 9.4098 9.5828 9.5828 9.5828 9.5828 10.0277 10.0277 10.0277 10.0277 10.5676 10.5676 10.5676 10.5676 11.3607 11.3607 11.3607 11.3607 11.9120 11.9120 11.9120 11.9120 12.3101 12.3101 12.3101 12.3101 13.1545 13.1545 13.1545 13.1545 13.4961 13.4961 13.4961 13.4961 14.1027 14.1027 14.1027 14.1027 14.3092 14.3092 k = 0.2500 0.2985 0.2593 ( 8172 PWs) bands (ev): 2.1811 2.1811 2.1811 2.1811 2.5630 2.5630 2.5630 2.5630 6.1345 6.1345 6.1345 6.1345 6.2886 6.2886 6.2886 6.2886 7.0044 7.0044 7.0044 7.0044 7.3155 7.3155 7.3155 7.3155 7.5195 7.5195 7.5195 7.5195 7.9781 7.9781 7.9781 7.9781 8.2720 8.2720 8.2720 8.2720 8.6038 8.6038 8.6038 8.6038 8.8362 8.8362 8.8362 8.8362 9.4203 9.4203 9.4203 9.4203 9.5967 9.5967 9.5967 9.5967 10.0377 10.0377 10.0377 10.0377 10.5857 10.5857 10.5857 10.5857 11.3807 11.3807 11.3807 11.3807 11.9313 11.9313 11.9313 11.9313 12.3328 12.3328 12.3328 12.3328 13.1693 13.1693 13.1693 13.1693 13.5356 13.5356 13.5356 13.5356 14.0464 14.0464 14.0464 14.0464 14.2991 14.2991 k = 0.2375 0.2985 0.2593 ( 8160 PWs) bands (ev): 2.1503 2.1503 2.1503 2.1503 2.5416 2.5416 2.5416 2.5416 6.1250 6.1250 6.1250 6.1250 6.2940 6.2940 6.2940 6.2940 6.9908 6.9908 6.9908 6.9908 7.3123 7.3123 7.3123 7.3123 7.5073 7.5073 7.5073 7.5073 7.9787 7.9787 7.9787 7.9787 8.2967 8.2967 8.2967 8.2967 8.6140 8.6140 8.6140 8.6140 8.8385 8.8385 8.8385 8.8385 9.4303 9.4303 9.4303 9.4303 9.6120 9.6120 9.6120 9.6120 10.0478 10.0478 10.0478 10.0478 10.6021 10.6021 10.6021 10.6021 11.3968 11.3968 11.3968 11.3968 11.9499 11.9499 11.9499 11.9499 12.3490 12.3490 12.3490 12.3490 13.1844 13.1844 13.1844 13.1844 13.5807 13.5807 13.5807 13.5807 13.9916 13.9916 13.9916 13.9916 14.2908 14.2908 k = 0.2250 0.2985 0.2593 ( 8156 PWs) bands (ev): 2.1203 2.1203 2.1203 2.1203 2.5203 2.5203 2.5203 2.5203 6.1135 6.1135 6.1135 6.1135 6.2981 6.2981 6.2981 6.2981 6.9777 6.9777 6.9777 6.9777 7.3097 7.3097 7.3097 7.3097 7.4959 7.4959 7.4959 7.4959 7.9795 7.9795 7.9795 7.9795 8.3228 8.3228 8.3228 8.3228 8.6273 8.6273 8.6273 8.6273 8.8413 8.8413 8.8413 8.8413 9.4400 9.4400 9.4400 9.4400 9.6289 9.6289 9.6289 9.6289 10.0581 10.0581 10.0581 10.0581 10.6164 10.6164 10.6164 10.6164 11.4091 11.4091 11.4091 11.4091 11.9680 11.9680 11.9680 11.9680 12.3589 12.3589 12.3589 12.3589 13.1982 13.1982 13.1982 13.1982 13.6305 13.6305 13.6305 13.6305 13.9403 13.9403 13.9403 13.9403 14.2842 14.2842 k = 0.2125 0.2985 0.2593 ( 8164 PWs) bands (ev): 2.0912 2.0912 2.0912 2.0912 2.4993 2.4993 2.4993 2.4993 6.1004 6.1004 6.1004 6.1004 6.3009 6.3009 6.3009 6.3009 6.9652 6.9652 6.9652 6.9652 7.3078 7.3078 7.3078 7.3078 7.4852 7.4852 7.4852 7.4852 7.9807 7.9807 7.9807 7.9807 8.3499 8.3499 8.3499 8.3499 8.6433 8.6433 8.6433 8.6433 8.8444 8.8444 8.8444 8.8444 9.4496 9.4496 9.4496 9.4496 9.6472 9.6472 9.6472 9.6472 10.0688 10.0688 10.0688 10.0688 10.6286 10.6286 10.6286 10.6286 11.4176 11.4176 11.4176 11.4176 11.9856 11.9856 11.9856 11.9856 12.3632 12.3632 12.3632 12.3632 13.2085 13.2085 13.2085 13.2085 13.6832 13.6832 13.6832 13.6832 13.8956 13.8956 13.8956 13.8956 14.2793 14.2793 k = 0.2000 0.2985 0.2593 ( 8176 PWs) bands (ev): 2.0632 2.0632 2.0632 2.0632 2.4786 2.4786 2.4786 2.4786 6.0859 6.0859 6.0859 6.0859 6.3022 6.3022 6.3022 6.3022 6.9534 6.9534 6.9534 6.9534 7.3067 7.3067 7.3067 7.3067 7.4752 7.4752 7.4752 7.4752 7.9822 7.9822 7.9822 7.9822 8.3776 8.3776 8.3776 8.3776 8.6614 8.6614 8.6614 8.6614 8.8479 8.8479 8.8479 8.8479 9.4592 9.4592 9.4592 9.4592 9.6671 9.6671 9.6671 9.6671 10.0798 10.0798 10.0798 10.0798 10.6387 10.6387 10.6387 10.6387 11.4224 11.4224 11.4224 11.4224 12.0029 12.0029 12.0029 12.0029 12.3628 12.3628 12.3628 12.3628 13.2126 13.2126 13.2126 13.2126 13.7339 13.7339 13.7339 13.7339 13.8637 13.8637 13.8637 13.8637 14.2762 14.2762 k = 0.1875 0.2985 0.2593 ( 8164 PWs) bands (ev): 2.0364 2.0364 2.0364 2.0364 2.4585 2.4585 2.4585 2.4585 6.0706 6.0706 6.0706 6.0706 6.3020 6.3020 6.3020 6.3020 6.9426 6.9426 6.9426 6.9426 7.3064 7.3064 7.3064 7.3064 7.4659 7.4659 7.4659 7.4659 7.9840 7.9840 7.9840 7.9840 8.4056 8.4056 8.4056 8.4056 8.6808 8.6808 8.6808 8.6808 8.8520 8.8520 8.8520 8.8520 9.4688 9.4688 9.4688 9.4688 9.6886 9.6886 9.6886 9.6886 10.0912 10.0912 10.0912 10.0912 10.6467 10.6467 10.6467 10.6467 11.4235 11.4235 11.4235 11.4235 12.0201 12.0201 12.0201 12.0201 12.3586 12.3586 12.3586 12.3586 13.2079 13.2079 13.2079 13.2079 13.7666 13.7666 13.7666 13.7666 13.8619 13.8619 13.8619 13.8619 14.2749 14.2749 k = 0.1750 0.2985 0.2593 ( 8160 PWs) bands (ev): 2.0108 2.0108 2.0108 2.0108 2.4391 2.4391 2.4391 2.4391 6.0547 6.0547 6.0547 6.0547 6.3003 6.3003 6.3003 6.3003 6.9327 6.9327 6.9327 6.9327 7.3069 7.3069 7.3069 7.3069 7.4573 7.4573 7.4573 7.4573 7.9859 7.9859 7.9859 7.9859 8.4337 8.4337 8.4337 8.4337 8.7006 8.7006 8.7006 8.7006 8.8567 8.8567 8.8567 8.8567 9.4783 9.4783 9.4783 9.4783 9.7116 9.7116 9.7116 9.7116 10.1029 10.1029 10.1029 10.1029 10.6527 10.6527 10.6527 10.6527 11.4210 11.4210 11.4210 11.4210 12.0372 12.0372 12.0372 12.0372 12.3516 12.3516 12.3516 12.3516 13.1923 13.1923 13.1923 13.1923 13.7700 13.7700 13.7700 13.7700 13.9024 13.9024 13.9024 13.9024 14.2757 14.2757 k = 0.1625 0.2985 0.2593 ( 8172 PWs) bands (ev): 1.9866 1.9866 1.9866 1.9866 2.4205 2.4205 2.4205 2.4205 6.0386 6.0386 6.0386 6.0386 6.2973 6.2973 6.2973 6.2973 6.9237 6.9237 6.9237 6.9237 7.3081 7.3081 7.3081 7.3081 7.4492 7.4492 7.4492 7.4492 7.9880 7.9880 7.9880 7.9880 8.4617 8.4617 8.4617 8.4617 8.7199 8.7199 8.7199 8.7199 8.8626 8.8626 8.8626 8.8626 9.4877 9.4877 9.4877 9.4877 9.7362 9.7362 9.7362 9.7362 10.1150 10.1150 10.1150 10.1150 10.6568 10.6568 10.6568 10.6568 11.4152 11.4152 11.4152 11.4152 12.0544 12.0544 12.0544 12.0544 12.3427 12.3427 12.3427 12.3427 13.1651 13.1651 13.1651 13.1651 13.7685 13.7685 13.7685 13.7685 13.9601 13.9601 13.9601 13.9601 14.2789 14.2789 k = 0.1500 0.2985 0.2593 ( 8180 PWs) bands (ev): 1.9639 1.9639 1.9639 1.9639 2.4028 2.4028 2.4028 2.4028 6.0225 6.0225 6.0225 6.0225 6.2931 6.2931 6.2931 6.2931 6.9157 6.9157 6.9157 6.9157 7.3101 7.3101 7.3101 7.3101 7.4417 7.4417 7.4417 7.4417 7.9901 7.9901 7.9901 7.9901 8.4891 8.4891 8.4891 8.4891 8.7375 8.7375 8.7375 8.7375 8.8703 8.8703 8.8703 8.8703 9.4969 9.4969 9.4969 9.4969 9.7624 9.7624 9.7624 9.7624 10.1272 10.1272 10.1272 10.1272 10.6592 10.6592 10.6592 10.6592 11.4061 11.4061 11.4061 11.4061 12.0718 12.0718 12.0718 12.0718 12.3328 12.3328 12.3328 12.3328 13.1272 13.1272 13.1272 13.1272 13.7734 13.7734 13.7734 13.7734 14.0212 14.0212 14.0212 14.0212 14.2853 14.2853 k = 0.1375 0.2985 0.2593 ( 8176 PWs) bands (ev): 1.9427 1.9427 1.9427 1.9427 2.3861 2.3861 2.3861 2.3861 6.0068 6.0068 6.0068 6.0068 6.2880 6.2880 6.2880 6.2880 6.9086 6.9086 6.9086 6.9086 7.3128 7.3128 7.3128 7.3128 7.4346 7.4346 7.4346 7.4346 7.9922 7.9922 7.9922 7.9922 8.5158 8.5158 8.5158 8.5158 8.7523 8.7523 8.7523 8.7523 8.8805 8.8805 8.8805 8.8805 9.5055 9.5055 9.5055 9.5055 9.7900 9.7900 9.7900 9.7900 10.1395 10.1395 10.1395 10.1395 10.6600 10.6600 10.6600 10.6600 11.3941 11.3941 11.3941 11.3941 12.0895 12.0895 12.0895 12.0895 12.3228 12.3228 12.3228 12.3228 13.0807 13.0807 13.0807 13.0807 13.7855 13.7855 13.7855 13.7855 14.0805 14.0805 14.0805 14.0806 14.2965 14.2965 k = 0.1250 0.2985 0.2593 ( 8188 PWs) bands (ev): 1.9231 1.9231 1.9231 1.9231 2.3705 2.3705 2.3705 2.3705 5.9917 5.9917 5.9917 5.9917 6.2823 6.2823 6.2823 6.2823 6.9024 6.9024 6.9024 6.9024 7.3160 7.3160 7.3160 7.3160 7.4279 7.4279 7.4279 7.4279 7.9943 7.9943 7.9943 7.9943 8.5416 8.5416 8.5416 8.5416 8.7633 8.7633 8.7633 8.7633 8.8934 8.8934 8.8934 8.8934 9.5134 9.5134 9.5134 9.5134 9.8190 9.8190 9.8190 9.8190 10.1517 10.1517 10.1517 10.1517 10.6595 10.6595 10.6595 10.6595 11.3797 11.3797 11.3797 11.3797 12.1073 12.1073 12.1073 12.1073 12.3134 12.3134 12.3134 12.3134 13.0278 13.0278 13.0278 13.0278 13.8032 13.8032 13.8032 13.8032 14.1337 14.1337 14.1337 14.1337 14.3159 14.3159 k = 0.1125 0.2985 0.2593 ( 8192 PWs) bands (ev): 1.9052 1.9052 1.9052 1.9052 2.3562 2.3562 2.3562 2.3562 5.9773 5.9773 5.9773 5.9773 6.2762 6.2762 6.2762 6.2762 6.8970 6.8970 6.8970 6.8970 7.3197 7.3197 7.3197 7.3197 7.4216 7.4216 7.4216 7.4216 7.9962 7.9962 7.9962 7.9962 8.5661 8.5661 8.5661 8.5661 8.7706 8.7706 8.7706 8.7706 8.9090 8.9090 8.9090 8.9090 9.5203 9.5203 9.5203 9.5203 9.8490 9.8490 9.8490 9.8490 10.1635 10.1635 10.1635 10.1635 10.6578 10.6578 10.6578 10.6578 11.3633 11.3633 11.3633 11.3633 12.1252 12.1252 12.1252 12.1252 12.3053 12.3053 12.3053 12.3053 12.9709 12.9709 12.9709 12.9709 13.8246 13.8246 13.8246 13.8246 14.1753 14.1753 14.1753 14.1753 14.3481 14.3481 k = 0.1000 0.2985 0.2593 ( 8192 PWs) bands (ev): 1.8890 1.8890 1.8890 1.8890 2.3431 2.3431 2.3431 2.3431 5.9640 5.9640 5.9640 5.9640 6.2699 6.2699 6.2699 6.2699 6.8924 6.8924 6.8924 6.8924 7.3238 7.3238 7.3238 7.3238 7.4156 7.4156 7.4156 7.4156 7.9980 7.9980 7.9980 7.9980 8.5893 8.5893 8.5893 8.5893 8.7745 8.7745 8.7745 8.7745 8.9265 8.9265 8.9265 8.9265 9.5261 9.5261 9.5261 9.5261 9.8798 9.8798 9.8798 9.8798 10.1746 10.1746 10.1746 10.1746 10.6551 10.6551 10.6551 10.6551 11.3457 11.3457 11.3457 11.3457 12.1426 12.1426 12.1426 12.1426 12.2997 12.2997 12.2997 12.2997 12.9116 12.9116 12.9116 12.9116 13.8478 13.8478 13.8478 13.8478 14.2031 14.2031 14.2031 14.2031 14.3950 14.3950 k = 0.0875 0.2985 0.2593 ( 8180 PWs) bands (ev): 1.8746 1.8746 1.8746 1.8746 2.3315 2.3315 2.3315 2.3315 5.9518 5.9518 5.9518 5.9518 6.2638 6.2638 6.2638 6.2638 6.8884 6.8884 6.8884 6.8884 7.3283 7.3283 7.3283 7.3283 7.4099 7.4099 7.4099 7.4099 7.9997 7.9997 7.9997 7.9997 8.6108 8.6108 8.6108 8.6108 8.7756 8.7756 8.7756 8.7756 8.9448 8.9448 8.9448 8.9448 9.5307 9.5307 9.5307 9.5307 9.9108 9.9108 9.9108 9.9108 10.1846 10.1846 10.1846 10.1846 10.6517 10.6517 10.6517 10.6517 11.3274 11.3274 11.3274 11.3274 12.1589 12.1589 12.1589 12.1589 12.2975 12.2975 12.2975 12.2975 12.8516 12.8516 12.8516 12.8516 13.8716 13.8716 13.8716 13.8716 