Program PWSCF v.5.1.1 starts on 30Oct2015 at 0: 4: 3 This program is part of the open-source Quantum ESPRESSO suite for quantum simulation of materials; please cite "P. Giannozzi et al., J. Phys.:Condens. Matter 21 395502 (2009); URL http://www.quantum-espresso.org", in publications or presentations arising from this work. More details at http://www.quantum-espresso.org/quote Parallel version (MPI), running on 48 processors R & G space division: proc/nbgrp/npool/nimage = 48 Waiting for input... Reading input from standard input Current dimensions of program PWSCF are: Max number of different atomic species (ntypx) = 10 Max number of k-points (npk) = 40000 Max angular momentum in pseudopotentials (lmaxx) = 3 Atomic positions and unit cell read from directory: ./NbCu3S4.save/ file Nb.rel-pbe-spn-rrkjus_psl.1.0.0.UPF: wavefunction(s) 4S 4P 4P renormalized file Cu.rel-pbe-dn-rrkjus_psl.1.0.0.UPF: wavefunction(s) 3D renormalized Subspace diagonalization in iterative solution of the eigenvalue problem: a serial algorithm will be used Parallelization info -------------------- sticks: dense smooth PW G-vecs: dense smooth PW Min 48 35 10 1764 1071 168 Max 49 36 11 1771 1093 173 Sum 2337 1685 489 84823 51867 8121 bravais-lattice index = 14 lattice parameter (alat) = 10.4865 a.u. unit-cell volume = 1153.1549 (a.u.)^3 number of atoms/cell = 8 number of atomic types = 3 number of electrons = 70.00 number of Kohn-Sham states= 84 kinetic-energy cutoff = 48.0000 Ry charge density cutoff = 267.0000 Ry Exchange-correlation = PBE ( 1 4 3 4 0 0) Non magnetic calculation with spin-orbit celldm(1)= 10.486467 celldm(2)= 1.000000 celldm(3)= 1.000000 celldm(4)= 0.000000 celldm(5)= 0.000000 celldm(6)= 0.000000 crystal axes: (cart. coord. in units of alat) a(1) = ( 1.000000 0.000000 0.000000 ) a(2) = ( 0.000000 1.000000 0.000000 ) a(3) = ( 0.000000 0.000000 1.000000 ) reciprocal axes: (cart. coord. in units 2 pi/alat) b(1) = ( 1.000000 -0.000000 -0.000000 ) b(2) = ( 0.000000 1.000000 -0.000000 ) b(3) = ( 0.000000 0.000000 1.000000 ) PseudoPot. # 1 for S read from file: /home/autes/Pseudo/S.rel-pbe-n-rrkjus_psl.1.0.0.UPF MD5 check sum: 95f1324244b600346090892298cb4451 Pseudo is Ultrasoft + core correction, Zval = 6.0 Generated using "atomic" code by A. Dal Corso v.5.0.2 svn rev. 9656 Using radial grid of 1151 points, 10 beta functions with: l(1) = 0 l(2) = 0 l(3) = 1 l(4) = 1 l(5) = 1 l(6) = 1 l(7) = 2 l(8) = 2 l(9) = 2 l(10) = 2 Q(r) pseudized with 0 coefficients PseudoPot. # 2 for Nb read from file: /home/autes/Pseudo/Nb.rel-pbe-spn-rrkjus_psl.1.0.0.UPF MD5 check sum: c1e153ab096482f446ae869583c6ae55 Pseudo is Ultrasoft + core correction, Zval = 13.0 Generated using "atomic" code by A. Dal Corso v.5.0.2 svn rev. 9656 Using radial grid of 1227 points, 10 beta functions with: l(1) = 0 l(2) = 0 l(3) = 1 l(4) = 1 l(5) = 1 l(6) = 1 l(7) = 2 l(8) = 2 l(9) = 2 l(10) = 2 Q(r) pseudized with 0 coefficients PseudoPot. # 3 for Cu read from file: /home/autes/Pseudo/Cu.rel-pbe-dn-rrkjus_psl.1.0.0.UPF MD5 check sum: bfb9b73be46f5385f72b338ff57911ad Pseudo is Ultrasoft + core correction, Zval = 11.0 Generated using "atomic" code by A. Dal Corso v.5.0.2 svn rev. 9656 Using radial grid of 1199 points, 10 beta functions with: l(1) = 0 l(2) = 0 l(3) = 1 l(4) = 1 l(5) = 1 l(6) = 1 l(7) = 2 l(8) = 2 l(9) = 2 l(10) = 2 Q(r) pseudized with 0 coefficients atomic species valence mass pseudopotential S 6.00 32.06500 S( 1.00) Nb 13.00 92.90640 Nb( 1.00) Cu 11.00 63.54600 Cu( 1.00) 24 Sym. Ops. (no inversion) found 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 ) ( 0 -1 0 ) ( 0 0 1 ) cart. s( 2) = ( -1.0000000 0.0000000 0.0000000 ) ( 0.0000000 -1.0000000 0.0000000 ) ( 0.0000000 0.0000000 1.0000000 ) isym = 3 180 deg rotation - cart. axis [0,1,0] cryst. s( 3) = ( -1 0 0 ) ( 0 1 0 ) ( 0 0 -1 ) cart. s( 3) = ( -1.0000000 0.0000000 -0.0000000 ) ( 0.0000000 1.0000000 -0.0000000 ) ( 0.0000000 0.0000000 -1.0000000 ) isym = 4 180 deg rotation - cart. axis [1,0,0] cryst. s( 4) = ( 1 0 0 ) ( 0 -1 0 ) ( 0 0 -1 ) cart. s( 4) = ( 1.0000000 -0.0000000 -0.0000000 ) ( 0.0000000 -1.0000000 0.0000000 ) ( 0.0000000 0.0000000 -1.0000000 ) isym = 5 120 deg rotation - cart. axis [-1,-1,-1] cryst. s( 5) = ( 0 0 1 ) ( 1 0 0 ) ( 0 1 0 ) cart. s( 5) = ( 0.0000000 1.0000000 -0.0000000 ) ( 0.0000000 -0.0000000 1.0000000 ) ( 1.0000000 -0.0000000 -0.0000000 ) isym = 6 120 deg rotation - cart. axis [-1,1,1] cryst. s( 6) = ( 0 0 -1 ) ( -1 0 0 ) ( 0 1 0 ) cart. s( 6) = ( -0.0000000 -1.0000000 0.0000000 ) ( -0.0000000 0.0000000 1.0000000 ) ( -1.0000000 0.0000000 0.0000000 ) isym = 7 120 deg rotation - cart. axis [1,1,-1] cryst. s( 7) = ( 0 0 -1 ) ( 1 0 0 ) ( 0 -1 0 ) cart. s( 7) = ( -0.0000000 1.0000000 -0.0000000 ) ( -0.0000000 0.0000000 -1.0000000 ) ( -1.0000000 0.0000000 0.0000000 ) isym = 8 120 deg rotation - cart. axis [1,-1,1] cryst. s( 8) = ( 0 0 1 ) ( -1 0 0 ) ( 0 -1 0 ) cart. s( 8) = ( 0.0000000 -1.0000000 -0.0000000 ) ( 0.0000000 -0.0000000 -1.0000000 ) ( 1.0000000 -0.0000000 -0.0000000 ) isym = 9 120 deg rotation - cart. axis [1,1,1] cryst. s( 9) = ( 0 1 0 ) ( 0 0 1 ) ( 1 0 0 ) cart. s( 9) = ( 0.0000000 0.0000000 1.0000000 ) ( 1.0000000 0.0000000 -0.0000000 ) ( 0.0000000 1.0000000 -0.0000000 ) isym = 10 120 deg rotation - cart. axis [-1,1,-1] cryst. s(10) = ( 0 -1 0 ) ( 0 0 -1 ) ( 1 0 0 ) cart. s(10) = ( -0.0000000 -0.0000000 1.0000000 ) ( -1.0000000 0.0000000 0.0000000 ) ( 0.0000000 -1.0000000 0.0000000 ) isym = 11 120 deg rotation - cart. axis [1,-1,-1] cryst. s(11) = ( 0 -1 0 ) ( 0 0 1 ) ( -1 0 0 ) cart. s(11) = ( -0.0000000 0.0000000 -1.0000000 ) ( -1.0000000 0.0000000 0.0000000 ) ( 0.0000000 1.0000000 -0.0000000 ) isym = 12 120 deg rotation - cart. axis [-1,-1,1] cryst. s(12) = ( 0 1 0 ) ( 0 0 -1 ) ( -1 0 0 ) cart. s(12) = ( 0.0000000 -0.0000000 -1.0000000 ) ( 1.0000000 -0.0000000 -0.0000000 ) ( 0.0000000 -1.0000000 0.0000000 ) isym = 13 inv. 180 deg rotation - cart. axis [1,1,0] cryst. s(13) = ( 0 -1 0 ) ( -1 0 0 ) ( 0 0 1 ) cart. s(13) = ( -0.0000000 -1.0000000 0.0000000 ) ( -1.0000000 0.0000000 0.0000000 ) ( 0.0000000 0.0000000 1.0000000 ) isym = 14 inv. 180 deg rotation - cart. axis [1,-1,0] cryst. s(14) = ( 0 1 0 ) ( 1 0 0 ) ( 0 0 1 ) cart. s(14) = ( 0.0000000 1.0000000 -0.0000000 ) ( 1.0000000 -0.0000000 0.0000000 ) ( 0.0000000 0.0000000 1.0000000 ) isym = 15 inv. 90 deg rotation - cart. axis [0,0,-1] cryst. s(15) = ( 0 1 0 ) ( -1 0 0 ) ( 0 0 -1 ) cart. s(15) = ( 0.0000000 -1.0000000 -0.0000000 ) ( 1.0000000 -0.0000000 -0.0000000 ) ( 0.0000000 0.0000000 -1.0000000 ) isym = 16 inv. 90 deg rotation - cart. axis [0,0,1] cryst. s(16) = ( 0 -1 0 ) ( 1 0 0 ) ( 0 0 -1 ) cart. s(16) = ( -0.0000000 1.0000000 -0.0000000 ) ( -1.0000000 0.0000000 -0.0000000 ) ( 0.0000000 0.0000000 -1.0000000 ) isym = 17 inv. 180 deg rotation - cart. axis [1,0,1] cryst. s(17) = ( 0 0 -1 ) ( 0 1 0 ) ( -1 0 0 ) cart. s(17) = ( -0.0000000 0.0000000 -1.0000000 ) ( -0.0000000 1.0000000 -0.0000000 ) ( -1.0000000 0.0000000 0.0000000 ) isym = 18 inv. 180 deg rotation - cart. axis [-1,0,1] cryst. s(18) = ( 0 0 1 ) ( 0 1 0 ) ( 1 0 0 ) cart. s(18) = ( 0.0000000 0.0000000 1.0000000 ) ( 0.0000000 1.0000000 -0.0000000 ) ( 1.0000000 -0.0000000 -0.0000000 ) isym = 19 inv. 90 deg rotation - cart. axis [0,1,0] cryst. s(19) = ( 0 0 1 ) ( 0 -1 0 ) ( -1 0 0 ) cart. s(19) = ( 0.0000000 -0.0000000 -1.0000000 ) ( 0.0000000 -1.0000000 0.0000000 ) ( 1.0000000 -0.0000000 -0.0000000 ) isym = 20 inv. 90 deg rotation - cart. axis [0,-1,0] cryst. s(20) = ( 0 0 -1 ) ( 0 -1 0 ) ( 1 0 0 ) cart. s(20) = ( -0.0000000 -0.0000000 1.0000000 ) ( -0.0000000 -1.0000000 0.0000000 ) ( -1.0000000 0.0000000 0.0000000 ) isym = 21 inv. 180 deg