14.2201 14.2201 14.2201 14.2201 14.4533 14.4533 k = 0.0750 0.2985 0.2593 ( 8176 PWs) bands (ev): 1.8620 1.8620 1.8620 1.8620 2.3212 2.3212 2.3212 2.3212 5.9410 5.9410 5.9410 5.9410 6.2580 6.2580 6.2580 6.2580 6.8851 6.8851 6.8851 6.8851 7.3329 7.3329 7.3329 7.3329 7.4045 7.4045 7.4045 7.4045 8.0012 8.0012 8.0012 8.0012 8.6305 8.6305 8.6305 8.6305 8.7746 8.7746 8.7746 8.7746 8.9629 8.9629 8.9629 8.9629 9.5341 9.5341 9.5341 9.5341 9.9414 9.9414 9.9414 9.9414 10.1932 10.1932 10.1932 10.1932 10.6477 10.6477 10.6477 10.6477 11.3094 11.3094 11.3094 11.3094 12.1730 12.1730 12.1730 12.1730 12.3003 12.3003 12.3003 12.3003 12.7921 12.7921 12.7921 12.7921 13.8947 13.8947 13.8947 13.8947 14.2306 14.2306 14.2306 14.2306 14.5183 14.5183 k = 0.0625 0.2985 0.2593 ( 8168 PWs) bands (ev): 1.8513 1.8513 1.8513 1.8513 2.3125 2.3125 2.3125 2.3125 5.9316 5.9316 5.9316 5.9316 6.2528 6.2528 6.2528 6.2528 6.8823 6.8823 6.8823 6.8823 7.3376 7.3376 7.3376 7.3376 7.3994 7.3994 7.3994 7.3994 8.0024 8.0024 8.0024 8.0024 8.6484 8.6484 8.6484 8.6484 8.7721 8.7721 8.7721 8.7721 8.9799 8.9799 8.9799 8.9799 9.5363 9.5363 9.5363 9.5363 9.9709 9.9709 9.9709 9.9709 10.2000 10.2000 10.2000 10.2000 10.6434 10.6434 10.6434 10.6434 11.2925 11.2925 11.2925 11.2925 12.1836 12.1836 12.1836 12.1836 12.3095 12.3095 12.3095 12.3095 12.7341 12.7341 12.7341 12.7341 13.9160 13.9160 13.9160 13.9160 14.2376 14.2376 14.2376 14.2376 14.5873 14.5873 k = 0.0500 0.2985 0.2593 ( 8172 PWs) bands (ev): 1.8425 1.8425 1.8425 1.8425 2.3052 2.3052 2.3052 2.3052 5.9238 5.9238 5.9238 5.9238 6.2483 6.2483 6.2483 6.2483 6.8801 6.8801 6.8801 6.8801 7.3422 7.3422 7.3422 7.3422 7.3945 7.3945 7.3945 7.3945 8.0035 8.0035 8.0035 8.0035 8.6642 8.6642 8.6642 8.6642 8.7684 8.7684 8.7684 8.7684 8.9950 8.9950 8.9950 8.9950 9.5375 9.5375 9.5375 9.5375 9.9982 9.9982 9.9982 9.9982 10.2049 10.2049 10.2049 10.2049 10.6391 10.6391 10.6391 10.6391 11.2774 11.2774 11.2774 11.2774 12.1903 12.1903 12.1903 12.1903 12.3254 12.3254 12.3254 12.3254 12.6787 12.6787 12.6787 12.6787 13.9347 13.9347 13.9347 13.9347 14.2423 14.2423 14.2423 14.2423 14.6583 14.6583 k = 0.0375 0.2985 0.2593 ( 8168 PWs) bands (ev): 1.8356 1.8356 1.8356 1.8356 2.2996 2.2996 2.2996 2.2996 5.9176 5.9176 5.9176 5.9176 6.2446 6.2446 6.2446 6.2446 6.8784 6.8784 6.8784 6.8784 7.3465 7.3465 7.3465 7.3465 7.3901 7.3901 7.3901 7.3901 8.0043 8.0043 8.0043 8.0043 8.6778 8.6778 8.6778 8.6778 8.7641 8.7641 8.7641 8.7641 9.0076 9.0076 9.0076 9.0076 9.5381 9.5381 9.5381 9.5381 10.0220 10.0220 10.0220 10.0220 10.2078 10.2078 10.2078 10.2078 10.6352 10.6352 10.6352 10.6352 11.2649 11.2649 11.2649 11.2649 12.1940 12.1940 12.1940 12.1940 12.3471 12.3471 12.3471 12.3471 12.6270 12.6270 12.6270 12.6270 13.9501 13.9501 13.9501 13.9501 14.2456 14.2456 14.2456 14.2456 14.7301 14.7301 k = 0.0250 0.2985 0.2593 ( 8180 PWs) bands (ev): 1.8307 1.8307 1.8307 1.8307 2.2955 2.2955 2.2955 2.2955 5.9132 5.9132 5.9132 5.9132 6.2419 6.2419 6.2419 6.2419 6.8773 6.8773 6.8773 6.8773 7.3503 7.3503 7.3503 7.3503 7.3863 7.3863 7.3863 7.3863 8.0049 8.0049 8.0049 8.0049 8.6887 8.6887 8.6887 8.6887 8.7597 8.7597 8.7597 8.7597 9.0170 9.0170 9.0170 9.0170 9.5382 9.5382 9.5382 9.5382 10.0408 10.0408 10.0408 10.0408 10.2091 10.2091 10.2091 10.2091 10.6319 10.6319 10.6319 10.6319 11.2555 11.2555 11.2555 11.2555 12.1957 12.1957 12.1957 12.1957 12.3723 12.3723 12.3723 12.3723 12.5808 12.5808 12.5808 12.5808 13.9616 13.9616 13.9616 13.9616 14.2477 14.2477 14.2477 14.2477 14.8016 14.8016 k = 0.0125 0.2985 0.2593 ( 8176 PWs) bands (ev): 1.8277 1.8277 1.8277 1.8277 2.2931 2.2931 2.2931 2.2931 5.9105 5.9105 5.9105 5.9105 6.2402 6.2402 6.2402 6.2402 6.8765 6.8765 6.8765 6.8765 7.3530 7.3530 7.3530 7.3530 7.3835 7.3835 7.3835 7.3835 8.0053 8.0053 8.0053 8.0053 8.6960 8.6960 8.6960 8.6960 8.7562 8.7562 8.7562 8.7562 9.0228 9.0228 9.0228 9.0228 9.5382 9.5382 9.5382 9.5382 10.0530 10.0530 10.0530 10.0530 10.2094 10.2094 10.2094 10.2094 10.6298 10.6298 10.6298 10.6298 11.2497 11.2497 11.2497 11.2497 12.1963 12.1963 12.1963 12.1963 12.3961 12.3961 12.3961 12.3961 12.5445 12.5445 12.5445 12.5445 13.9686 13.9686 13.9686 13.9686 14.2489 14.2489 14.2489 14.2489 14.8710 14.8710 k = 0.0000 0.2985 0.2593 ( 8196 PWs) bands (ev): 1.8267 1.8267 1.8267 1.8267 2.2923 2.2923 2.2923 2.2923 5.9096 5.9096 5.9096 5.9096 6.2397 6.2397 6.2397 6.2397 6.8763 6.8763 6.8763 6.8763 7.3541 7.3541 7.3541 7.3541 7.3825 7.3825 7.3825 7.3825 8.0054 8.0054 8.0054 8.0054 8.6987 8.6987 8.6987 8.6987 8.7548 8.7548 8.7548 8.7548 9.0248 9.0248 9.0248 9.0248 9.5381 9.5381 9.5381 9.5381 10.0573 10.0573 10.0573 10.0573 10.2093 10.2093 10.2093 10.2093 10.6291 10.6291 10.6291 10.6291 11.2477 11.2477 11.2477 11.2477 12.1965 12.1965 12.1965 12.1965 12.4075 12.4075 12.4075 12.4075 12.5290 12.5290 12.5290 12.5290 13.9710 13.9710 13.9710 13.9710 14.2493 14.2493 14.2493 14.2493 14.9282 14.9289 k = 0.0000 0.2985 0.2593 ( 8196 PWs) bands (ev): 1.8267 1.8267 1.8267 1.8267 2.2923 2.2923 2.2923 2.2923 5.9096 5.9096 5.9096 5.9096 6.2397 6.2397 6.2397 6.2397 6.8763 6.8763 6.8763 6.8763 7.3541 7.3541 7.3541 7.3541 7.3825 7.3825 7.3825 7.3825 8.0054 8.0054 8.0054 8.0054 8.6987 8.6987 8.6987 8.6987 8.7548 8.7548 8.7548 8.7548 9.0248 9.0248 9.0248 9.0248 9.5381 9.5381 9.5381 9.5381 10.0573 10.0573 10.0573 10.0573 10.2093 10.2093 10.2093 10.2093 10.6291 10.6291 10.6291 10.6291 11.2477 11.2477 11.2477 11.2477 12.1965 12.1965 12.1965 12.1965 12.4075 12.4075 12.4075 12.4075 12.5290 12.5290 12.5290 12.5290 13.9710 13.9710 13.9710 13.9710 14.2493 14.2493 14.2493 14.2493 14.9287 14.9292 k = 0.0000 0.2861 0.2593 ( 8182 PWs) bands (ev): 1.8228 1.8228 1.8228 1.8228 2.2966 2.2966 2.2966 2.2966 5.9103 5.9103 5.9103 5.9103 6.2411 6.2411 6.2411 6.2411 6.8761 6.8761 6.8761 6.8761 7.3519 7.3519 7.3519 7.3519 7.3846 7.3846 7.3846 7.3846 8.0052 8.0052 8.0052 8.0052 8.6920 8.6920 8.6920 8.6920 8.7591 8.7591 8.7591 8.7591 9.0256 9.0256 9.0256 9.0256 9.5384 9.5384 9.5384 9.5384 10.0493 10.0493 10.0493 10.0493 10.2149 10.2149 10.2149 10.2149 10.6286 10.6286 10.6286 10.6286 11.2487 11.2487 11.2487 11.2487 12.1978 12.1978 12.1978 12.1978 12.4065 12.4065 12.4065 12.4065 12.5277 12.5277 12.5277 12.5277 13.9693 13.9693 13.9693 13.9693 14.2489 14.2489 14.2489 14.2489 14.9273 14.9277 k = 0.0000 0.2736 0.2593 ( 8176 PWs) bands (ev): 1.8115 1.8115 1.8115 1.8115 2.3089 2.3089 2.3089 2.3089 5.9125 5.9125 5.9125 5.9125 6.2453 6.2453 6.2453 6.2453 6.8754 6.8754 6.8754 6.8754 7.3466 7.3466 7.3466 7.3466 7.3894 7.3894 7.3894 7.3894 8.0046 8.0046 8.0046 8.0046 8.6760 8.6760 8.6760 8.6760 8.7677 8.7677 8.7677 8.7677 9.0280 9.0280 9.0280 9.0280 9.5392 9.5392 9.5392 9.5392 10.0284 10.0284 10.0284 10.0284 10.2288 10.2288 10.2288 10.2288 10.6274 10.6274 10.6274 10.6274 11.2515 11.2515 11.2515 11.2515 12.2016 12.2016 12.2016 12.2016 12.4034 12.4034 12.4034 12.4034 12.5243 12.5243 12.5243 12.5243 13.9643 13.9643 13.9643 13.9643 14.2478 14.2478 14.2478 14.2478 14.9153 14.9154 k = 0.0000 0.2612 0.2593 ( 8168 PWs) bands (ev): 1.7941 1.7941 1.7941 1.7941 2.3282 2.3282 2.3282 2.3282 5.9162 5.9162 5.9162 5.9162 6.2522 6.2522 6.2522 6.2522 6.8743 6.8743 6.8743 6.8743 7.3399 7.3399 7.3399 7.3399 7.3954 7.3954 7.3954 7.3954 8.0037 8.0037 8.0037 8.0037 8.6554 8.6554 8.6554 8.6554 8.7757 8.7757 8.7757 8.7757 9.0323 9.0323 9.0323 9.0323 9.5402 9.5402 9.5402 9.5402 9.9997 9.9997 9.9997 9.9997 10.2462 10.2462 10.2462 10.2462 10.6255 10.6255 10.6255 10.6255 11.2563 11.2563 11.2563 11.2563 12.2069 12.2069 12.2069 12.2069 12.3978 12.3978 12.3978 12.3978 12.5204 12.5204 12.5204 12.5204 13.9561 13.9561 13.9561 13.9561 14.2460 14.2460 14.2460 14.2460 14.8926 14.8926 k = 0.0000 0.2488 0.2593 ( 8166 PWs) bands (ev): 1.7721 1.7721 1.7721 1.7721 2.3528 2.3528 2.3528 2.3528 5.9216 5.9216 5.9216 5.9216 6.2617 6.2617 6.2617 6.2617 6.8727 6.8727 6.8727 6.8727 7.3326 7.3326 7.3326 7.3326 7.4016 7.4016 7.4016 7.4016 8.0024 8.0024 8.0024 8.0024 8.6324 8.6324 8.6324 8.6324 8.7808 8.7808 8.7808 8.7808 9.0388 9.0388 9.0388 9.0388 9.5406 9.5406 9.5406 9.5406 9.9672 9.9672 9.9672 9.9672 10.2638 10.2638 10.2638 10.2638 10.6233 10.6233 10.6233 10.6233 11.2632 11.2632 11.2632 11.2632 12.2119 12.2119 12.2119 12.2119 12.3894 12.3894 12.3894 12.3894 12.5180 12.5180 12.5180 12.5180 13.9450 13.9450 13.9450 13.9450 14.2437 14.2437 14.2437 14.2437 14.8658 14.8658 k = 0.0000 0.2363 0.2593 ( 8162 PWs) bands (ev): 1.7468 1.7468 1.7468 1.7468 2.3813 2.3813 2.3813 2.3813 5.9286 5.9286 5.9286 5.9286 6.2736 6.2736 6.2736 6.2736 6.8707 6.8707 6.8707 6.8707 7.3252 7.3252 7.3252 7.3252 7.4076 7.4076 7.4076 7.4076 8.0008 8.0008 8.0008 8.0008 8.6077 8.6077 8.6077 8.6077 8.7818 8.7818 8.7818 8.7818 9.0480 9.0480 9.0480 9.0480 9.5397 9.5397 9.5397 9.5397 9.9335 9.9335 9.9335 9.9335 10.2798 10.2798 10.2798 10.2798 10.6211 10.6211 10.6211 10.6211 11.2723 11.2723 11.2723 11.2723 12.2142 12.2142 12.2142 12.2142 12.3788 12.3788 12.3788 12.3788 12.5192 12.5192 12.5192 12.5192 13.9315 13.9315 13.9315 13.9315 14.2409 14.2409 14.2409 14.2409 14.8380 14.8380 k = 0.0000 0.2239 0.2593 ( 8174 PWs) bands (ev): 1.7195 1.7195 1.7195 1.7195 2.4124 2.4124 2.4124 2.4124 5.9374 5.9374 5.9374 5.9374 6.2879 6.2879 6.2879 6.2879 6.8681 6.8681 6.8681 6.8681 7.3177 7.3177 7.3177 7.3177 7.4133 7.4133 7.4133 7.4133 7.9989 7.9989 7.9989 7.9989 8.5820 8.5820 8.5820 8.5820 8.7783 8.7783 8.7783 8.7783 9.0599 9.0599 9.0599 9.0599 9.5363 9.5363 9.5363 9.5363 9.9008 9.9008 9.9008 9.9008 10.2934 10.2934 10.2934 10.2934 10.6194 10.6194 10.6194 10.6194 11.2837 11.2837 11.2837 11.2837 12.2106 12.2106 12.2106 12.2106 12.3679 12.3679 12.3679 12.3679 12.5253 12.5253 12.5253 12.5253 13.9159 13.9159 13.9159 13.9159 14.2378 14.2378 14.2378 14.2378 14.8108 14.8108 k = 0.0000 0.2115 0.2593 ( 8174 PWs) bands (ev): 1.6911 1.6911 1.6911 1.6911 2.4450 2.4450 2.4450 2.4450 5.9481 5.9481 5.9481 5.9481 6.3042 6.3042 6.3042 6.3042 6.8650 6.8650 6.8650 