rotation - cart. axis [0,1,1] cryst. s(21) = ( 1 0 0 ) ( 0 0 -1 ) ( 0 -1 0 ) cart. s(21) = ( 1.0000000 -0.0000000 -0.0000000 ) ( 0.0000000 -0.0000000 -1.0000000 ) ( 0.0000000 -1.0000000 0.0000000 ) isym = 22 inv. 180 deg rotation - cart. axis [0,1,-1] cryst. s(22) = ( 1 0 0 ) ( 0 0 1 ) ( 0 1 0 ) cart. s(22) = ( 1.0000000 0.0000000 0.0000000 ) ( 0.0000000 0.0000000 1.0000000 ) ( 0.0000000 1.0000000 -0.0000000 ) isym = 23 inv. 90 deg rotation - cart. axis [-1,0,0] cryst. s(23) = ( -1 0 0 ) ( 0 0 1 ) ( 0 -1 0 ) cart. s(23) = ( -1.0000000 0.0000000 -0.0000000 ) ( 0.0000000 0.0000000 -1.0000000 ) ( 0.0000000 1.0000000 -0.0000000 ) isym = 24 inv. 90 deg rotation - cart. axis [1,0,0] cryst. s(24) = ( -1 0 0 ) ( 0 0 -1 ) ( 0 1 0 ) cart. s(24) = ( -1.0000000 0.0000000 0.0000000 ) ( 0.0000000 -0.0000000 1.0000000 ) ( 0.0000000 -1.0000000 0.0000000 ) double point group T_d (-43m) there are 8 classes and 3 irreducible representations the character table: E -E 8C3 -8C3 3C2 6s_d 6S4 -6S4 -3C2 -6s_d G_6 2.00 -2.00 1.00 -1.00 0.00 0.00 1.41 -1.41 G_7 2.00 -2.00 1.00 -1.00 0.00 0.00 -1.41 1.41 G_8 4.00 -4.00 -1.00 1.00 0.00 0.00 0.00 0.00 the symmetry operations in each class: E 1 3C2 -3C2 2 -2 3 -3 4 -4 8C3 5 7 8 6 12 9 10 11 6s_d -6s_d 13 -13 14 -14 17 -17 18 -18 21 -21 22 -22 6S4 15 16 20 19 23 24 -E -1 -8C3 -5 -7 -8 -6 -12 -9 -10 -11 -6S4 -15 -16 -20 -19 -23 -24 Cartesian axes number of k points= 225 Fermi-Dirac smearing, width (Ry)= 0.0010 cart. coord. in units 2pi/alat k( 1) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0044444 k( 2) = ( 0.0000000 0.0172414 -0.0000000), wk = 0.0044444 k( 3) = ( 0.0000000 0.0344828 -0.0000000), wk = 0.0044444 k( 4) = ( 0.0000000 0.0517241 -0.0000000), wk = 0.0044444 k( 5) = ( 0.0000000 0.0689655 -0.0000000), wk = 0.0044444 k( 6) = ( 0.0000000 0.0862069 -0.0000000), wk = 0.0044444 k( 7) = ( 0.0000000 0.1034483 -0.0000000), wk = 0.0044444 k( 8) = ( 0.0000000 0.1206897 -0.0000000), wk = 0.0044444 k( 9) = ( 0.0000000 0.1379310 -0.0000000), wk = 0.0044444 k( 10) = ( 0.0000000 0.1551724 -0.0000000), wk = 0.0044444 k( 11) = ( 0.0000000 0.1724138 -0.0000000), wk = 0.0044444 k( 12) = ( 0.0000000 0.1896552 -0.0000000), wk = 0.0044444 k( 13) = ( 0.0000000 0.2068966 -0.0000000), wk = 0.0044444 k( 14) = ( 0.0000000 0.2241379 -0.0000000), wk = 0.0044444 k( 15) = ( 0.0000000 0.2413793 -0.0000000), wk = 0.0044444 k( 16) = ( 0.0000000 0.2586207 -0.0000000), wk = 0.0044444 k( 17) = ( 0.0000000 0.2758621 -0.0000000), wk = 0.0044444 k( 18) = ( 0.0000000 0.2931034 -0.0000000), wk = 0.0044444 k( 19) = ( 0.0000000 0.3103448 -0.0000000), wk = 0.0044444 k( 20) = ( 0.0000000 0.3275862 -0.0000000), wk = 0.0044444 k( 21) = ( 0.0000000 0.3448276 -0.0000000), wk = 0.0044444 k( 22) = ( 0.0000000 0.3620690 -0.0000000), wk = 0.0044444 k( 23) = ( 0.0000000 0.3793103 -0.0000000), wk = 0.0044444 k( 24) = ( 0.0000000 0.3965517 -0.0000000), wk = 0.0044444 k( 25) = ( 0.0000000 0.4137931 -0.0000000), wk = 0.0044444 k( 26) = ( 0.0000000 0.4310345 -0.0000000), wk = 0.0044444 k( 27) = ( 0.0000000 0.4482759 -0.0000000), wk = 0.0044444 k( 28) = ( 0.0000000 0.4655172 -0.0000000), wk = 0.0044444 k( 29) = ( 0.0000000 0.4827586 -0.0000000), wk = 0.0044444 k( 30) = ( 0.0000000 0.5000000 -0.0000000), wk = 0.0044444 k( 31) = ( 0.0000000 0.5000000 -0.0000000), wk = 0.0044444 k( 32) = ( 0.0172414 0.5000000 -0.0000000), wk = 0.0044444 k( 33) = ( 0.0344828 0.5000000 -0.0000000), wk = 0.0044444 k( 34) = ( 0.0517241 0.5000000 -0.0000000), wk = 0.0044444 k( 35) = ( 0.0689655 0.5000000 -0.0000000), wk = 0.0044444 k( 36) = ( 0.0862069 0.5000000 -0.0000000), wk = 0.0044444 k( 37) = ( 0.1034483 0.5000000 -0.0000000), wk = 0.0044444 k( 38) = ( 0.1206897 0.5000000 -0.0000000), wk = 0.0044444 k( 39) = ( 0.1379310 0.5000000 -0.0000000), wk = 0.0044444 k( 40) = ( 0.1551724 0.5000000 -0.0000000), wk = 