6.8650 7.3103 7.3103 7.3103 7.3103 7.4183 7.4183 7.4183 7.4183 7.9968 7.9968 7.9968 7.9968 8.5556 8.5556 8.5556 8.5556 8.7699 8.7699 8.7699 8.7699 9.0745 9.0745 9.0745 9.0745 9.5293 9.5293 9.5293 9.5293 9.8710 9.8710 9.8710 9.8710 10.3037 10.3037 10.3037 10.3037 10.6186 10.6186 10.6186 10.6186 11.2973 11.2973 11.2973 11.2973 12.1987 12.1987 12.1987 12.1987 12.3591 12.3591 12.3591 12.3591 12.5370 12.5370 12.5370 12.5370 13.8989 13.8989 13.8989 13.8989 14.2347 14.2347 14.2347 14.2347 14.7846 14.7846 k = 0.0000 0.1990 0.2593 ( 8190 PWs) bands (ev): 1.6624 1.6624 1.6624 1.6624 2.4783 2.4783 2.4783 2.4783 5.9607 5.9607 5.9607 5.9607 6.3224 6.3224 6.3224 6.3224 6.8613 6.8613 6.8613 6.8613 7.3031 7.3031 7.3031 7.3031 7.4228 7.4228 7.4228 7.4228 7.9945 7.9945 7.9945 7.9945 8.5288 8.5288 8.5288 8.5288 8.7567 8.7567 8.7567 8.7567 9.0915 9.0915 9.0915 9.0915 9.5179 9.5179 9.5179 9.5179 9.8458 9.8458 9.8458 9.8458 10.3105 10.3105 10.3105 10.3105 10.6192 10.6192 10.6192 10.6192 11.3132 11.3132 11.3132 11.3132 12.1776 12.1776 12.1776 12.1776 12.3536 12.3536 12.3536 12.3536 12.5540 12.5540 12.5540 12.5540 13.8810 13.8810 13.8810 13.8810 14.2315 14.2315 14.2315 14.2315 14.7594 14.7594 k = 0.0000 0.1866 0.2593 ( 8188 PWs) bands (ev): 1.6339 1.6339 1.6339 1.6339 2.5118 2.5118 2.5118 2.5118 5.9752 5.9752 5.9752 5.9752 6.3422 6.3422 6.3422 6.3422 6.8570 6.8570 6.8570 6.8570 7.2961 7.2961 7.2961 7.2961 7.4265 7.4265 7.4265 7.4265 7.9920 7.9920 7.9920 7.9920 8.5019 8.5019 8.5019 8.5019 8.7389 8.7389 8.7389 8.7389 9.1105 9.1105 9.1105 9.1105 9.5019 9.5019 9.5019 9.5019 9.8264 9.8264 9.8264 9.8264 10.3134 10.3134 10.3134 10.3134 10.6215 10.6215 10.6215 10.6215 11.3312 11.3312 11.3312 11.3312 12.1489 12.1489 12.1489 12.1489 12.3508 12.3508 12.3508 12.3508 12.5756 12.5756 12.5756 12.5756 13.8627 13.8627 13.8627 13.8627 14.2286 14.2286 14.2286 14.2286 14.7350 14.7350 k = 0.0000 0.1741 0.2593 ( 8180 PWs) bands (ev): 1.6061 1.6061 1.6061 1.6061 2.5448 2.5448 2.5448 2.5448 5.9916 5.9916 5.9916 5.9916 6.3635 6.3635 6.3635 6.3635 6.8521 6.8521 6.8521 6.8521 7.2892 7.2892 7.2892 7.2892 7.4294 7.4294 7.4294 7.4294 7.9894 7.9894 7.9894 7.9894 8.4752 8.4752 8.4752 8.4752 8.7167 8.7167 8.7167 8.7167 9.1308 9.1308 9.1308 9.1308 9.4820 9.4820 9.4820 9.4820 9.8127 9.8127 9.8127 9.8127 10.3124 10.3124 10.3124 10.3124 10.6255 10.6255 10.6255 10.6255 11.3511 11.3511 11.3511 11.3511 12.1152 12.1152 12.1152 12.1152 12.3495 12.3495 12.3495 12.3495 12.6009 12.6009 12.6009 12.6009 13.8445 13.8445 13.8445 13.8445 14.2261 14.2261 14.2261 14.2261 14.7110 14.7110 k = 0.0000 0.1617 0.2593 ( 8172 PWs) bands (ev): 1.5792 1.5792 1.5792 1.5792 2.5770 2.5770 2.5770 2.5770 6.0100 6.0100 6.0100 6.0100 6.3860 6.3860 6.3860 6.3860 6.8465 6.8465 6.8465 6.8465 7.2827 7.2827 7.2827 7.2827 7.4315 7.4315 7.4315 7.4315 7.9867 7.9867 7.9867 7.9867 8.4489 8.4489 8.4489 8.4489 8.6905 8.6905 8.6905 8.6905 9.1518 9.1518 9.1518 9.1518 9.4601 9.4601 9.4601 9.4601 9.8040 9.8040 9.8040 9.8040 10.3076 10.3076 10.3076 10.3076 10.6313 10.6313 10.6313 10.6313 11.3726 11.3726 11.3726 11.3726 12.0787 12.0787 12.0787 12.0787 12.3486 12.3486 12.3486 12.3486 12.6288 12.6288 12.6288 12.6288 13.8269 13.8269 13.8269 13.8269 14.2240 14.2240 14.2240 14.2240 14.6872 14.6872 k = 0.0000 0.1493 0.2593 ( 8172 PWs) bands (ev): 1.5535 1.5535 1.5535 1.5535 2.6079 2.6079 2.6079 2.6079 6.0300 6.0300 6.0300 6.0300 6.4093 6.4093 6.4093 6.4093 6.8401 6.8401 6.8401 6.8401 7.2763 7.2763 7.2763 7.2763 7.4329 7.4329 7.4329 7.4329 7.9837 7.9837 7.9837 7.9837 8.4231 8.4231 8.4231 8.4231 8.6609 8.6609 8.6609 8.6609 9.1725 9.1725 9.1725 9.1725 9.4383 9.4383 9.4383 9.4383 9.7993 9.7993 9.7993 9.7993 10.2994 10.2994 10.2994 10.2994 10.6385 10.6385 10.6385 10.6385 11.3953 11.3953 11.3953 11.3953 12.0411 12.0411 12.0411 12.0411 12.3478 12.3478 12.3478 12.3478 12.6583 12.6583 12.6583 12.6583 13.8103 13.8103 13.8103 13.8103 14.2227 14.2227 14.2227 14.2227 14.6632 14.6632 k = 0.0000 0.1368 0.2593 ( 8168 PWs) bands (ev): 1.5293 1.5293 1.5293 1.5293 2.6373 2.6373 2.6373 2.6373 6.0517 6.0517 6.0517 6.0517 6.4334 6.4334 6.4334 6.4334 6.8331 6.8331 6.8331 6.8331 7.2703 7.2703 7.2703 7.2703 7.4336 7.4336 7.4336 7.4336 7.9806 7.9806 7.9806 7.9806 8.3981 8.3981 8.3981 8.3981 8.6284 8.6284 8.6284 8.6284 9.1915 9.1915 9.1915 9.1915 9.4193 9.4193 9.4193 9.4193 9.7973 9.7973 9.7973 9.7973 10.2882 10.2882 10.2882 10.2882 10.6469 10.6469 10.6469 10.6469 11.4188 11.4188 11.4188 11.4188 12.0036 12.0036 12.0036 12.0036 12.3470 12.3470 12.3470 12.3470 12.6886 12.6886 12.6886 12.6886 13.7951 13.7951 13.7951 13.7951 14.2221 14.2221 14.2221 14.2221 14.6390 14.6390 k = 0.0000 0.1244 0.2593 ( 8180 PWs) bands (ev): 1.5068 1.5068 1.5068 1.5068 2.6648 2.6648 2.6648 2.6648 6.0745 6.0745 6.0745 6.0745 6.4577 6.4577 6.4577 6.4577 6.8254 6.8254 6.8254 6.8254 7.2645 7.2645 7.2645 7.2645 7.4335 7.4335 7.4335 7.4335 7.9771 7.9771 7.9771 7.9771 8.3739 8.3739 8.3739 8.3739 8.5942 8.5942 8.5942 8.5942 9.2072 9.2072 9.2072 9.2072 9.4057 9.4057 9.4057 9.4057 9.7969 9.7969 9.7969 9.7969 10.2744 10.2744 10.2744 10.2744 10.6560 10.6560 10.6560 10.6560 11.4428 11.4428 11.4428 11.4428 11.9673 11.9673 11.9673 11.9673 12.3462 12.3462 12.3462 12.3462 12.7187 12.7187 12.7187 12.7187 13.7814 13.7814 13.7814 13.7814 14.2225 14.2225 14.2225 14.2225 14.6143 14.6143 k = 0.0000 0.1119 0.2593 ( 8188 PWs) bands (ev): 1.4860 1.4860 1.4860 1.4860 2.6904 2.6904 2.6904 2.6904 6.0983 6.0983 6.0983 6.0983 6.4821 6.4821 6.4821 6.4821 6.8170 6.8170 6.8170 6.8170 7.2591 7.2591 7.2591 7.2591 7.4329 7.4329 7.4329 7.4329 7.9733 7.9733 7.9733 7.9733 8.3506 8.3506 8.3506 8.3506 8.5592 8.5592 8.5592 8.5592 9.2176 9.2176 9.2176 9.2176 9.4000 9.4000 9.4000 9.4000 9.7976 9.7976 9.7976 9.7976 10.2587 10.2587 10.2587 10.2587 10.6654 10.6654 10.6654 10.6654 11.4666 11.4666 11.4666 11.4666 11.9327 11.9327 11.9327 11.9327 12.3453 12.3453 12.3453 12.3453 12.7479 12.7479 12.7479 12.7479 13.7694 13.7694 13.7694 13.7694 14.2239 14.2239 14.2239 14.2239 14.5894 14.5894 k = 0.0000 0.0995 0.2593 ( 8184 PWs) bands (ev): 1.4672 1.4672 1.4672 1.4672 2.7137 2.7137 2.7137 2.7137 6.1226 6.1226 6.1226 6.1226 6.5060 6.5060 6.5060 6.5060 6.8080 6.8080 6.8080 6.8080 7.2541 7.2541 7.2541 7.2541 7.4317 7.4317 7.4317 7.4317 7.9692 7.9692 7.9692 7.9692 8.3283 8.3283 8.3283 8.3283 8.5248 8.5248 8.5248 8.5248 9.2217 9.2217 9.2217 9.2217 9.4031 9.4031 9.4031 9.4031 9.7986 9.7986 9.7986 9.7986 10.2415 10.2415 10.2415 10.2415 10.6748 10.6748 10.6748 10.6748 11.4897 11.4897 11.4897 11.4897 11.9007 11.9007 11.9007 11.9007 12.3446 12.3446 12.3446 12.3446 12.7758 12.7758 12.7758 12.7758 13.7593 13.7593 13.7593 13.7593 14.2263 14.2263 14.2263 14.2263 14.5642 14.5642 k = 0.0000 0.0871 0.2593 ( 8182 PWs) bands (ev): 1.4503 1.4503 1.4503 1.4503 2.7345 2.7345 2.7345 2.7345 6.1468 6.1468 6.1468 6.1468 6.5292 6.5292 6.5292 6.5292 6.7987 6.7987 6.7987 6.7987 7.2494 7.2494 7.2494 7.2494 7.4302 7.4302 7.4302 7.4302 7.9646 7.9646 7.9646 7.9646 8.3070 8.3070 8.3070 8.3070 8.4922 8.4922 8.4922 8.4922 9.2203 9.2203 9.2203 9.2203 9.4139 9.4139 9.4139 9.4139 9.7996 9.7996 9.7996 9.7996 10.2236 10.2236 10.2236 10.2236 10.6838 10.6838 10.6838 10.6838 11.5117 11.5117 11.5117 11.5117 11.8715 11.8715 11.8715 11.8715 12.3440 12.3440 12.3440 12.3440 12.8016 12.8016 12.8016 12.8016 13.7511 13.7511 13.7511 13.7511 14.2299 14.2299 14.2299 14.2299 14.5392 14.5392 k = 0.0000 0.0746 0.2593 ( 8186 PWs) bands (ev): 1.4356 1.4356 1.4356 1.4356 2.7529 2.7529 2.7529 2.7529 6.1702 6.1702 6.1702 6.1702 6.5510 6.5510 6.5510 6.5510 6.7891 6.7891 6.7891 6.7891 7.2452 7.2452 7.2452 7.2452 7.4284 7.4284 7.4284 7.4284 7.9596 7.9596 7.9596 7.9596 8.2870 8.2870 8.2870 8.2870 8.4628 8.4628 8.4628 8.4628 9.2155 9.2155 9.2155 9.2155 9.4297 9.4297 9.4297 9.4297 9.8005 9.8005 9.8005 9.8005 10.2056 10.2056 10.2056 10.2056 10.6922 10.6922 10.6922 10.6922 11.5320 11.5320 11.5320 11.5320 11.8456 11.8456 11.8456 11.8456 12.3436 12.3436 12.3436 12.3436 12.8250 12.8250 12.8250 12.8250 13.7446 13.7446 13.7446 13.7446 14.2346 14.2346 14.2346 14.2346 14.5146 14.5146 k = 0.0000 0.0622 0.2593 ( 8170 PWs) bands (ev): 1.4230 1.4230 1.4230 1.4230 2.7686 2.7686 2.7686 2.7686 6.1922 6.1922 6.1922 6.1922 6.5710 6.5710 6.5710 6.5710 6.7797 6.7797 6.7797 6.7797 7.2415 7.2415 7.2415 7.2415 7.4265 7.4265 7.4265 7.4265 7.9545 7.9545 7.9545 7.9545 8.2685 8.2685 8.2685 8.2685 8.4374 8.4374 8.4374 8.4374 9.2095 9.2095 9.2095 9.2095 9.4478 9.4478 9.4478 9.4478 9.8009 9.8009 9.8009 9.8009 10.1883 10.1883 10.1883 10.1883 10.6997 10.6997 10.6997 10.6997 11.5501 11.5501 11.5501 11.5501 11.8233 11.8233 11.8233 11.8233 12.3434 12.3434 12.3434 12.3434 12.8454 12.8454 12.8454 12.8454 13.7398 13.7398 13.7398 13.7398 14.2403 14.2403 14.2403 14.2403 14.4911 14.4911 k = 0.0000 0.0498 0.2593 ( 8170 PWs) bands (ev): 1.4126 1.4126 1.4126 1.4126 2.7816 2.7816 2.7816 2.7816 6.2119 6.2119 6.2119 6.2119 6.5886 6.5886 6.5886 6.5886 6.7709 6.7709 6.7709 6.7709 7.2383 7.2383 7.2383 7.2383 7.4247 7.4247 7.4247 7.4247 7.9494 7.9494 7.9494 7.9494 8.2521 8.2521 8.2521 8.2521 8.4167 8.4167 8.4167 8.4167 9.2034 9.2034 9.2034 9.2034 9.4659 9.4659 9.4659 9.4659 9.8010 9.8010 9.8010 9.8010 10.1724 10.1724 10.1724 10.1724 10.7060 10.7060 10.7060 10.7060 11.5657 11.5657 11.5657 11.5657 11.8048 11.8048 11.8048 11.8048 12.3433 12.3433 12.3433 12.3433 12.8627 12.8627 12.8627 12.8627 13.7364 13.7364 13.7364 13.7364 14.2468 14.2468 14.2468 14.2468 14.4693 14.4693 k = 0.0000 0.0373 0.2593 ( 8158 PWs) bands (ev): 1.4045 1.4045 1.4045 1.4045 2.7918 2.7918 2.7918 2.7918 6.2285 6.2285 6.2285 6.2285 6.6031 6.6031 6.6031 6.6031 6.7631 6.7631 6.7631 6.7631 7.2358 7.2358 7.2358 7.2358 7.4231 7.4231 7.4231 7.4231 7.9447 7.9447 7.9447 7.9447 8.2384 8.2384 8.2384 8.2384 8.4008 8.4008 8.4008 8.4008 9.1982 9.1982 9.1982 9.1982 9.4821 9.4821 9.4821 9.4821 9.8008 9.8008 9.8008 9.8008 10.1589 10.1589 10.1589 10.1589 10.7112 10.7112 10.7112 10.7112 11.5782 11.5782 11.5782 11.5782 11.7902 11.7902 11.7902 11.7902 12.3433 12.3433 12.3433 12.3433 12.8763 12.8763 12.8763 12.8763 13.7342 13.7342 13.7342 13.7342 14.2534 14.2534 14.2534 14.2534 14.4501 14.4501 k = 0.0000 0.0249 0.2593 ( 8174 PWs) bands (ev): 1.3986 1.3986 1.3986 1.3986 2.7990 2.7990 2.7990 2.7990 6.2410 6.2410 6.2410 6.2410 6.6141 6.6141 6.6141 6.6141 6.7570 6.7570 6.7570 6.7570 7.2339 7.2339 7.2339 7.2339 7.4218 7.4218 7.4218 7.4218 7.9409 7.9409 7.9409 7.9409 8.2281 8.2281 8.2281 8.2281 8.3896 8.3896 8.3896 8.3896 9.1943 9.1943 9.1943 9.1943 9.4949 9.4949 9.4949 9.4949 9.8004 9.8004 9.8004 9.8004 10.1485 10.1485 10.1485 10.1485 10.7149 10.7149 10.7149 10.7149 11.5873 11.5873 11.5873 11.5873 11.7797 11.7797 11.7797 11.7797 12.3434 12.3434 12.3434 12.3434 12.8863 12.8863 12.8863 12.8863 13.7329 13.7329 13.7329 13.7329 14.2596 14.2596 14.2596 14.2596 14.4347 14.4347 k = 0.0000 0.0124 0.2593 ( 8172 PWs) bands (ev): 1.3951 1.3951 1.3951 1.3951 2.8034 2.8034 2.8034 2.8034 6.2489 6.2489 6.2489 6.2489 6.6209 6.6209 6.6209 6.6209 6.7530 6.7530 6.7530 6.7530 7.2328 7.2328 7.2328 7.2328 7.4209 7.4209 7.4209 7.4209 7.9384 7.9384 7.9384 7.9384 8.2217 8.2217 8.2217 8.2217 8.3830 8.3830 8.3830 8.3830 9.1919 9.1919 9.1919 9.1919 9.5031 9.5031 9.5031 9.5031 9.8000 9.8000 9.8000 9.8000 10.1419 10.1419 10.1419 10.1419 10.7172 10.7172 10.7172 10.7172 11.5930 11.5930 11.5930 11.5930 11.7734 11.7734 11.7734 11.7734 12.3434 12.3434 12.3434 12.3434 12.8923 12.8923 12.8923 12.8923 13.7322 13.7322 13.7322 13.7322 14.2640 14.2640 14.2640 14.2640 14.4245 14.4245 k = 0.0000 0.0000 0.2593 ( 8168 PWs) bands (ev): 1.3940 1.3940 1.3940 1.3940 2.8049 2.8049 2.8049 2.8049 6.2516 6.2516 6.2516 6.2516 6.6232 6.6232 6.6232 6.6232 6.7516 6.7516 6.7516 6.7516 7.2324 7.2324 7.2324 7.2324 7.4206 7.4206 7.4206 7.4206 7.9375 7.9375 7.9375 7.9375 8.2196 8.2196 8.2196 8.2196 8.3808 8.3808 8.3808 8.3808 9.1911 9.1911 9.1911 9.1911 9.5060 9.5060 9.5060 9.5060 9.7999 9.7999 9.7999 9.7999 10.1397 10.1397 10.1397 10.1397 10.7180 10.7180 10.7180 10.7180 11.5948 11.5948 11.5948 11.5948 11.7712 11.7712 11.7712 11.7712 12.3435 12.3435 12.3435 12.3435 12.8943 12.8943 12.8943 12.8943 13.7320 13.7320 13.7320 13.7320 14.2657 14.2657 14.2657 14.2657 14.4210 14.4210 k = 0.0000 0.2985-0.0000 ( 8180 PWs) bands (ev): 1.5455 1.5455 1.5455 1.5455 2.6944 2.6944 2.6944 2.6944 5.6050 5.6050 5.6050 5.6050 6.5960 6.5960 6.5960 6.5960 6.7938 6.7938 6.7938 6.7938 7.2202 7.2202 7.2202 7.2202 7.4893 7.4893 7.4893 7.4893 7.8797 7.8797 7.8797 7.8797 8.4123 8.4123 8.4123 8.4123 8.8510 8.8510 8.8510 8.8510 9.2097 9.2097 9.2097 9.2097 9.5945 9.5945 9.5945 9.5945 9.8608 9.8608 9.8608 9.8608 10.3907 10.3907 10.3907 10.3907 10.6709 10.6709 10.6709 10.6709 11.4979 11.4979 11.4979 11.4979 11.7699 11.7699 11.7699 11.7699 12.5133 12.5133 12.5133 12.5133 12.9250 12.9250 12.9250 12.9250 13.3437 13.3437 13.3437 13.3437 14.3991 14.3991 14.3991 14.3991 15.1558 15.1558 k = 0.0000 0.2985 0.0123 ( 8178 PWs) bands (ev): 1.5465 1.5465 1.5465 1.5465 2.6926 2.6926 2.6926 2.6926 5.6064 5.6064 5.6064 5.6064 6.5938 6.5938 6.5938 6.5938 6.7948 6.7948 6.7948 6.7948 7.2206 7.2206 7.2206 7.2206 7.4893 7.4893 7.4893 7.4893 7.8804 7.8804 7.8804 7.8804 8.4123 8.4123 8.4123 8.4123 8.8512 8.8512 8.8512 8.8512 9.2104 9.2104 9.2104 9.2104 9.5942 9.5942 9.5942 9.5942 9.8595 9.8595 9.8595 9.8595 10.3896 10.3896 10.3896 10.3896 10.6739 10.6739 10.6739 10.6739 11.4924 11.4924 11.4924 11.4924 11.7729 11.7729 11.7729 11.7729 12.5128 12.5128 12.5128 12.5128 12.9194 12.9194 12.9194 12.9194 13.3536 13.3536 13.3536 13.3536 14.3973 14.3973 14.3973 14.3973 15.1533 15.1533 k = 0.0000 0.2985 0.0247 ( 8190 PWs) bands (ev): 1.5497 1.5497 1.5497 1.5497 2.6873 2.6873 2.6873 2.6873 5.6104 5.6104 5.6104 5.6104 6.5872 6.5872 6.5872 6.5872 6.7976 6.7976 6.7976 6.7976 7.2219 7.2219 7.2219 7.2219 7.4892 7.4892 7.4892 7.4892 7.8827 7.8827 7.8827 7.8827 8.4124 8.4124 8.4124 8.4124 8.8519 8.8519 8.8519 8.8519 9.2126 9.2126 9.2126 9.2126 9.5934 9.5934 9.5934 9.5934 9.8555 9.8555 9.8555 9.8555 10.3864 10.3864 10.3864 10.3864 10.6827 10.6827 10.6827 10.6827 11.4763 11.4763 11.4763 11.4763 11.7815 11.7815 11.7815 11.7815 12.5115 12.5115 12.5115 12.5115 12.9043 12.9043 12.9043 12.9043 13.3816 13.3816 13.3816 13.3816 14.3917 14.3917 14.3917 14.3917 15.1458 15.1458 k = 0.0000 0.2985 0.0370 ( 8188 PWs) bands (ev): 1.5549 1.5549 1.5549 1.5549 2.6785 2.6785 2.6785 2.6785 5.6170 5.6170 5.6170 5.6170 6.5768 6.5768 6.5768 6.5768 6.8019 6.8019 6.8019 6.8019 7.2239 7.2239 7.2239 7.2239 7.4890 7.4890 7.4890 7.4890 7.8864 7.8864 7.8864 7.8864 8.4126 8.4126 8.4126 8.4126 8.8531 8.8531 8.8531 8.8531 9.2159 9.2159 9.2159 9.2159 9.5922 9.5922 9.5922 9.5922 9.8493 9.8493 9.8493 9.8493 10.3811 10.3811 10.3811 10.3811 10.6970 10.6970 10.6970 10.6970 11.4511 11.4511 11.4511 11.4511 11.7948 11.7948 11.7948 11.7948 12.5092 12.5092 12.5092 12.5092 12.8830 12.8830 12.8830 12.8830 13.4237 13.4237 13.4237 13.4237 14.3826 14.3826 14.3826 14.3826 15.1338 15.1338 k = 0.0000 0.2985 0.0494 ( 8188 PWs) bands (ev): 1.5622 1.5622 1.5622 1.5622 2.6664 2.6664 2.6664 2.6664 5.6261 5.6261 5.6261 5.6261 6.5631 6.5631 6.5631 6.5631 6.8072 6.8072 6.8072 6.8072 7.2267 7.2267 7.2267 7.2267 7.4885 7.4885 7.4885 7.4885 7.8915 7.8915 7.8915 7.8915 8.4132 8.4132 8.4132 8.4132 8.8545 8.8545 8.8545 8.8545 9.2202 9.2202 9.2202 9.2202 9.5907 9.5907 9.5907 9.5907 9.8411 9.8411 9.8411 9.8411 10.3742 10.3742 10.3742 10.3742 10.7163 10.7163 10.7163 10.7163 11.4182 11.4182 11.4182 11.4182 11.8118 11.8118 11.8118 11.8118 12.5061 12.5061 12.5061 12.5061 12.8588 12.8588 12.8588 12.8588 13.4757 13.4757 13.4757 13.4757 14.3697 14.3697 14.3697 14.3697 15.1180 15.1180 k = 0.0000 0.2985 0.0617 ( 8196 PWs) bands (ev): 1.5715 1.5715 1.5715 1.5715 2.6512 2.6512 2.6512 2.6512 5.6376 5.6376 5.6376 5.6376 6.5465 6.5465 6.5465 6.5465 6.8131 6.8131 6.8131 6.8131 7.2303 7.2303 7.2303 7.2303 7.4877 7.4877 7.4877 7.4877 7.8980 7.8980 7.8980 7.8980 8.4144 8.4144 8.4144 8.4144 8.8559 8.8559 8.8559 8.8559 9.2248 9.2248 9.2248 9.2248 9.5891 9.5891 9.5891 9.5891 9.8318 9.8318 9.8318 9.8318 10.3659 10.3659 10.3659 10.3659 10.7398 10.7398 10.7398 10.7398 11.3793 11.3793 11.3793 11.3793 11.8316 11.8316 11.8316 11.8316 12.5022 12.5022 12.5022 12.5022 12.8336 12.8336 12.8336 12.8336 13.5345 13.5345 13.5345 13.5345 14.3532 14.3532 14.3532 14.3532 15.0993 15.0993 k = 0.0000 0.2985 0.0741 ( 8188 PWs) bands (ev): 1.5828 1.5828 1.5828 1.5828 2.6330 2.6330 2.6330 2.6330 5.6512 5.6512 5.6512 5.6512 6.5278 6.5278 6.5278 6.5278 6.8194 6.8194 6.8194 6.8194 7.2346 7.2346 7.2346 7.2346 7.4864 7.4864 7.4864 7.4864 7.9056 7.9056 7.9056 7.9056 8.4165 8.4165 8.4165 8.4165 8.8573 8.8573 8.8573 8.8573 9.2289 9.2289 9.2289 9.2289 9.5878 9.5878 9.5878 9.5878 9.8220 9.8220 9.8220 9.8220 10.3564 10.3564 10.3564 10.3564 10.7667 10.7667 10.7667 10.7667 11.3359 11.3359 11.3359 11.3359 11.8538 11.8538 11.8538 11.8538 12.4975 12.4975 12.4975 12.4975 12.8088 12.8088 12.8088 12.8088 13.5974 13.5974 13.5974 13.5974 14.3332 14.3332 14.3332 14.3332 15.0786 15.0786 k = 0.0000 0.2985 0.0864 ( 8184 PWs) bands (ev): 1.5959 1.5959 1.5959 1.5959 2.6122 2.6122 2.6122 2.6122 5.6669 5.6669 5.6669 5.6669 6.5073 6.5073 6.5073 6.5073 6.8257 6.8257 6.8257 6.8257 7.2395 7.2395 7.2395 7.2395 7.4845 7.4845 7.4845 7.4845 7.9142 7.9142 7.9142 7.9142 8.4199 8.4199 8.4199 8.4199 8.8585 8.8585 8.8585 8.8585 9.2318 9.2318 9.2318 9.2318 9.5868 9.5868 9.5868 9.5868 9.8128 9.8128 9.8128 9.8128 10.3463 10.3463 10.3463 10.3463 10.7961 10.7961 10.7961 10.7961 11.2893 11.2893 11.2893 11.2893 11.8780 11.8780 11.8780 11.8780 12.4919 12.4919 12.4919 12.4919 12.7847 12.7847 12.7847 12.7847 13.6625 13.6625 13.6625 13.6625 14.3099 14.3099 14.3099 14.3099 15.0571 15.0571 k = 0.0000 0.2985 0.0988 ( 8190 PWs) bands (ev): 1.6108 1.6108 1.6108 1.6108 2.5889 2.5889 2.5889 2.5889 5.6843 5.6843 5.6843 5.6843 6.4854 6.4854 6.4854 6.4854 6.8320 6.8320 6.8320 6.8320 7.2450 7.2450 7.2450 7.2450 7.4818 7.4818 7.4818 7.4818 7.9236 7.9236 7.9236 7.9236 8.4250 8.4250 8.4250 8.4250 8.8593 8.8593 8.8593 8.8593 9.2323 9.2323 9.2323 9.2323 9.5862 9.5862 9.5862 9.5862 9.8054 9.8054 9.8054 9.8054 10.3357 10.3357 10.3357 10.3357 10.8265 10.8265 10.8265 10.8265 11.2412 11.2412 11.2412 11.2412 11.9038 11.9038 11.9038 11.9038 12.4856 12.4856 12.4856 12.4856 12.7615 12.7615 12.7615 12.7615 13.7282 13.7282 13.7282 13.7282 14.2836 14.2836 14.2836 14.2836 15.0354 15.0354 k = 0.0000 0.2985 0.1111 ( 8190 PWs) bands (ev): 1.6272 1.6272 1.6272 1.6272 2.5637 2.5637 2.5637 2.5637 5.7032 5.7032 5.7032 5.7032 6.4624 6.4624 6.4624 6.4624 6.8380 6.8380 6.8380 6.8380 7.2512 7.2512 7.2512 7.2512 7.4782 7.4782 7.4782 7.4782 7.9336 7.9336 7.9336 7.9336 8.4321 8.4321 8.4321 8.4321 8.8596 8.8596 8.8596 8.8596 9.2294 9.2294 9.2294 9.2294 9.5858 9.5858 9.5858 9.5858 9.8012 9.8012 9.8012 9.8012 10.3249 10.3249 10.3249 10.3249 10.8561 10.8561 10.8561 10.8561 11.1939 11.1939 11.1939 11.1939 11.9310 11.9310 11.9310 11.9310 12.4786 12.4786 12.4786 12.4786 12.7391 12.7391 12.7391 12.7391 13.7933 13.7933 13.7933 13.7933 14.2547 14.2547 14.2547 14.2547 15.0146 15.0146 k = 0.0000 0.2985 0.1235 ( 8194 PWs) bands (ev): 1.6452 1.6452 1.6452 1.6452 2.5367 2.5367 2.5367 2.5367 5.7234 5.7234 5.7234 5.7234 6.4387 6.4387 6.4387 6.4387 6.8438 6.8438 6.8438 6.8438 7.2579 7.2579 7.2579 7.2579 7.4737 7.4737 7.4737 7.4737 7.9437 7.9437 7.9437 7.9437 8.4416 8.4416 8.4416 8.4416 8.8594 8.8594 8.8594 8.8594 9.2223 9.2223 9.2223 9.2223 9.5850 9.5850 9.5850 9.5850 9.8019 9.8019 9.8019 9.8019 10.3143 10.3143 10.3143 10.3143 10.8814 10.8814 10.8814 10.8814 11.1508 11.1508 11.1508 11.1508 11.9592 11.9592 11.9592 11.9592 12.4709 12.4709 12.4709 12.4709 12.7173 12.7173 12.7173 12.7173 13.8566 13.8566 13.8566 13.8566 14.2240 14.2240 14.2240 14.2240 14.9952 14.9952 k = 0.0000 0.2985 