0.0044444 k( 41) = ( 0.1724138 0.5000000 -0.0000000), wk = 0.0044444 k( 42) = ( 0.1896552 0.5000000 -0.0000000), wk = 0.0044444 k( 43) = ( 0.2068966 0.5000000 -0.0000000), wk = 0.0044444 k( 44) = ( 0.2241379 0.5000000 -0.0000000), wk = 0.0044444 k( 45) = ( 0.2413793 0.5000000 -0.0000000), wk = 0.0044444 k( 46) = ( 0.2586207 0.5000000 -0.0000000), wk = 0.0044444 k( 47) = ( 0.2758621 0.5000000 -0.0000000), wk = 0.0044444 k( 48) = ( 0.2931034 0.5000000 -0.0000000), wk = 0.0044444 k( 49) = ( 0.3103448 0.5000000 -0.0000000), wk = 0.0044444 k( 50) = ( 0.3275862 0.5000000 -0.0000000), wk = 0.0044444 k( 51) = ( 0.3448276 0.5000000 -0.0000000), wk = 0.0044444 k( 52) = ( 0.3620690 0.5000000 -0.0000000), wk = 0.0044444 k( 53) = ( 0.3793103 0.5000000 -0.0000000), wk = 0.0044444 k( 54) = ( 0.3965517 0.5000000 -0.0000000), wk = 0.0044444 k( 55) = ( 0.4137931 0.5000000 -0.0000000), wk = 0.0044444 k( 56) = ( 0.4310345 0.5000000 -0.0000000), wk = 0.0044444 k( 57) = ( 0.4482759 0.5000000 -0.0000000), wk = 0.0044444 k( 58) = ( 0.4655172 0.5000000 -0.0000000), wk = 0.0044444 k( 59) = ( 0.4827586 0.5000000 -0.0000000), wk = 0.0044444 k( 60) = ( 0.5000000 0.5000000 -0.0000000), wk = 0.0044444 k( 61) = ( 0.5000000 0.5000000 -0.0000000), wk = 0.0044444 k( 62) = ( 0.4878049 0.4878049 -0.0000000), wk = 0.0044444 k( 63) = ( 0.4756098 0.4756098 -0.0000000), wk = 0.0044444 k( 64) = ( 0.4634146 0.4634146 -0.0000000), wk = 0.0044444 k( 65) = ( 0.4512195 0.4512195 -0.0000000), wk = 0.0044444 k( 66) = ( 0.4390244 0.4390244 -0.0000000), wk = 0.0044444 k( 67) = ( 0.4268293 0.4268293 -0.0000000), wk = 0.0044444 k( 68) = ( 0.4146341 0.4146341 -0.0000000), wk = 0.0044444 k( 69) = ( 0.4024390 0.4024390 -0.0000000), wk = 0.0044444 k( 70) = ( 0.3902439 0.3902439 -0.0000000), wk = 0.0044444 k( 71) = ( 0.3780488 0.3780488 -0.0000000), wk = 0.0044444 k( 72) = ( 0.3658537 0.3658537 -0.0000000), wk = 0.0044444 k( 73) = ( 0.3536585 0.3536585 -0.0000000), wk = 0.0044444 k( 74) = ( 0.3414634 0.3414634 -0.0000000), wk = 0.0044444 k( 75) = ( 0.3292683 0.3292683 -0.0000000), wk = 0.0044444 k( 76) = ( 0.3170732 0.3170732 -0.0000000), wk = 0.0044444 k( 77) = ( 0.3048781 0.3048780 -0.0000000), wk = 0.0044444 k( 78) = ( 0.2926829 0.2926829 -0.0000000), wk = 0.0044444 k( 79) = ( 0.2804878 0.2804878 -0.0000000), wk = 0.0044444 k( 80) = ( 0.2682927 0.2682927 -0.0000000), wk = 0.0044444 k( 81) = ( 0.2560976 0.2560976 -0.0000000), wk = 0.0044444 k( 82) = ( 0.2439024 0.2439024 -0.0000000), wk = 0.0044444 k( 83) = ( 0.2317073 0.2317073 -0.0000000), wk = 0.0044444 k( 84) = ( 0.2195122 0.2195122 -0.0000000), wk = 0.0044444 k( 85) = ( 0.2073171 0.2073171 -0.0000000), wk = 0.0044444 k( 86) = ( 0.1951219 0.1951219 -0.0000000), wk = 0.0044444 k( 87) = ( 0.1829268 0.1829268 -0.0000000), wk = 0.0044444 k( 88) = ( 0.1707317 0.1707317 -0.0000000), wk = 0.0044444 k( 89) = ( 0.1585366 0.1585366 -0.0000000), wk = 0.0044444 k( 90) = ( 0.1463415 0.1463415 -0.0000000), wk = 0.0044444 k( 91) = ( 0.1341463 0.1341463 -0.0000000), wk = 0.0044444 k( 92) = ( 0.1219512 0.1219512 -0.0000000), wk = 0.0044444 k( 93) = ( 0.1097561 0.1097561 -0.0000000), wk = 0.0044444 k( 94) = ( 0.0975610 0.0975610 -0.0000000), wk = 0.0044444 k( 95) = ( 0.0853658 0.0853658 -0.0000000), wk = 0.0044444 k( 96) = ( 0.0731707 0.0731707 -0.0000000), wk = 0.0044444 k( 97) = ( 0.0609756 0.0609756 -0.0000000), wk = 0.0044444 k( 98) = ( 0.0487805 0.0487805 -0.0000000), wk = 0.0044444 k( 99) = ( 0.0365854 0.0365854 -0.0000000), wk = 0.0044444 k( 100) = ( 0.0243902 0.0243902 -0.0000000), wk = 0.0044444 k( 101) = ( 0.0121951 0.0121951 -0.0000000), wk = 0.0044444 k( 102) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0044444 k( 103) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0044444 k( 104) = ( 0.0100000 0.0100000 0.0100000), wk = 0.0044444 k( 105) = ( 0.0200000 0.0200000 0.0200000), wk = 0.0044444 k( 106) = ( 0.0300000 0.0300000 0.0300000), wk = 0.0044444 k( 107) = ( 0.0400000 0.0400000 0.0400000), wk = 0.0044444 k( 108) = ( 0.0500000 0.0500000 0.0500000), wk = 0.0044444 k( 109) = ( 0.0600000 0.0600000 0.0600000), wk = 0.0044444 k( 110) = ( 0.0700000 0.0700000 0.0700000), wk = 0.0044444 k( 111) = ( 0.0800000 0.0800000 0.0800000), wk = 0.0044444 k( 112) = ( 0.0900000 0.0900000 0.0900000), wk = 0.0044444 k( 113) = ( 0.1000000 0.1000000 0.1000000), wk = 0.0044444 k( 114) = ( 0.1100000 0.1100000 0.1100000), wk = 0.0044444 k( 115) = ( 0.1200000 0.1200000 0.1200000), wk = 0.0044444 k( 116) = ( 0.1300000 0.1300000 0.1300000), wk = 0.0044444 k( 117) = ( 0.1400000 0.1400000 0.1400000), wk = 0.0044444 k( 118) = ( 0.1500000 0.1500000 0.1500000), wk = 0.0044444 k( 119) = ( 0.1600000 0.1600000 0.1600000), wk = 0.0044444 k( 120) = ( 0.1700000 0.1700000 0.1700000), wk = 0.0044444 k( 121) = ( 0.1800000 0.1800000 0.1800000), wk = 0.0044444 k( 122) = ( 0.1900000 0.1900000 0.1900000), wk = 0.0044444 k( 123) = ( 0.2000000 0.2000000 0.2000000), wk = 0.0044444 k( 124) = ( 0.2100000 0.2100000 0.2100000), wk = 0.0044444 k( 125) = ( 0.2200000 0.2200000 0.2200000), wk = 0.0044444 k( 126) = ( 0.2300000 0.2300000 0.2300000), wk = 0.0044444 k( 127) = ( 0.2400000 0.2400000 0.2400000), wk = 0.0044444 k( 128) = ( 0.2500000 0.2500000 0.2500000), wk = 0.0044444 k( 129) = ( 0.2600000 0.2600000 0.2600000), wk = 0.0044444 k( 130) = ( 0.2700000 0.2700000 0.2700000), wk = 0.0044444 k( 131) = ( 0.2800000 0.2800000 0.2800000), wk = 0.0044444 k( 132) = ( 0.2900000 0.2900000 0.2900000), wk = 0.0044444 k( 133) = ( 0.3000000 0.3000000 0.3000000), wk = 0.0044444 k( 134) = ( 0.3100000 0.3100000 0.3100000), wk = 0.0044444 k( 135) = ( 0.3200000 0.3200000 0.3200000), wk = 0.0044444 k( 136) = ( 0.3300000 0.3300000 0.3300000), wk = 0.0044444 k( 137) = ( 0.3400000 0.3400000 0.3400000), wk = 0.0044444 k( 138) = ( 0.3500000 0.3500000 0.3500000), wk = 0.0044444 k( 139) = ( 0.3600000 0.3600000 0.3600000), wk = 0.0044444 k( 140) = ( 0.3700000 0.3700000 0.3700000), wk = 0.0044444 k( 141) = ( 0.3800000 0.3800000 0.3800000), wk = 0.0044444 k( 142) = ( 0.3900000 0.3900000 0.3900000), wk = 0.0044444 k( 143) = ( 0.4000000 0.4000000 0.4000000), wk = 0.0044444 k( 144) = ( 0.4100000 0.4100000 0.4100000), wk = 0.0044444 k( 145) = ( 0.4200000 0.4200000 0.4200000), wk = 0.0044444 k( 146) = ( 0.4300000 0.4300000 0.4300000), wk = 0.0044444 k( 147) = ( 0.4400000 0.4400000 0.4400000), wk = 0.0044444 k( 148) = ( 0.4500000 0.4500000 0.4500000), wk = 0.0044444 k( 149) = ( 0.4600000 0.4600000 0.4600000), wk = 0.0044444 k( 150) = ( 0.4700000 0.4700000 0.4700000), wk = 0.0044444 k( 151) = ( 0.4800000 0.4800000 0.4800000), wk = 0.0044444 k( 152) = ( 0.4900000 0.4900000 0.4900000), wk = 0.0044444 k( 153) = ( 0.5000000 0.5000000 0.5000000), wk = 0.0044444 k( 154) = ( 0.5000000 0.5000000 0.5000000), wk = 0.0044444 k( 155) = ( 0.4878049 0.5000000 0.4878049), wk = 0.0044444 k( 156) = ( 0.4756098 0.5000000 0.4756098), wk = 0.0044444 k( 157) = ( 0.4634146 0.5000000 0.4634146), wk = 0.0044444 k( 158) = ( 0.4512195 0.5000000 0.4512195), wk = 0.0044444 k( 159) = ( 0.4390244 0.5000000 0.4390244), wk = 0.0044444 k( 160) = ( 0.4268293 0.5000000 0.4268293), wk = 0.0044444 k( 161) = ( 0.4146341 0.5000000 0.4146341), wk = 0.0044444 k( 162) = ( 0.4024390 0.5000000 0.4024390), wk = 0.0044444 k( 163) = ( 0.3902439 0.5000000 0.3902439), wk = 0.0044444 k( 164) = ( 0.3780488 0.5000000 0.3780488), wk = 0.0044444 k( 165) = ( 0.3658537 0.5000000 0.3658537), wk = 0.0044444 k( 166) = ( 0.3536585 0.5000000 0.3536585), wk = 0.0044444 k( 167) = ( 0.3414634 0.5000000 0.3414634), wk = 0.0044444 k( 168) = ( 0.3292683 0.5000000 0.3292683), wk = 0.0044444 k( 169) = ( 0.3170732 0.5000000 0.3170732), wk = 0.0044444 k( 170) = ( 0.3048781 