0.1358 ( 8186 PWs) bands (ev): 1.6644 1.6644 1.6644 1.6644 2.5085 2.5085 2.5085 2.5085 5.7445 5.7445 5.7445 5.7445 6.4147 6.4147 6.4147 6.4147 6.8491 6.8491 6.8491 6.8491 7.2652 7.2652 7.2652 7.2652 7.4682 7.4682 7.4682 7.4682 7.9537 7.9537 7.9537 7.9537 8.4539 8.4539 8.4539 8.4539 8.8584 8.8584 8.8584 8.8584 9.2107 9.2107 9.2107 9.2107 9.5832 9.5832 9.5832 9.5832 9.8087 9.8087 9.8087 9.8087 10.3038 10.3038 10.3038 10.3038 10.8966 10.8966 10.8966 10.8966 11.1180 11.1180 11.1180 11.1180 11.9880 11.9880 11.9880 11.9880 12.4627 12.4627 12.4627 12.4627 12.6959 12.6959 12.6959 12.6959 13.9171 13.9171 13.9171 13.9171 14.1923 14.1923 14.1923 14.1923 14.9777 14.9777 k = 0.0000 0.2985 0.1482 ( 8174 PWs) bands (ev): 1.6846 1.6846 1.6846 1.6846 2.4794 2.4794 2.4794 2.4794 5.7662 5.7662 5.7662 5.7662 6.3904 6.3904 6.3904 6.3904 6.8541 6.8541 6.8541 6.8541 7.2731 7.2731 7.2731 7.2731 7.4617 7.4617 7.4617 7.4617 7.9632 7.9632 7.9632 7.9632 8.4693 8.4693 8.4693 8.4693 8.8566 8.8566 8.8566 8.8566 9.1944 9.1944 9.1944 9.1944 9.5798 9.5798 9.5798 9.5798 9.8224 9.8224 9.8224 9.8224 10.2937 10.2937 10.2937 10.2937 10.8934 10.8934 10.8934 10.8934 11.1036 11.1036 11.1036 11.1036 12.0172 12.0172 12.0172 12.0172 12.4540 12.4540 12.4540 12.4540 12.6747 12.6747 12.6747 12.6747 13.9735 13.9735 13.9735 13.9735 14.1607 14.1607 14.1607 14.1607 14.9625 14.9625 k = 0.0000 0.2985 0.1605 ( 8180 PWs) bands (ev): 1.7056 1.7056 1.7056 1.7056 2.4501 2.4501 2.4501 2.4501 5.7883 5.7883 5.7883 5.7883 6.3664 6.3664 6.3664 6.3664 6.8586 6.8586 6.8586 6.8586 7.2816 7.2816 7.2816 7.2816 7.4542 7.4542 7.4542 7.4542 7.9721 7.9721 7.9721 7.9721 8.4879 8.4879 8.4879 8.4879 8.8537 8.8537 8.8537 8.8537 9.1741 9.1741 9.1741 9.1741 9.5748 9.5748 9.5748 9.5748 9.8427 9.8427 9.8427 9.8427 10.2839 10.2839 10.2839 10.2839 10.8700 10.8700 10.8700 10.8700 11.1096 11.1096 11.1096 11.1096 12.0463 12.0463 12.0463 12.0463 12.4451 12.4451 12.4451 12.4451 12.6536 12.6536 12.6536 12.6536 14.0239 14.0239 14.0239 14.0239 14.1313 14.1313 14.1313 14.1313 14.9498 14.9498 k = 0.0000 0.2985 0.1729 ( 8180 PWs) bands (ev): 1.7268 1.7268 1.7268 1.7268 2.4209 2.4209 2.4209 2.4209 5.8102 5.8102 5.8102 5.8102 6.3428 6.3428 6.3428 6.3428 6.8627 6.8627 6.8627 6.8627 7.2906 7.2906 7.2906 7.2906 7.4459 7.4459 7.4459 7.4459 7.9801 7.9801 7.9801 7.9801 8.5098 8.5098 8.5098 8.5098 8.8495 8.8495 8.8495 8.8495 9.1506 9.1506 9.1506 9.1506 9.5687 9.5687 9.5687 9.5687 9.8688 9.8688 9.8688 9.8688 10.2743 10.2743 10.2743 10.2743 10.8335 10.8335 10.8335 10.8335 11.1288 11.1288 11.1288 11.1288 12.0748 12.0748 12.0748 12.0748 12.4364 12.4364 12.4364 12.4364 12.6327 12.6327 12.6327 12.6327 14.0593 14.0593 14.0593 14.0593 14.1133 14.1133 14.1133 14.1133 14.9397 14.9397 k = 0.0000 0.2985 0.1852 ( 8166 PWs) bands (ev): 1.7479 1.7479 1.7479 1.7479 2.3926 2.3926 2.3926 2.3926 5.8316 5.8316 5.8316 5.8316 6.3202 6.3202 6.3202 6.3202 6.8663 6.8663 6.8663 6.8663 7.3001 7.3001 7.3001 7.3001 7.4367 7.4367 7.4367 7.4367 7.9870 7.9870 7.9870 7.9870 8.5347 8.5347 8.5347 8.5347 8.8434 8.8434 8.8434 8.8434 9.1252 9.1252 9.1252 9.1252 9.5622 9.5622 9.5622 9.5622 9.8993 9.8993 9.8993 9.8993 10.2646 10.2646 10.2646 10.2646 10.7919 10.7919 10.7919 10.7919 11.1531 11.1531 11.1531 11.1531 12.1022 12.1022 12.1022 12.1022 12.4281 12.4281 12.4281 12.4281 12.6120 12.6120 12.6120 12.6120 14.0543 14.0543 14.0543 14.0543 14.1324 14.1324 14.1324 14.1324 14.9322 14.9322 k = 0.0000 0.2985 0.1976 ( 8166 PWs) bands (ev): 1.7682 1.7682 1.7682 1.7682 2.3660 2.3660 2.3660 2.3660 5.8519 5.8519 5.8519 5.8519 6.2990 6.2990 6.2990 6.2990 6.8693 6.8693 6.8693 6.8693 7.3100 7.3100 7.3100 7.3100 7.4269 7.4269 7.4269 7.4269 7.9928 7.9928 7.9928 7.9928 8.5624 8.5624 8.5624 8.5624 8.8349 8.8349 8.8349 8.8349 9.0994 9.0994 9.0994 9.0994 9.5557 9.5557 9.5557 9.5557 9.9325 9.9325 9.9325 9.9325 10.2547 10.2547 10.2547 10.2547 10.7501 10.7501 10.7501 10.7501 11.1782 11.1782 11.1782 11.1782 12.1277 12.1277 12.1277 12.1277 12.4208 12.4208 12.4208 12.4208 12.5919 12.5919 12.5919 12.5919 14.0328 14.0328 14.0328 14.0328 14.1651 14.1651 14.1651 14.1651 14.9271 14.9271 k = 0.0000 0.2985 0.2099 ( 8166 PWs) bands (ev): 1.7869 1.7869 1.7869 1.7869 2.3420 2.3420 2.3420 2.3420 5.8705 5.8705 5.8705 5.8705 6.2798 6.2798 6.2798 6.2798 6.8718 6.8718 6.8718 6.8718 7.3202 7.3202 7.3202 7.3202 7.4167 7.4167 7.4167 7.4167 7.9974 7.9974 7.9974 7.9974 8.5923 8.5923 8.5923 8.5923 8.8232 8.8232 8.8232 8.8232 9.0751 9.0751 9.0751 9.0751 9.5498 9.5498 9.5498 9.5498 9.9667 9.9667 9.9667 9.9667 10.2443 10.2443 10.2443 10.2443 10.7112 10.7112 10.7112 10.7112 11.2013 11.2013 11.2013 11.2013 12.1505 12.1505 12.1505 12.1505 12.4149 12.4149 12.4149 12.4149 12.5729 12.5729 12.5729 12.5729 14.0120 14.0120 14.0120 14.0120 14.1945 14.1945 14.1945 14.1945 14.9244 14.9244 k = 0.0000 0.2985 0.2223 ( 8170 PWs) bands (ev): 1.8031 1.8031 1.8031 1.8031 2.3215 2.3215 2.3215 2.3215 5.8864 5.8864 5.8864 5.8864 6.2634 6.2634 6.2634 6.2634 6.8738 6.8738 6.8738 6.8738 7.3307 7.3307 7.3307 7.3307 7.4061 7.4061 7.4061 7.4061 8.0010 8.0010 8.0010 8.0010 8.6237 8.6237 8.6237 8.6237 8.8076 8.8076 8.8076 8.8076 9.0541 9.0541 9.0541 9.0541 9.5449 9.5449 9.5449 9.5449 9.9996 9.9996 9.9996 9.9996 10.2333 10.2333 10.2333 10.2333 10.6775 10.6775 10.6775 10.6775 11.2208 11.2208 11.2208 11.2208 12.1697 12.1697 12.1697 12.1697 12.4108 12.4108 12.4108 12.4108 12.5558 12.5558 12.5558 12.5558 13.9946 13.9946 13.9946 13.9946 14.2182 14.2182 14.2182 14.2182 14.9238 14.9238 k = 0.0000 0.2985 0.2346 ( 8186 PWs) bands (ev): 1.8158 1.8158 1.8158 1.8158 2.3057 2.3057 2.3057 2.3057 5.8988 5.8988 5.8988 5.8988 6.2506 6.2506 6.2506 6.2506 6.8752 6.8752 6.8752 6.8752 7.3409 7.3409 7.3409 7.3409 7.3958 7.3958 7.3958 7.3958 8.0035 8.0035 8.0035 8.0035 8.6552 8.6552 8.6552 8.6552 8.7883 8.7883 8.7883 8.7883 9.0381 9.0381 9.0381 9.0381 9.5412 9.5412 9.5412 9.5412 10.0286 10.0286 10.0286 10.0286 10.2222 10.2222 10.2222 10.2222 10.6514 10.6514 10.6514 10.6514 11.2355 11.2355 11.2355 11.2355 12.1842 12.1842 12.1842 12.1842 12.4085 12.4085 12.4085 12.4085 12.5417 12.5417 12.5417 12.5417 13.9816 13.9816 13.9816 13.9816 14.2354 14.2354 14.2354 14.2354 14.9249 14.9249 k = 0.0000 0.2985 0.2470 ( 8172 PWs) bands (ev): 1.8239 1.8239 1.8239 1.8239 2.2957 2.2957 2.2957 2.2957 5.9068 5.9068 5.9068 5.9068 6.2425 6.2425 6.2425 6.2425 6.8760 6.8760 6.8760 6.8760 7.3498 7.3498 7.3498 7.3498 7.3868 7.3868 7.3868 7.3868 8.0049 8.0049 8.0049 8.0049 8.6838 8.6838 8.6838 8.6838 8.7672 8.7672 8.7672 8.7672 9.0282 9.0282 9.0282 9.0282 9.5389 9.5389 9.5389 9.5389 10.0494 10.0494 10.0494 10.0494 10.2131 10.2131 10.2131 10.2131 10.6348 10.6348 10.6348 10.6348 11.2446 11.2446 11.2446 11.2446 12.1934 12.1934 12.1934 12.1934 12.4077 12.4077 12.4077 12.4077 12.5323 12.5323 12.5323 12.5323 13.9737 13.9737 13.9737 13.9737 14.2458 14.2458 14.2458 14.2458 14.9270 14.9271 k = 0.0000 0.2985 0.2593 ( 8196 PWs) bands (ev): 1.8267 1.8267 1.8267 1.8267 2.2923 2.2923 2.2923 2.2923 5.9096 5.9096 5.9096 5.9096 6.2397 6.2397 6.2397 6.2397 6.8763 6.8763 6.8763 6.8763 7.3541 7.3541 7.3541 7.3541 7.3825 7.3825 7.3825 7.3825 8.0054 8.0054 8.0054 8.0054 8.6987 8.6987 8.6987 8.6987 8.7548 8.7548 8.7548 8.7548 9.0248 9.0248 9.0248 9.0248 9.5381 9.5381 9.5381 9.5381 10.0573 10.0573 10.0573 10.0573 10.2093 10.2093 10.2093 10.2093 10.6291 10.6291 10.6291 10.6291 11.2477 11.2477 11.2477 11.2477 12.1965 12.1965 12.1965 12.1965 12.4075 12.4075 12.4075 12.4075 12.5290 12.5290 12.5290 12.5290 13.9710 13.9710 13.9710 13.9710 14.2493 14.2493 14.2493 14.2493 14.9281 14.9284 k = 0.5000-0.0000 0.2593 ( 8116 PWs) bands (ev): 2.6155 2.6155 2.6155 2.6155 2.8230 2.8230 2.8230 2.8230 5.7323 5.7323 5.7323 5.7323 6.6332 6.6332 6.6332 6.6332 7.0755 7.0755 7.0755 7.0755 7.2985 7.2985 7.2985 7.2985 7.8695 7.8695 7.8695 7.8695 7.9377 7.9377 7.9377 7.9377 8.1367 8.1367 8.1367 8.1367 8.8986 8.8986 8.8986 8.8986 9.2719 9.2719 9.2719 9.2719 9.3905 9.3905 9.3905 9.3905 9.6099 9.6099 9.6099 9.6099 9.8411 9.8411 9.8411 9.8411 10.2380 10.2380 10.2380 10.2380 10.4486 10.4486 10.4486 10.4486 10.9518 10.9518 10.9518 10.9518 11.6712 11.6712 11.6712 11.6712 13.0297 13.0297 13.0297 13.0297 13.6407 13.6407 13.6407 13.6407 14.5100 14.5100 14.5100 14.5100 14.8007 14.8007 k = 0.5000-0.0000 0.2470 ( 8126 PWs) bands (ev): 2.6148 2.6148 2.6155 2.6155 2.8224 2.8224 2.8236 2.8236 5.7331 5.7331 5.7340 5.7340 6.6284 6.6284 6.6362 6.6362 7.0653 7.0653 7.0856 7.0856 7.2877 7.2877 7.3115 7.3115 7.8617 7.8617 7.8779 7.8779 7.9362 7.9362 7.9410 7.9410 8.1341 8.1341 8.1398 8.1398 8.8969 8.8969 8.9000 8.9000 9.2699 9.2699 9.2705 9.2705 9.3792 9.3792 9.3985 9.3985 9.6073 9.6073 9.6096 9.6096 9.8402 9.8402 9.8444 9.8444 10.2336 10.2336 10.2421 10.2421 10.4421 10.4421 10.4552 10.4552 10.9458 10.9458 10.9542 10.9542 11.6690 11.6690 11.6789 11.6789 13.0307 13.0307 13.0341 13.0341 13.6409 13.6409 13.6429 13.6429 14.5067 14.5067 14.5104 14.5104 14.7902 14.7905 k = 0.5000-0.0000 0.2346 ( 8122 PWs) bands (ev): 2.6133 2.6133 2.6148 2.6148 2.8220 2.8220 2.8242 2.8242 5.7364 5.7364 5.7380 5.7380 6.6219 6.6219 6.6374 6.6374 7.0554 7.0554 7.0948 7.0948 7.2796 7.2796 7.3261 7.3261 7.8550 7.8550 7.8866 7.8866 7.9365 7.9365 7.9462 7.9462 8.1319 8.1319 8.1436 8.1436 8.8948 8.8948 8.9012 8.9012 9.2647 9.2647 9.2658 9.2658 9.3651 9.3651 9.4029 9.4029 9.6019 9.6019 9.6063 9.6063 9.8418 9.8418 9.8498 9.8498 10.2288 10.2288 10.2458 10.2458 10.4360 10.4360 10.4619 10.4619 10.9367 10.9367 10.9529 10.9529 11.6728 11.6728 11.6918 11.6918 13.0372 13.0372 13.0439 13.0439 13.6433 13.6433 13.6473 13.6473 14.5001 14.5001 14.5079 14.5079 14.7735 14.7735 k = 0.5000-0.0000 0.2223 ( 8122 PWs) bands (ev): 2.6112 2.6112 2.6134 2.6134 2.8216 2.8216 2.8249 2.8249 5.7420 5.7420 5.7444 5.7444 6.6138 6.6138 6.6365 6.6365 7.0464 7.0464 7.1027 7.1027 7.2750 7.2750 7.3418 7.3418 7.8496 7.8496 7.8953 7.8953 7.9382 7.9382 7.9530 7.9530 