0.5000000 0.3048780), wk = 0.0044444 k( 171) = ( 0.2926829 0.5000000 0.2926829), wk = 0.0044444 k( 172) = ( 0.2804878 0.5000000 0.2804878), wk = 0.0044444 k( 173) = ( 0.2682927 0.5000000 0.2682927), wk = 0.0044444 k( 174) = ( 0.2560976 0.5000000 0.2560976), wk = 0.0044444 k( 175) = ( 0.2439024 0.5000000 0.2439024), wk = 0.0044444 k( 176) = ( 0.2317073 0.5000000 0.2317073), wk = 0.0044444 k( 177) = ( 0.2195122 0.5000000 0.2195122), wk = 0.0044444 k( 178) = ( 0.2073171 0.5000000 0.2073171), wk = 0.0044444 k( 179) = ( 0.1951219 0.5000000 0.1951219), wk = 0.0044444 k( 180) = ( 0.1829268 0.5000000 0.1829268), wk = 0.0044444 k( 181) = ( 0.1707317 0.5000000 0.1707317), wk = 0.0044444 k( 182) = ( 0.1585366 0.5000000 0.1585366), wk = 0.0044444 k( 183) = ( 0.1463415 0.5000000 0.1463415), wk = 0.0044444 k( 184) = ( 0.1341463 0.5000000 0.1341463), wk = 0.0044444 k( 185) = ( 0.1219512 0.5000000 0.1219512), wk = 0.0044444 k( 186) = ( 0.1097561 0.5000000 0.1097561), wk = 0.0044444 k( 187) = ( 0.0975610 0.5000000 0.0975610), wk = 0.0044444 k( 188) = ( 0.0853658 0.5000000 0.0853658), wk = 0.0044444 k( 189) = ( 0.0731707 0.5000000 0.0731707), wk = 0.0044444 k( 190) = ( 0.0609756 0.5000000 0.0609756), wk = 0.0044444 k( 191) = ( 0.0487805 0.5000000 0.0487805), wk = 0.0044444 k( 192) = ( 0.0365854 0.5000000 0.0365854), wk = 0.0044444 k( 193) = ( 0.0243902 0.5000000 0.0243902), wk = 0.0044444 k( 194) = ( 0.0121951 0.5000000 0.0121951), wk = 0.0044444 k( 195) = ( 0.0000000 0.5000000 -0.0000000), wk = 0.0044444 k( 196) = ( 0.5000000 0.5000000 -0.0000000), wk = 0.0044444 k( 197) = ( 0.5000000 0.5000000 0.0172414), wk = 0.0044444 k( 198) = ( 0.5000000 0.5000000 0.0344828), wk = 0.0044444 k( 199) = ( 0.5000000 0.5000000 0.0517241), wk = 0.0044444 k( 200) = ( 0.5000000 0.5000000 0.0689655), wk = 0.0044444 k( 201) = ( 0.5000000 0.5000000 0.0862069), wk = 0.0044444 k( 202) = ( 0.5000000 0.5000000 0.1034483), wk = 0.0044444 k( 203) = ( 0.5000000 0.5000000 0.1206897), wk = 0.0044444 k( 204) = ( 0.5000000 0.5000000 0.1379310), wk = 0.0044444 k( 205) = ( 0.5000000 0.5000000 0.1551724), wk = 0.0044444 k( 206) = ( 0.5000000 0.5000000 0.1724138), wk = 0.0044444 k( 207) = ( 0.5000000 0.5000000 0.1896552), wk = 0.0044444 k( 208) = ( 0.5000000 0.5000000 0.2068965), wk = 0.0044444 k( 209) = ( 0.5000000 0.5000000 0.2241379), wk = 0.0044444 k( 210) = ( 0.5000000 0.5000000 0.2413793), wk = 0.0044444 k( 211) = ( 0.5000000 0.5000000 0.2586207), wk = 0.0044444 k( 212) = ( 0.5000000 0.5000000 0.2758621), wk = 0.0044444 k( 213) = ( 0.5000000 0.5000000 0.2931034), wk = 0.0044444 k( 214) = ( 0.5000000 0.5000000 0.3103448), wk = 0.0044444 k( 215) = ( 0.5000000 0.5000000 0.3275862), wk = 0.0044444 k( 216) = ( 0.5000000 0.5000000 0.3448276), wk = 0.0044444 k( 217) = ( 0.5000000 0.5000000 0.3620690), wk = 0.0044444 k( 218) = ( 0.5000000 0.5000000 0.3793103), wk = 0.0044444 k( 219) = ( 0.5000000 0.5000000 0.3965517), wk = 0.0044444 k( 220) = ( 0.5000000 0.5000000 0.4137931), wk = 0.0044444 k( 221) = ( 0.5000000 0.5000000 0.4310345), wk = 0.0044444 k( 222) = ( 0.5000000 0.5000000 0.4482759), wk = 0.0044444 k( 223) = ( 0.5000000 0.5000000 0.4655172), wk = 0.0044444 k( 224) = ( 0.5000000 0.5000000 0.4827586), wk = 0.0044444 k( 225) = ( 0.5000000 0.5000000 0.5000000), wk = 0.0044444 cryst. coord. k( 1) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0044444 k( 2) = ( 0.0000000 0.0172414 0.0000000), wk = 0.0044444 k( 3) = ( 0.0000000 0.0344828 0.0000000), wk = 0.0044444 k( 4) = ( 0.0000000 0.0517241 0.0000000), wk = 0.0044444 k( 5) = ( 0.0000000 0.0689655 0.0000000), wk = 0.0044444 k( 6) = ( 0.0000000 0.0862069 0.0000000), wk = 0.0044444 k( 7) = ( 0.0000000 0.1034483 0.0000000), wk = 0.0044444 k( 8) = ( 0.0000000 0.1206897 0.0000000), wk = 0.0044444 k( 9) = ( 0.0000000 0.1379310 0.0000000), wk = 0.0044444 k( 