8.1302 8.1302 8.1481 8.1481 8.8924 8.8924 8.9022 8.9022 9.2560 9.2560 9.2577 9.2577 9.3491 9.3491 9.4039 9.4039 9.5936 9.5936 9.6000 9.6000 9.8461 9.8461 9.8568 9.8568 10.2235 10.2235 10.2491 10.2491 10.4306 10.4306 10.4686 10.4686 10.9248 10.9248 10.9479 10.9479 11.6825 11.6825 11.7092 11.7092 13.0492 13.0492 13.0589 13.0589 13.6480 13.6480 13.6538 13.6538 14.4896 14.4896 14.5025 14.5025 14.7512 14.7512 k = 0.5000-0.0000 0.2099 ( 8130 PWs) bands (ev): 2.6085 2.6085 2.6114 2.6114 2.8213 2.8213 2.8255 2.8255 5.7499 5.7499 5.7532 5.7532 6.6039 6.6039 6.6334 6.6334 7.0387 7.0387 7.1088 7.1088 7.2744 7.2744 7.3583 7.3583 7.8458 7.8458 7.9042 7.9042 7.9412 7.9412 7.9610 7.9610 8.1290 8.1290 8.1534 8.1534 8.8895 8.8895 8.9032 8.9032 9.2435 9.2435 9.2462 9.2462 9.3319 9.3319 9.4018 9.4018 9.5824 9.5824 9.5910 9.5910 9.8529 9.8529 9.8647 9.8647 10.2178 10.2178 10.2521 10.2521 10.4260 10.4260 10.4751 10.4751 10.9107 10.9107 10.9396 10.9396 11.6978 11.6978 11.7305 11.7305 13.0664 13.0664 13.0787 13.0787 13.6547 13.6547 13.6624 13.6624 14.4741 14.4741 14.4938 14.4938 14.7244 14.7245 k = 0.5000-0.0000 0.1976 ( 8122 PWs) bands (ev): 2.6053 2.6053 2.6087 2.6087 2.8211 2.8211 2.8261 2.8261 5.7600 5.7600 5.7642 5.7642 6.5924 6.5924 6.6278 6.6278 7.0328 7.0328 7.1130 7.1130 7.2780 7.2780 7.3753 7.3753 7.8437 7.8437 7.9132 7.9132 7.9451 7.9451 7.9694 7.9694 8.1283 8.1283 8.1599 8.1599 8.8862 8.8862 8.9041 8.9041 9.2270 9.2270 9.2316 9.2316 9.3147 9.3147 9.3971 9.3971 9.5684 9.5684 9.5796 9.5796 9.8620 9.8620 9.8732 9.8732 10.2116 10.2116 10.2546 10.2546 10.4225 10.4225 10.4814 10.4814 10.8950 10.8950 10.9283 10.9283 11.7185 11.7185 11.7552 11.7552 13.0886 13.0886 13.1030 13.1030 13.6632 13.6632 13.6727 13.6727 14.4525 14.4525 14.4812 14.4812 14.6952 14.6952 k = 0.5000-0.0000 0.1852 ( 8128 PWs) bands (ev): 2.6016 2.6016 2.6054 2.6054 2.8210 2.8210 2.8266 2.8266 5.7723 5.7723 5.7773 5.7773 6.5791 6.5791 6.6194 6.6194 7.0289 7.0289 7.1157 7.1157 7.2856 7.2856 7.3926 7.3926 7.8434 7.8434 7.9224 7.9224 7.9500 7.9500 7.9776 7.9776 8.1282 8.1282 8.1675 8.1675 8.8825 8.8825 8.9051 8.9051 9.2066 9.2066 9.2140 9.2140 9.2979 9.2979 9.3900 9.3900 9.5516 9.5516 9.5662 9.5662 9.8731 9.8731 9.8817 9.8817 10.2049 10.2049 10.2566 10.2566 10.4204 10.4204 10.4876 10.4876 10.8782 10.8782 10.9146 10.9146 11.7438 11.7438 11.7825 11.7825 13.1155 13.1155 13.1315 13.1315 13.6732 13.6732 13.6846 13.6846 14.4236 14.4236 14.4637 14.4637 14.6656 14.6656 k = 0.5000-0.0000 0.1729 ( 8124 PWs) bands (ev): 2.5977 2.5977 2.6017 2.6017 2.8210 2.8210 2.8271 2.8271 5.7865 5.7865 5.7925 5.7925 6.5642 6.5642 6.6083 6.6083 7.0272 7.0272 7.1173 7.1173 7.2967 7.2967 7.4101 7.4101 7.8446 7.8446 7.9318 7.9318 7.9556 7.9556 7.9854 7.9854 8.1287 8.1287 8.1763 8.1763 8.8783 8.8783 8.9062 8.9062 9.1828 9.1828 9.1940 9.1940 9.2819 9.2819 9.3808 9.3808 9.5325 9.5325 9.5513 9.5513 9.8859 9.8859 9.8898 9.8898 10.1978 10.1978 10.2578 10.2578 10.4200 10.4200 10.4935 10.4935 10.8609 10.8609 10.8992 10.8992 11.7732 11.7732 11.8120 11.8120 13.1465 13.1465 13.1636 13.1636 13.6843 13.6843 13.6977 13.6977 14.3872 14.3872 14.4401 14.4401 14.6376 14.6376 k = 0.5000-0.0000 0.1605 ( 8120 PWs) bands (ev): 2.5935 2.5935 2.5977 2.5977 2.8210 2.8210 2.8274 2.8274 5.8026 5.8026 5.8095 5.8095 6.5475 6.5475 6.5944 6.5944 7.0278 7.0278 7.1185 7.1185 7.3105 7.3105 7.4275 7.4275 7.8471 7.8471 7.9409 7.9409 7.9620 7.9620 7.9926 7.9926 8.1298 8.1298 8.1860 8.1860 8.8737 8.8737 8.9073 8.9073 9.1566 9.1566 9.1721 9.1721 9.2663 9.2663 9.3694 9.3694 9.5118 9.5118 9.5354 9.5354 9.8973 9.8973 9.8997 9.8997 10.1901 10.1901 10.2578 10.2578 10.4214 10.4214 10.4991 10.4991 10.8434 10.8434 10.8827 10.8827 11.8058 11.8058 11.8431 11.8431 13.1813 13.1813 13.1989 13.1989 13.6961 13.6961 13.7117 13.7117 14.3441 14.3441 14.4093 14.4093 14.6115 14.6115 k = 0.5000-0.0000 0.1482 ( 8124 PWs) bands (ev): 2.5891 2.5891 2.5934 2.5934 2.8211 2.8211 2.8277 2.8277 5.8203 5.8203 5.8282 5.8282 6.5292 6.5292 6.5778 6.5778 7.0307 7.0307 7.1196 7.1196 7.3265 7.3265 7.4448 7.4448 7.8505 7.8505 7.9490 7.9490 7.9692 7.9692 7.9999 7.9999 8.1317 8.1317 8.1963 8.1963 8.8685 8.8685 8.9085 8.9085 9.1291 9.1291 9.1489 9.1489 9.2509 9.2509 9.3555 9.3555 9.4905 9.4905 9.5189 9.5189 9.9043 9.9043 9.9142 9.9142 10.1821 10.1821 10.2566 10.2566 10.4248 10.4248 10.5044 10.5044 10.8262 10.8262 10.8656 10.8656 11.8409 11.8409 11.8754 11.8754 13.2192 13.2192 13.2369 13.2369 13.7080 13.7080 13.7261 13.7261 14.2964 14.2964 14.3710 14.3710 14.5869 14.5869 k = 0.5000-0.0000 0.1358 ( 8130 PWs) bands (ev): 2.5847 2.5847 2.5890 2.5890 2.8212 2.8212 2.8278 2.8278 5.8395 5.8395 5.8485 5.8485 6.5095 6.5095 6.5588 6.5588 7.0357 7.0357 7.1211 7.1211 7.3441 7.3441 7.4617 7.4617 7.8546 7.8546 7.9552 7.9552 7.9773 7.9773 8.0081 8.0081 8.1342 8.1342 8.2068 8.2068 8.8627 8.8627 8.9096 8.9096 9.1016 9.1016 9.1252 9.1252 9.2356 9.2356 9.3384 9.3384 9.4697 9.4697 9.5021 9.5021 9.9107 9.9107 9.9288 9.9288 10.1739 10.1739 10.2540 10.2540 10.4302 10.4302 10.5093 10.5093 10.8096 10.8096 10.8484 10.8484 11.8777 11.8777 11.9084 11.9084 13.2596 13.2596 13.2772 13.2772 13.7194 13.7194 13.7406 13.7406 14.2464 14.2464 14.3259 14.3259 14.5624 14.5630 k = 0.5000-0.0000 0.1235 ( 8134 PWs) bands (ev): 2.5803 2.5803 2.5845 2.5845 2.8213 2.8213 2.8278 2.8278 5.8600 5.8600 5.8700 5.8700 6.4886 6.4886 6.5377 6.5377 7.0424 7.0424 7.1230 7.1230 7.3627 7.3627 7.4781 7.4781 7.8589 7.8589 7.9587 7.9587 7.9866 7.9866 8.0179 8.0179 8.1373 8.1373 8.2169 8.2169 8.8561 8.8561 8.9102 8.9102 9.0753 9.0753 9.1018 9.1018 9.2201 9.2201 9.3179 9.3179 9.4507 9.4507 9.4856 9.4856 9.9167 9.9167 9.9431 9.9431 10.1656 10.1656 10.2499 10.2499 10.4372 10.4372 10.5138 10.5138 10.7940 10.7940 10.8315 10.8315 11.9154 11.9154 11.9416 11.9416 13.3019 13.3019 13.3190 13.3190 13.7295 13.7295 13.7545 13.7545 14.1966 14.1966 14.2762 14.2762 14.5270 14.5347 k = 0.5000-0.0000 0.1111 ( 8138 PWs) bands (ev): 2.5761 2.5761 2.5801 2.5801 2.8215 2.8215 2.8277 2.8277 5.8815 5.8815 5.8925 5.8925 6.4667 6.4667 6.5148 6.5148 7.0506 7.0506 7.1253 7.1253 7.3821 7.3821 7.4935 7.4935 7.8633 7.8633 7.9594 7.9594 7.9971 7.9971 8.0293 8.0293 8.1410 8.1410 8.2261 8.2261 8.8485 8.8485 8.9099 8.9099 9.0516 9.0516 9.0796 9.0796 9.2043 9.2043 9.2940 9.2940 9.4343 9.4343 9.4696 9.4696 9.9224 9.9224 9.9566 9.9566 10.1578 10.1578 10.2445 10.2445 10.4456 10.4456 10.5177 10.5177 10.7796 10.7796 10.8152 10.8152 11.9533 11.9533 11.9746 11.9746 13.3453 13.3453 13.3618 13.3618 13.7375 13.7375 13.7674 13.7674 14.1491 14.1491 14.2243 14.2243 14.4985 14.5009 k = 0.5000-0.0000 0.0988 ( 8132 PWs) bands (ev): 2.5722 2.5722 2.5759 2.5759 2.8217 2.8217 2.8275 2.8275 5.9037 5.9037 5.9157 5.9157 6.4442 6.4442 6.4905 6.4905 7.0598 7.0598 7.1279 7.1279 7.4018 7.4018 7.5076 7.5076 7.8676 7.8676 7.9576 7.9576 8.0089 8.0089 8.0417 8.0417 8.1453 8.1453 8.2338 8.2338 8.8396 8.8396 8.9078 8.9078 9.0317 9.0317 9.0599 9.0599 9.1884 9.1884 9.2672 9.2672 9.4205 9.4205 9.4545 9.4545 9.9280 9.9280 9.9687 9.9687 10.1507 10.1507 10.2378 10.2378 10.4548 10.4548 10.5211 10.5211 10.7667 10.7667 10.7999 10.7999 11.9904 11.9904 12.0069 12.0069 13.3890 13.3890 13.4048 13.4048 13.7426 13.7426 13.7784 13.7784 14.1061 14.1061 14.1730 14.1730 14.4725 14.4775 k = 0.5000-0.0000 0.0864 ( 8144 PWs) bands (ev): 2.5685 2.5685 2.5719 2.5719 2.8219 2.8219 2.8272 2.8272 5.9265 5.9265 5.9393 5.9393 6.4216 6.4216 6.4654 6.4654 7.0696 7.0696 7.1304 7.1304 7.4214 7.4214 7.5200 7.5200 7.8718 7.8718 7.9541 7.9541 8.0216 8.0216 8.0544 8.0544 8.1501 8.1501 8.2395 8.2395 8.8295 8.8295 8.9031 8.9031 9.0169 9.0169 9.0439 9.0439 9.1723 9.1723 9.2386 9.2386 9.4092 9.4092 9.4404 9.4404 9.9336 9.9336 9.9788 9.9788 10.1449 10.1449 10.2301 10.2301 10.4646 10.4646 10.5238 10.5238 10.7553 10.7553 10.7858 10.7858 12.0259 12.0259 12.0379 12.0379 13.4320 13.4320 13.4472 13.4472 13.7442 13.7442 13.7867 13.7867 14.0693 14.0693 14.1246 14.1246 14.4457 14.4606 k = 0.5000-0.0000 0.0741 ( 8146 PWs) bands (ev): 2.5652 2.5652 2.5682 2.5682 2.8222 2.8222 2.8269 2.8269 5.9493 5.9493 5.9627 5.9627 6.3992 6.3992 6.4400 6.4400 7.0798 7.0798 7.1327 7.1327 7.4408 7.4408 7.5303 7.5303 7.8762 7.8762 7.9492 7.9492 8.0352 8.0352 8.0667 8.0667 8.1555 8.1555 8.2428 8.2428 8.8190 8.8190 8.8946 8.8946 9.0074 9.0074 9.0329 9.0329 9.1563 9.1563 9.2093 9.2093 9.4002 9.4002 9.4276 9.4276 9.9393 9.9393 9.9865 9.9865 10.1410 10.1410 10.2217 10.2217 10.4744 10.4744 10.5257 10.5257 10.7457 10.7457 10.7729 10.7729 12.0590 12.0590 12.0670 12.0670 13.4733 13.4733 13.4881 13.4881 13.7421 13.7421 13.7914 13.7914 14.0398 14.0398 14.0813 14.0813 14.4209 14.4284 k = 0.5000-0.0000 0.0617 ( 8146 PWs) bands (ev): 2.5624 2.5624 2.5649 2.5649 2.8224 2.8224 2.8265 2.8265 5.9717 5.9717 5.9853 5.9853 6.3779 6.3779 6.4147 6.4147 7.0898 7.0898 7.1345 7.1345 7.4595 7.4595 7.5380 7.5380 7.8807 7.8807 7.9434 7.9434 8.0490 8.0490 8.0779 8.0779 8.1617 8.1617 8.2433 8.2433 8.8091 8.8091 8.8824 8.8824 9.0034 9.0034 9.0274 9.0274 9.1405 9.1405 9.1803 9.1803 9.3931 9.3931 9.4162 9.4162 9.9452 9.9452 9.9913 9.9913 10.1395 10.1395 10.2127 10.2127 10.4839 10.4839 10.5269 10.5269 10.7378 10.7378 10.7614 10.7614 12.0889 12.0889 12.0935 12.0935 13.5117 13.5117 13.5261 13.5261 13.7372 13.7372 13.7916 13.7916 14.0178 14.0178 14.0454 14.0454 14.3978 14.4006 k = 0.5000-0.0000 0.0494 ( 8150 PWs) bands (ev): 2.5600 2.5600 2.5621 2.5621 2.8227 2.8227 2.8261 2.8261 5.9930 5.9930 6.0062 6.0062 6.3584 6.3584 6.3905 6.3905 7.0994 7.0994 7.1356 7.1356 7.4772 7.4772 7.5428 7.5428 7.8856 7.8856 7.9371 7.9371 8.0625 8.0625 8.0872 8.0872 8.1688 8.1688 8.2410 8.2410 8.8011 8.8011 8.8673 8.8673 9.0043 9.0043 9.0268 9.0268 9.1251 9.1251 9.1526 9.1526 9.3878 9.3878 9.4063 9.4063 9.9515 9.9515 9.9930 9.9930 10.1407 10.1407 10.2033 10.2033 10.4928 10.4928 10.5272 10.5272 10.7319 10.7319 10.7514 10.7514 12.1145 12.1145 12.1167 12.1167 13.5457 13.5457 13.5597 13.5597 13.7315 13.7315 13.7868 13.7868 14.0024 14.0024 14.0180 14.0180 14.3780 14.3817 k = 0.5000-0.0000 0.0370 ( 8150 PWs) bands (ev): 2.5582 2.5582 2.5598 2.5598 2.8231 2.8231 2.8256 2.8256 6.0125 6.0125 6.0242 6.0242 6.3420 6.3420 6.3681 6.3681 7.1083 7.1083 7.1356 7.1356 7.4936 7.4936 7.5446 7.5446 7.8910 7.8910 7.9303 7.9303 8.0749 8.0749 8.0943 8.0943 8.1769 8.1769 8.2358 8.2358 8.7964 8.7964 8.8508 8.8508 9.0093 9.0093 9.0297 9.0297 9.1105 9.1105 9.1270 9.1270 9.3841 9.3841 9.3981 9.3981 9.9579 9.9579 9.9920 9.9920 10.1443 10.1443 10.1937 10.1937 10.5008 10.5008 10.5265 10.5265 10.7279 10.7279 10.7430 10.7430 12.1353 12.1353 12.1359 12.1359 13.5742 13.5742 13.5870 13.5870 13.7275 13.7275 13.7778 13.7778 13.9922 13.9922 13.9994 13.9994 14.3581 14.3625 k = 0.5000-0.0000 0.0247 ( 8146 PWs) bands (ev): 2.5570 2.5570 2.5580 2.5580 2.8234 2.8234 2.8251 2.8251 6.0289 6.0289 6.0380 6.0380 6.3301 6.3301 6.3489 6.3489 7.1161 7.1161 7.1345 7.1345 7.5082 7.5082 7.5431 7.5431 7.8969 7.8969 7.9234 7.9234 8.0854 8.0854 8.0987 8.0987 8.1863 8.1863 8.2281 8.2281 8.7958 8.7958 8.8344 8.8344 9.0177 9.0177 9.0345 9.0345 9.0973 9.0973 9.1047 9.1047 9.3822 9.3822 9.3915 9.3915 9.9646 9.9646 9.9886 9.9886 10.1500 10.1500 10.1841 10.1841 10.5079 10.5079 10.5249 10.5249 10.7259 10.7259 10.7361 10.7361 12.1503 12.1503 12.1505 12.1505 13.5958 13.5958 13.6059 13.6059 13.7278 13.7278 13.7662 13.7662 13.9858 13.9858 13.9882 13.9882 14.3452 14.3473 k = 0.5000-0.0000 0.0123 ( 8136 PWs) bands (ev): 2.5563 2.5563 2.5568 2.5568 2.8238 2.8238 2.8247 2.8247 6.0408 6.0408 6.0459 6.0459 6.3244 6.3244 6.3342 6.3342 7.1228 7.1228 7.1320 7.1320 7.5208 7.5208 7.5386 7.5386 7.9031 7.9031 7.9165 7.9165 8.0934 8.0934 8.1001 8.1001 8.1967 8.1967 8.2185 8.2185 8.7996 8.7996 8.8197 8.8197 9.0278 9.0278 9.0385 9.0385 9.0866 9.0866 9.0880 9.0880 9.3820 9.3820 9.3866 9.3866 9.9713 9.9713 9.9837 9.9837 10.1573 10.1573 10.1747 10.1747 10.5138 10.5138 10.5223 10.5223 10.7257 10.7257 10.7309 10.7309 12.1594 12.1594 12.1597 12.1597 13.6100 13.6100 13.6156 13.6156 13.7332 13.7332 13.7540 13.7540 13.9822 13.9822 13.9826 13.9826 14.3369 14.3390 k = 0.5000-0.0000-0.0000 ( 8140 PWs) bands (ev): 2.5563 2.5563 2.5563 2.5563 2.8242 2.8242 2.8242 2.8242 6.0468 6.0468 6.0468 6.0468 6.3257 6.3257 6.3257 6.3257 7.1281 7.1281 7.1281 7.1281 7.5310 7.5310 7.5310 7.5310 7.9097 7.9097 7.9097 7.9097 8.0983 8.0983 8.0983 8.0983 8.2077 8.2077 8.2077 8.2077 8.8078 8.8078 8.8078 8.8078 9.0366 9.0366 9.0366 9.0366 9.0817 9.0817 9.0817 9.0817 9.3834 9.3834 9.3834 9.3834 9.9778 9.9778 9.9778 9.9778 10.1656 10.1656 10.1656 10.1656 10.5186 10.5186 10.5186 10.5186 10.7274 10.7274 10.7274 10.7274 12.1626 12.1626 12.1626 12.1626 13.6167 13.6167 13.6167 13.6167 13.7426 13.7426 13.7426 13.7426 13.9810 13.9810 13.9810 13.9810 14.3344 14.3344 k = 0.5000 0.2985-0.0000 ( 8160 PWs) bands (ev): 2.7059 2.7059 2.7059 2.7059 2.7233 2.7233 2.7233 2.7233 5.9744 5.9744 5.9744 5.9744 6.0663 6.0663 6.0663 6.0663 7.4753 7.4753 7.4753 7.4753 7.4847 7.4847 7.4847 7.4847 7.9589 7.9589 7.9589 7.9589 7.9726 7.9726 7.9726 7.9726 8.5242 8.5242 8.5242 8.5242 8.6315 8.6315 8.6315 8.6315 8.9977 8.9977 8.9977 8.9977 9.1128 9.1128 9.1128 9.1128 9.5612 9.5612 9.5612 9.5612 9.7805 9.7805 9.7805 9.7805 10.0362 10.0362 10.0362 10.0362 10.0815 10.0815 10.0815 10.0815 11.4862 11.4862 11.4862 11.4862 11.4923 11.4923 11.4923 11.4923 13.5283 13.5283 13.5283 13.5283 13.5772 13.5772 13.5772 13.5772 14.6070 14.6070 14.6070 14.6071 14.6421 14.6421 k = 0.5000 0.2985 0.0123 ( 8156 PWs) bands (ev): 2.7058 2.7058 2.7064 2.7064 2.7230 2.7230 2.7238 2.7238 5.9729 5.9729 5.9767 5.9767 6.0661 6.0661 6.0669 6.0669 7.4610 7.4610 7.4815 7.4815 7.4861 7.4861 7.4874 7.4874 7.9514 7.9514 7.9567 7.9567 7.9591 7.9591 7.9904 7.9904 8.5018 8.5018 8.5488 8.5488 8.6259 8.6259 8.6375 8.6375 8.9801 8.9801 9.0159 9.0159 9.1084 9.1084 9.1146 9.1146 9.5621 9.5621 9.5629 9.5629 9.7715 9.7715 9.7855 9.7855 10.0265 10.0265 10.0500 10.0500 10.0810 10.0810 10.0890 10.0890 11.4844 11.4844 11.4901 11.4901 11.4908 11.4908 11.4957 11.4957 13.5255 13.5255 13.5284 13.5284 13.5752 13.5752 13.5763 13.5763 14.6068 14.6068 14.6073 14.6073 14.6403 14.6429 k = 0.5000 0.2985 0.0247 ( 8144 PWs) bands (ev): 2.7059 2.7059 2.7071 2.7071 2.7229 2.7229 2.7245 2.7245 5.9724 5.9724 5.9799 5.9799 6.0664 6.0664 6.0680 6.0680 7.4447 7.4447 7.4767 7.4767 7.4857 7.4857 7.4970 7.4970 7.9278 7.9278 7.9528 7.9528 7.9573 7.9573 8.0039 8.0039 8.4827 8.4827 8.5748 8.5748 8.6203 8.6203 8.6440 8.6440 8.9637 8.9637 9.0343 9.0343 9.1016 9.1016 9.1137 9.1137 9.5656 9.5656 9.5669 9.5669 9.7587 9.7587 9.7868 9.7868 10.0211 10.0211 10.0677 10.0677 10.0874 10.0874 10.1031 10.1031 11.4848 11.4848 11.4912 11.4912 11.4961 11.4961 11.5009 11.5009 13.5200 13.5200 13.5258 13.5258 13.5702 13.5702 13.5724 13.5724 14.6066 14.6066 14.6076 14.6076 14.6384 14.6389 k = 0.5000 0.2985 0.0370 ( 8140 PWs) bands (ev): 2.7063 2.7063 2.7081 2.7081 2.7229 2.7229 2.7253 2.7253 5.9727 5.9727 5.9839 5.9839 6.0672 6.0672 6.0696 6.0696 7.4269 7.4269 7.4706 7.4706 7.4831 7.4831 7.5040 7.5040 7.9027 7.9027 7.9473 7.9473 7.9535 7.9535 8.0121 8.0121 8.4676 8.4676 8.6014 8.6014 8.6146 8.6146 8.6511 8.6511 8.9489 8.9489 9.0524 9.0524 9.0927 9.0927 9.1106 9.1106 9.5711 9.5711 9.5729 9.5729 9.7431 9.7431 9.7851 9.7851 10.0203 10.0203 10.0889 10.0889 10.0998 10.0998 10.1229 10.1229 11.4873 11.4873 11.4935 11.4935 11.5040 11.5040 11.5079 11.5079 13.5120 13.5120 13.5206 13.5206 13.5625 13.5625 13.5656 13.5656 14.6065 14.6065 14.6080 14.6080 14.6366 14.6367 k = 0.5000 0.2985 0.0494 ( 8132 PWs) bands (ev): 2.7069 2.7069 2.7093 2.7093 2.7231 2.7231 2.7263 2.7263 5.9739 5.9739 5.9887 5.9887 6.0683 6.0683 6.0716 6.0716 7.4077 7.4077 7.4633 7.4633 7.4783 7.4783 7.5083 7.5083 7.8770 7.8770 7.9404 7.9404 7.9476 7.9476 8.0146 8.0146 8.4573 8.4573 8.6085 8.6085 8.6278 8.6278 8.6588 8.6588 8.9363 8.9363 9.0699 9.0699 9.0823 9.0823 9.1059 9.1059 9.5782 9.5782 9.5798 9.5798 9.7256 9.7256 9.7812 9.7812 10.0243 10.0243 10.1133 10.1133 10.1172 10.1172 10.1471 10.1471 11.4919 11.4919 11.4977 11.4977 11.5138 11.5138 11.5165 11.5165 13.5015 13.5015 13.5128 13.5128 13.5522 13.5522 13.5560 13.5560 14.6066 14.6066 14.6085 14.6085 14.6350 14.6352 k = 0.5000 0.2985 0.0617 ( 8140 PWs) bands (ev): 2.7078 2.7078 2.7108 2.7108 2.7235 2.7235 2.7275 2.7275 5.9759 5.9759 5.9943 5.9943 6.0697 6.0697 6.0741 6.0741 7.3875 7.3875 7.4549 7.4549 7.4710 7.4710 7.5099 7.5099 7.8515 7.8515 7.9323 7.9323 7.9398 7.9398 8.0113 8.0113 8.4517 8.4517 8.6019 8.6019 8.6534 8.6534 8.6673 8.6673 8.9260 8.9260 9.0711 9.0711 9.0864 9.0864 9.1001 9.1001 9.5864 9.5864 9.5870 9.5870 9.7071 9.7071 9.7761 9.7761 10.0333 10.0333 10.1386 10.1386 10.1406 10.1406 10.1747 10.1747 11.4985 11.4985 11.5037 11.5037 11.5251 11.5251 11.5265 11.5265 13.4887 13.4887 13.5027 13.5027 13.5394 13.5394 13.5438 13.5438 14.6071 14.6071 14.6091 14.6091 14.6336 14.6336 k = 0.5000 0.2985 0.0741 ( 8148 PWs) bands (ev): 2.7089 2.7089 2.7125 2.7125 2.7241 2.7241 2.7287 2.7287 5.9787 5.9787 6.0006 6.0006 6.0713 6.0713 6.0770 6.0770 7.3666 7.3666 7.4457 7.4457 7.4611 7.4611 7.5088 7.5088 7.8271 7.8271 7.9232 7.9232 7.9301 7.9301 8.0028 8.0028 8.4505 8.4505 8.5947 8.5947 8.6763 8.6763 8.6778 8.6778 8.9183 8.9183 9.0595 9.0595 9.0941 9.0941 9.1018 9.1018 9.5934 9.5934 9.5950 9.5950 9.6884 9.6884 9.7702 9.7702 10.0473 10.0473 10.1629 10.1629 10.1704 10.1704 10.2046 10.2046 11.5069 11.5069 11.5113 11.5113 11.5378 11.5378 11.5378 11.5378 13.4740 13.4740 13.4903 13.4903 13.5244 13.5244 13.5292 13.5292 14.6079 14.6079 14.6100 14.6100 14.6326 14.6326 k = 0.5000 0.2985 0.0864 ( 8148 PWs) bands (ev): 2.7102 2.7102 2.7144 2.7144 2.7247 2.7247 2.7301 2.7301 5.9822 5.9822 6.0075 6.0075 6.0732 6.0732 6.0802 6.0802 7.3455 7.3455 7.4359 7.4359 7.4484 7.4484 7.5051 7.5051 7.8043 7.8043 7.9133 7.9133 7.9189 7.9189 7.9899 7.9899 8.4529 8.4529 8.5872 8.5872 8.6858 8.6858 8.7004 8.7004 8.9131 8.9131 9.0480 9.0480 9.0885 9.0885 9.1157 9.1157 9.5987 9.5987 9.6037 9.6037 9.6701 9.6701 9.7641 9.7641 10.0661 10.0661 10.1893 10.1893 10.2022 10.2022 10.2361 10.2361 11.5169 11.5169 11.5205 11.5205 11.5500 11.5500 11.5515 11.5515 13.4575 13.4575 13.4761 13.4761 13.5076 13.5076 13.5124 13.5124 14.6094 14.6094 14.6113 14.6113 14.6320 14.6320 k = 0.5000 0.2985 0.0988 ( 8152 PWs) bands (ev): 2.7117 2.7117 2.7165 2.7165 2.7255 2.7255 2.7315 2.7315 5.9864 5.9864 6.0150 6.0150 6.0751 6.0751 6.0837 6.0837 7.3244 7.3244 7.4256 7.4256 7.4332 7.4332 7.4991 7.4991 7.7837 7.7837 7.9027 7.9027 7.9063 7.9063 7.9738 7.9738 8.4580 8.4580 8.5794 8.5794 8.6956 8.6956 8.7209 8.7209 8.9104 8.9104 9.0370 9.0370 9.0839 9.0839 9.1281 9.1281 9.6023 9.6023 9.6122 9.6122 9.6527 9.6527 9.7579 9.7579 10.0891 10.0891 10.2170 10.2170 10.2355 10.2355 10.2683 10.2683 11.5283 11.5283 11.5310 11.5310 11.5630 11.5630 11.5660 11.5660 13.4397 13.4397 13.4603 13.4603 13.4892 13.4892 13.4937 13.4937 14.6114 14.6114 14.6129 14.6129 14.6320 14.6320 k = 0.5000 0.2985 0.1111 ( 8160 PWs) bands (ev): 2.7133 2.7133 2.7186 2.7186 2.7263 2.7263 2.7329 2.7329 5.9913 5.9913 6.0230 6.0230 6.0770 6.0770 6.0873 6.0873 7.3037 7.3037 7.4152 7.4152 7.4154 7.4154 7.4911 7.4911 7.7656 7.7656 7.8917 7.8917 7.8926 7.8926 7.9557 7.9557 8.4647 8.4647 8.5716 8.5716 8.7056 8.7056 8.7390 8.7390 8.9098 8.9098 9.0268 9.0268 9.0807 9.0807 9.1388 9.1388 9.6042 9.6042 9.6204 9.6204 9.6364 9.6364 9.7518 9.7518 10.1157 10.1157 10.2452 10.2452 10.2698 10.2698 10.3009 10.3009 11.5407 11.5407 11.5427 11.5427 11.5764 11.5764 11.5808 11.5808 13.4210 13.4210 13.4433 13.4433 13.4696 13.4696 13.4736 13.4736 14.6143 14.6143 14.6151 14.6151 14.6325 14.6325 k = 0.5000 0.2985 0.1235 ( 8172 PWs) bands (ev): 2.7150 2.7150 2.7209 2.7209 2.7271 2.7271 2.7344 2.7344 5.9968 5.9968 6.0313 6.0313 6.0788 6.0788 6.0911 6.0911 7.2837 7.2837 7.3955 7.3955 7.4048 7.4048 7.4813 7.4813 7.7502 