10) = ( 0.0000000 0.1551724 0.0000000), wk = 0.0044444 k( 11) = ( 0.0000000 0.1724138 0.0000000), wk = 0.0044444 k( 12) = ( 0.0000000 0.1896552 0.0000000), wk = 0.0044444 k( 13) = ( 0.0000000 0.2068966 0.0000000), wk = 0.0044444 k( 14) = ( 0.0000000 0.2241379 0.0000000), wk = 0.0044444 k( 15) = ( 0.0000000 0.2413793 0.0000000), wk = 0.0044444 k( 16) = ( 0.0000000 0.2586207 0.0000000), wk = 0.0044444 k( 17) = ( 0.0000000 0.2758621 0.0000000), wk = 0.0044444 k( 18) = ( 0.0000000 0.2931034 0.0000000), wk = 0.0044444 k( 19) = ( 0.0000000 0.3103448 0.0000000), wk = 0.0044444 k( 20) = ( 0.0000000 0.3275862 0.0000000), wk = 0.0044444 k( 21) = ( 0.0000000 0.3448276 0.0000000), wk = 0.0044444 k( 22) = ( 0.0000000 0.3620690 0.0000000), wk = 0.0044444 k( 23) = ( 0.0000000 0.3793103 0.0000000), wk = 0.0044444 k( 24) = ( 0.0000000 0.3965517 0.0000000), wk = 0.0044444 k( 25) = ( 0.0000000 0.4137931 0.0000000), wk = 0.0044444 k( 26) = ( 0.0000000 0.4310345 0.0000000), wk = 0.0044444 k( 27) = ( 0.0000000 0.4482759 0.0000000), wk = 0.0044444 k( 28) = ( 0.0000000 0.4655172 0.0000000), wk = 0.0044444 k( 29) = ( 0.0000000 0.4827586 0.0000000), wk = 0.0044444 k( 30) = ( 0.0000000 0.5000000 0.0000000), wk = 0.0044444 k( 31) = ( 0.0000000 0.5000000 0.0000000), wk = 0.0044444 k( 32) = ( 0.0172414 0.5000000 0.0000000), wk = 0.0044444 k( 33) = ( 0.0344828 0.5000000 0.0000000), wk = 0.0044444 k( 34) = ( 0.0517241 0.5000000 0.0000000), wk = 0.0044444 k( 35) = ( 0.0689655 0.5000000 0.0000000), wk = 0.0044444 k( 36) = ( 0.0862069 0.5000000 0.0000000), wk = 0.0044444 k( 37) = ( 0.1034483 0.5000000 0.0000000), wk = 0.0044444 k( 38) = ( 0.1206897 0.5000000 0.0000000), wk = 0.0044444 k( 39) = ( 0.1379310 0.5000000 0.0000000), wk = 0.0044444 k( 40) = ( 0.1551724 0.5000000 0.0000000), wk = 0.0044444 k( 41) = ( 0.1724138 0.5000000 0.0000000), wk = 0.0044444 k( 42) = ( 0.1896552 0.5000000 0.0000000), wk = 0.0044444 k( 43) = ( 0.2068966 0.5000000 0.0000000), wk = 0.0044444 k( 44) = ( 0.2241379 0.5000000 0.0000000), wk = 0.0044444 k( 45) = ( 0.2413793 0.5000000 0.0000000), wk = 0.0044444 k( 46) = ( 0.2586207 0.5000000 0.0000000), wk = 0.0044444 k( 47) = ( 0.2758621 0.5000000 0.0000000), wk = 0.0044444 k( 48) = ( 0.2931034 0.5000000 0.0000000), wk = 0.0044444 k( 49) = ( 0.3103448 0.5000000 0.0000000), wk = 0.0044444 k( 50) = ( 0.3275862 0.5000000 0.0000000), wk = 0.0044444 k( 51) = ( 0.3448276 0.5000000 0.0000000), wk = 0.0044444 k( 52) = ( 0.3620690 0.5000000 0.0000000), wk = 0.0044444 k( 53) = ( 0.3793103 0.5000000 0.0000000), wk = 0.0044444 k( 54) = ( 0.3965517 0.5000000 0.0000000), wk = 0.0044444 k( 55) = ( 0.4137931 0.5000000 0.0000000), wk = 0.0044444 k( 56) = ( 0.4310345 0.5000000 0.0000000), wk = 0.0044444 k( 57) = ( 0.4482759 0.5000000 0.0000000), wk = 0.0044444 k( 58) = ( 0.4655172 0.5000000 0.0000000), wk = 0.0044444 k( 59) = ( 0.4827586 0.5000000 0.0000000), wk = 0.0044444 k( 60) = ( 0.5000000 0.5000000 0.0000000), wk = 0.0044444 k( 61) = ( 0.5000000 0.5000000 0.0000000), wk = 0.0044444 k( 62) = ( 0.4878049 0.4878049 0.0000000), wk = 0.0044444 k( 63) = ( 0.4756098 0.4756098 0.0000000), wk = 0.0044444 k( 64) = ( 0.4634146 0.4634146 0.0000000), wk = 0.0044444 k( 65) = ( 0.4512195 0.4512195 0.0000000), wk = 0.0044444 k( 66) = ( 0.4390244 0.4390244 0.0000000), wk = 0.0044444 k( 67) = ( 0.4268293 0.4268293 0.0000000), wk = 0.0044444 k( 68) = ( 0.4146341 0.4146341 0.0000000), wk = 0.0044444 k( 69) = ( 0.4024390 0.4024390 0.0000000), wk = 0.0044444 k( 70) = ( 0.3902439 0.3902439 0.0000000), wk = 0.0044444 k( 71) = ( 0.3780488 0.3780488 0.0000000), wk = 0.0044444 k( 72) = ( 0.3658537 0.3658537 0.0000000), wk = 0.0044444 k( 73) = ( 0.3536585 0.3536585 0.0000000), wk = 0.0044444 k( 74) = ( 0.3414634 0.3414634 0.0000000), wk = 0.0044444 k( 75) = ( 0.3292683 0.3292683 0.0000000), wk = 0.0044444 k( 76) = ( 