7.7502 7.8781 7.8781 7.8804 7.8804 7.9364 7.9364 8.4722 8.4722 8.5641 8.5641 8.7156 8.7156 8.7546 8.7546 8.9109 8.9109 9.0175 9.0175 9.0793 9.0793 9.1478 9.1478 9.6045 9.6045 9.6216 9.6216 9.6282 9.6282 9.7459 9.7459 10.1451 10.1451 10.2735 10.2735 10.3043 10.3043 10.3331 10.3331 11.5540 11.5540 11.5553 11.5553 11.5900 11.5900 11.5957 11.5957 13.4016 13.4016 13.4253 13.4253 13.4492 13.4492 13.4525 13.4525 14.6178 14.6178 14.6179 14.6179 14.6337 14.6337 k = 0.5000 0.2985 0.1358 ( 8160 PWs) bands (ev): 2.7168 2.7168 2.7232 2.7232 2.7280 2.7280 2.7357 2.7357 6.0027 6.0027 6.0399 6.0399 6.0805 6.0805 6.0949 6.0949 7.2647 7.2647 7.3741 7.3741 7.3948 7.3948 7.4701 7.4701 7.7375 7.7375 7.8630 7.8630 7.8690 7.8690 7.9170 7.9170 8.4799 8.4799 8.5571 8.5571 8.7254 8.7254 8.7675 8.7675 8.9136 8.9136 9.0091 9.0091 9.0797 9.0797 9.1550 9.1550 9.6034 9.6034 9.6084 9.6084 9.6354 9.6354 9.7403 9.7403 10.1764 10.1764 10.3010 10.3010 10.3385 10.3385 10.3646 10.3646 11.5677 11.5677 11.5685 11.5685 11.6035 11.6035 11.6104 11.6104 13.3822 13.3822 13.4070 13.4070 13.4285 13.4285 13.4307 13.4307 14.6210 14.6210 14.6224 14.6224 14.6355 14.6355 k = 0.5000 0.2985 0.1482 ( 8156 PWs) bands (ev): 2.7186 2.7186 2.7255 2.7255 2.7289 2.7289 2.7371 2.7371 6.0091 6.0091 6.0485 6.0485 6.0818 6.0818 6.0986 6.0986 7.2471 7.2471 7.3515 7.3515 7.3853 7.3853 7.4580 7.4580 7.7275 7.7275 7.8475 7.8475 7.8577 7.8577 7.8980 7.8980 8.4873 8.4873 8.5507 8.5507 8.7350 8.7350 8.7780 8.7780 8.9173 8.9173 9.0018 9.0018 9.0820 9.0820 9.1604 9.1604 9.5970 9.5970 9.6012 9.6012 9.6422 9.6422 9.7348 9.7348 10.2088 10.2088 10.3272 10.3272 10.3717 10.3717 10.3948 10.3948 11.5817 11.5817 11.5822 11.5822 11.6164 11.6164 11.6243 11.6243 13.3631 13.3631 13.3887 13.3887 13.4079 13.4079 13.4088 13.4088 14.6248 14.6248 14.6278 14.6278 14.6379 14.6379 k = 0.5000 0.2985 0.1605 ( 8168 PWs) bands (ev): 2.7205 2.7205 2.7278 2.7278 2.7297 2.7297 2.7383 2.7383 6.0157 6.0157 6.0572 6.0572 6.0827 6.0827 6.1021 6.1021 7.2312 7.2312 7.3285 7.3285 7.3766 7.3766 7.4452 7.4452 7.7199 7.7199 7.8320 7.8320 7.8468 7.8468 7.8800 7.8800 8.4941 8.4941 8.5450 8.5450 8.7442 8.7442 8.7860 8.7860 8.9218 8.9218 8.9954 8.9954 9.0860 9.0860 9.1641 9.1641 9.5873 9.5873 9.5980 9.5980 9.6486 9.6486 9.7295 9.7295 10.2413 10.2413 10.3515 10.3515 10.4034 10.4034 10.4234 10.4234 11.5955 11.5955 11.5959 11.5959 11.6285 11.6285 11.6372 11.6372 13.3448 13.3448 13.3708 13.3708 13.3871 13.3871 13.3878 13.3878 14.6290 14.6290 14.6339 14.6339 14.6407 14.6407 k = 0.5000 0.2985 0.1729 ( 8172 PWs) bands (ev): 2.7222 2.7222 2.7300 2.7300 2.7304 2.7304 2.7393 2.7393 6.0226 6.0226 6.0656 6.0656 6.0831 6.0831 6.1053 6.1053 7.2173 7.2173 7.3058 7.3058 7.3691 7.3691 7.4322 7.4322 7.7146 7.7146 7.8167 7.8167 7.8366 7.8366 7.8633 7.8633 8.5001 8.5001 8.5402 8.5402 8.7529 8.7529 8.7920 8.7920 8.9268 8.9268 8.9898 8.9898 9.0914 9.0914 9.1661 9.1661 9.5795 9.5795 9.5942 9.5942 9.6545 9.6545 9.7243 9.7243 10.2733 10.2733 10.3734 10.3734 10.4330 10.4330 10.4498 10.4498 11.6088 11.6088 11.6094 11.6094 11.6395 11.6395 11.6488 11.6488 13.3278 13.3278 13.3538 13.3538 13.3662 13.3662 13.3687 13.3687 14.6336 14.6336 14.6406 14.6406 14.6438 14.6438 k = 0.5000 0.2985 0.1852 ( 8176 PWs) bands (ev): 2.7239 2.7239 2.7310 2.7310 2.7321 2.7321 2.7402 2.7402 6.0295 6.0295 6.0738 6.0738 6.0829 6.0829 6.1080 6.1080 7.2055 7.2055 7.2838 7.2838 7.3628 7.3628 7.4193 7.4193 7.7114 7.7114 7.8018 7.8018 7.8272 7.8272 7.8484 7.8484 8.5052 8.5052 8.5360 8.5360 8.7609 8.7609 8.7961 8.7961 8.9321 8.9321 8.9850 8.9850 9.0979 9.0979 9.1666 9.1666 9.5734 9.5734 9.5901 9.5901 9.6602 9.6602 9.7193 9.7193 10.3038 10.3038 10.3924 10.3924 10.4599 10.4599 10.4737 10.4737 11.6215 11.6215 11.6225 11.6225 11.6492 11.6492 11.6588 11.6588 13.3125 13.3125 13.3382 13.3382 13.3466 13.3466 13.3509 13.3509 14.6383 14.6383 14.6471 14.6471 14.6478 14.6478 k = 0.5000 0.2985 0.1976 ( 8176 PWs) bands (ev): 2.7255 2.7255 2.7314 2.7314 2.7340 2.7340 2.7409 2.7409 6.0364 6.0364 6.0814 6.0814 6.0820 6.0820 6.1101 6.1101 7.1963 7.1963 7.2631 7.2631 7.3580 7.3580 7.4068 7.4068 7.7103 7.7103 7.7875 7.7875 7.8189 7.8189 7.8353 7.8353 8.5095 8.5095 8.5326 8.5326 8.7684 8.7684 8.7986 8.7986 8.9374 8.9374 8.9807 8.9807 9.1051 9.1051 9.1655 9.1655 9.5690 9.5690 9.5857 9.5857 9.6656 9.6656 9.7144 9.7144 10.3322 10.3322 10.4080 10.4080 10.4837 10.4837 10.4947 10.4947 11.6331 11.6331 11.6348 11.6348 11.6573 11.6573 11.6670 11.6670 13.2993 13.2993 13.3244 13.3244 13.3286 13.3286 13.3350 13.3350 14.6429 14.6429 14.6504 14.6504 14.6552 14.6552 k = 0.5000 0.2985 0.2099 ( 8192 PWs) bands (ev): 2.7270 2.7270 2.7317 2.7317 2.7358 2.7358 2.7413 2.7413 6.0432 6.0432 6.0804 6.0804 6.0884 6.0884 6.1114 6.1114 7.1897 7.1897 7.2442 7.2442 7.3549 7.3549 7.3951 7.3951 7.7110 7.7110 7.7740 7.7740 7.8120 7.8120 7.8242 7.8242 8.5131 8.5131 8.5298 8.5298 8.7750 8.7750 8.7997 8.7997 8.9427 8.9427 8.9767 8.9767 9.1128 9.1128 9.1631 9.1631 9.5661 9.5661 9.5813 9.5813 9.6708 9.6708 9.7096 9.7096 10.3579 10.3579 10.4199 10.4199 10.5039 10.5039 10.5123 10.5123 11.6435 11.6435 11.6461 11.6461 11.6636 11.6636 11.6731 11.6731 13.2886 13.2886 13.3126 13.3126 13.3127 13.3127 13.3212 13.3212 14.6473 14.6473 14.6533 14.6533 14.6626 14.6626 k = 0.5000 0.2985 0.2223 ( 8188 PWs) bands (ev): 2.7282 2.7282 2.7318 2.7318 2.7374 2.7374 2.7416 2.7416 6.0498 6.0498 6.0781 6.0781 6.0947 6.0947 6.1120 6.1120 7.1860 7.1860 7.2275 7.2275 7.3536 7.3536 7.3844 7.3844 7.7135 7.7135 7.7615 7.7615 7.8067 7.8067 7.8153 7.8153 8.5160 8.5160 8.5275 8.5275 8.7810 8.7810 8.7998 8.7998 8.9478 8.9478 8.9729 8.9729 9.1206 9.1206 9.1594 9.1594 9.5647 9.5647 9.5771 9.5771 9.6759 9.6759 9.7048 9.7048 10.3804 10.3804 10.4276 10.4276 10.5202 10.5202 10.5262 10.5262 11.6525 11.6525 11.6560 11.6560 11.6680 11.6680 11.6771 11.6771 13.2807 13.2807 13.2991 13.2991 13.3035 13.3035 13.3099 13.3099 14.6512 14.6512 14.6557 14.6557 14.6697 14.6697 k = 0.5000 0.2985 0.2346 ( 8192 PWs) bands (ev): 2.7294 2.7294 2.7318 2.7318 2.7387 2.7387 2.7415 2.7415 6.0559 6.0559 6.0751 6.0751 6.1001 6.1001 6.1116 6.1116 7.1853 7.1853 7.2132 7.2132 7.3542 7.3542 7.3751 7.3751 7.7178 7.7178 7.7501 7.7501 7.8031 7.8031 7.8086 7.8086 8.5183 8.5183 8.5255 8.5255 8.7862 8.7862 8.7988 8.7988 8.9526 8.9526 8.9692 8.9692 9.1283 9.1283 9.1547 9.1547 9.5645 9.5645 9.5733 9.5733 9.6808 9.6808 9.7000 9.7000 10.3991 10.3991 10.4309 10.4309 10.5322 10.5322 10.5361 10.5361 11.6598 11.6598 11.6644 11.6644 11.6704 11.6704 11.6788 11.6788 13.2759 13.2759 13.2883 13.2883 13.2971 13.2971 13.3013 13.3013 14.6544 14.6544 14.6574 14.6574 14.6761 14.6762 k = 0.5000 0.2985 0.2470 ( 8188 PWs) bands (ev): 2.7303 2.7303 2.7315 2.7315 2.7398 2.7398 2.7412 2.7412 6.0616 6.0616 6.0713 6.0713 6.1045 6.1045 6.1103 6.1103 7.1877 7.1877 7.2018 7.2018 7.3567 7.3567 7.3672 7.3672 7.7236 7.7236 7.7399 7.7399 7.8013 7.8013 7.8040 7.8040 8.5203 8.5203 8.5237 8.5237 8.7905 8.7905 8.7969 8.7969 8.9572 8.9572 8.9654 8.9654 9.1358 9.1358 9.1491 9.1491 9.5654 9.5654 9.5700 9.5700 9.6857 9.6857 9.6952 9.6952 10.4137 10.4137 10.4298 10.4298 10.5399 10.5399 10.5418 10.5418 11.6653 11.6653 11.6707 11.6707 11.6710 11.6710 11.6784 11.6784 13.2742 13.2742 13.2804 13.2804 13.2935 13.2935 13.2957 13.2957 14.6567 14.6567 14.6582 14.6582 14.6816 14.6820 k = 0.5000 0.2985 0.2593 ( 8192 PWs) bands (ev): 2.7310 2.7310 2.7310 2.7310 2.7407 2.7407 2.7407 2.7407 6.0668 6.0668 6.0668 6.0668 6.1079 6.1079 6.1079 6.1079 7.1932 7.1932 7.1932 7.1932 7.3610 7.3610 7.3610 7.3610 7.7310 7.7310 7.7310 7.7310 7.8016 7.8016 7.8016 7.8016 8.5221 8.5221 8.5221 8.5221 8.7941 8.7941 8.7941 8.7941 8.9614 8.9614 8.9614 8.9614 9.1428 9.1428 9.1428 9.1428 9.5673 9.5673 9.5673 9.5673 9.6905 9.6905 9.6905 9.6905 10.4240 10.4240 10.4240 10.4240 10.5431 10.5431 10.5431 10.5431 11.6690 11.6690 11.6690 11.6690 11.6757 11.6757 11.6757 11.6757 13.2757 13.2757 13.2757 13.2757 13.2931 13.2931 13.2931 13.2931 14.6580 14.6580 14.6580 14.6580 14.6859 14.6859 Writing output data file ZrGePt.save init_run : 0.34s CPU 0.52s WALL ( 1 calls) electrons : 1233.85s CPU 1245.30s WALL ( 1 calls) Called by init_run: wfcinit : 0.00s CPU 0.01s WALL ( 1 calls) potinit : 0.04s CPU 0.08s WALL ( 1 calls) Called by electrons: c_bands : 1233.83s CPU 1245.28s WALL ( 1 calls) v_of_rho : 0.01s CPU 0.01s WALL ( 1 calls) v_h : 0.00s CPU 0.00s WALL ( 1 calls) v_xc : 0.00s CPU 0.01s WALL ( 1 calls) newd : 0.07s CPU 0.11s WALL ( 1 calls) Called by c_bands: init_us_2 : 0.10s CPU 0.11s WALL ( 352 calls) cegterg : 1174.48s CPU 1184.70s WALL ( 1537 calls) Called by sum_band: Called by *egterg: h_psi : 487.16s CPU 497.12s WALL ( 29895 calls) s_psi : 100.48s CPU 100.14s WALL ( 29895 calls) g_psi : 1.01s CPU 0.89s WALL ( 28006 calls) cdiaghg : 516.93s CPU 518.26s WALL ( 28358 calls) cegterg:over : 48.79s CPU 49.10s WALL ( 28006 calls) cegterg:upda : 36.79s CPU 36.64s WALL ( 28006 calls) cegterg:last : 16.38s CPU 16.48s WALL ( 2945 calls) cdiaghg:chol : 21.99s CPU 22.16s WALL ( 28358 calls) cdiaghg:inve : 16.05s CPU 16.27s WALL ( 28358 calls) cdiaghg:para : 30.82s CPU 30.78s WALL ( 56716 calls) Called by h_psi: h_psi:vloc : 402.62s CPU 411.91s WALL ( 29895 calls) h_psi:vnl : 83.53s CPU 84.12s WALL ( 29895 calls) add_vuspsi : 41.93s CPU 42.20s WALL ( 29895 calls) General routines calbec : 41.48s CPU 41.83s WALL ( 29895 calls) fft : 0.03s CPU 0.03s WALL ( 19 calls) ffts : 0.00s CPU 0.00s WALL ( 4 calls) fftw : 381.21s CPU 390.35s WALL ( 3100152 calls) interpolate : 0.00s CPU 0.00s WALL ( 4 calls) davcio : 0.30s CPU 0.37s WALL ( 704 calls) Parallel routines fft_scatter : 267.70s CPU 275.24s WALL ( 3100175 calls) PWSCF : 21m30.92s CPU 22m 7.48s WALL This run was terminated on: 21:57:34 31Jan2017 =------------------------------------------------------------------------------= JOB DONE. =------------------------------------------------------------------------------=