0.3170732 0.3170732 0.0000000), wk = 0.0044444 k( 77) = ( 0.3048781 0.3048781 0.0000000), wk = 0.0044444 k( 78) = ( 0.2926829 0.2926829 -0.0000000), wk = 0.0044444 k( 79) = ( 0.2804878 0.2804878 0.0000000), wk = 0.0044444 k( 80) = ( 0.2682927 0.2682927 0.0000000), wk = 0.0044444 k( 81) = ( 0.2560976 0.2560976 0.0000000), wk = 0.0044444 k( 82) = ( 0.2439024 0.2439024 0.0000000), wk = 0.0044444 k( 83) = ( 0.2317073 0.2317073 0.0000000), wk = 0.0044444 k( 84) = ( 0.2195122 0.2195122 0.0000000), wk = 0.0044444 k( 85) = ( 0.2073171 0.2073171 0.0000000), wk = 0.0044444 k( 86) = ( 0.1951219 0.1951219 0.0000000), wk = 0.0044444 k( 87) = ( 0.1829268 0.1829268 0.0000000), wk = 0.0044444 k( 88) = ( 0.1707317 0.1707317 0.0000000), wk = 0.0044444 k( 89) = ( 0.1585366 0.1585366 -0.0000000), wk = 0.0044444 k( 90) = ( 0.1463415 0.1463415 0.0000000), wk = 0.0044444 k( 91) = ( 0.1341463 0.1341463 0.0000000), wk = 0.0044444 k( 92) = ( 0.1219512 0.1219512 0.0000000), wk = 0.0044444 k( 93) = ( 0.1097561 0.1097561 0.0000000), wk = 0.0044444 k( 94) = ( 0.0975610 0.0975610 0.0000000), wk = 0.0044444 k( 95) = ( 0.0853658 0.0853658 0.0000000), wk = 0.0044444 k( 96) = ( 0.0731707 0.0731707 0.0000000), wk = 0.0044444 k( 97) = ( 0.0609756 0.0609756 0.0000000), wk = 0.0044444 k( 98) = ( 0.0487805 0.0487805 0.0000000), wk = 0.0044444 k( 99) = ( 0.0365854 0.0365854 -0.0000000), wk = 0.0044444 k( 100) = ( 0.0243902 0.0243902 0.0000000), wk = 0.0044444 k( 101) = ( 0.0121951 0.0121951 0.0000000), wk = 0.0044444 k( 102) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0044444 k( 103) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0044444 k( 104) = ( 0.0100000 0.0100000 0.0100000), wk = 0.0044444 k( 105) = ( 0.0200000 0.0200000 0.0200000), wk = 0.0044444 k( 106) = ( 0.0300000 0.0300000 0.0300000), wk = 0.0044444 k( 107) = ( 0.0400000 0.0400000 0.0400000), wk = 0.0044444 k( 108) = ( 0.0500000 0.0500000 0.0500000), wk = 0.0044444 k( 109) = ( 0.0600000 0.0600000 0.0600000), wk = 0.0044444 k( 110) = ( 0.0700000 0.0700000 0.0700000), wk = 0.0044444 k( 111) = ( 0.0800000 0.0800000 0.0800000), wk = 0.0044444 k( 112) = ( 0.0900000 0.0900000 0.0900000), wk = 0.0044444 k( 113) = ( 0.1000000 0.1000000 0.1000000), wk = 0.0044444 k( 114) = ( 0.1100000 0.1100000 0.1100000), wk = 0.0044444 k( 115) = ( 0.1200000 0.1200000 0.1200000), wk = 0.0044444 k( 116) = ( 0.1300000 0.1300000 0.1300000), wk = 0.0044444 k( 117) = ( 0.1400000 0.1400000 0.1400000), wk = 0.0044444 k( 118) = ( 0.1500000 0.1500000 0.1500000), wk = 0.0044444 k( 119) = ( 0.1600000 0.1600000 0.1600000), wk = 0.0044444 k( 120) = ( 0.1700000 0.1700000 0.1700000), wk = 0.0044444 k( 121) = ( 0.1800000 0.1800000 0.1800000), wk = 0.0044444 k( 122) = ( 0.1900000 0.1900000 0.1900000), wk = 0.0044444 k( 123) = ( 0.2000000 0.2000000 0.2000000), wk = 0.0044444 k( 124) = ( 0.2100000 0.2100000 0.2100000), wk = 0.0044444 k( 125) = ( 0.2200000 0.2200000 0.2200000), wk = 0.0044444 k( 126) = ( 0.2300000 0.2300000 0.2300000), wk = 0.0044444 k( 127) = ( 0.2400000 0.2400000 0.2400000), wk = 0.0044444 k( 128) = ( 0.2500000 0.2500000 0.2500000), wk = 0.0044444 k( 129) = ( 0.2600000 0.2600000 0.2600000), wk = 0.0044444 k( 130) = ( 0.2700000 0.2700000 0.2700000), wk = 0.0044444 k( 131) = ( 0.2800000 0.2800000 0.2800000), wk = 0.0044444 k( 132) = ( 0.2900000 0.2900000 0.2900000), wk = 0.0044444 k( 133) = ( 0.3000000 0.3000000 0.3000000), wk = 0.0044444 k( 134) = ( 0.3100000 0.3100000 0.3100000), wk = 0.0044444 k( 135) = ( 0.3200000 0.3200000 0.3200000), wk = 0.0044444 k( 136) = ( 0.3300000 0.3300000 0.3300000), wk = 0.0044444 k( 137) = ( 0.3400000 0.3400000 0.3400000), wk = 0.0044444 k( 138) = ( 0.3500000 0.3500000 0.3500000), wk = 0.0044444 k( 139) = ( 0.3600000 0.3600000 0.3600000), wk = 0.0044444 k( 140) = ( 0.3700000 0.3700000 0.3700000), wk = 0.0044444 k( 141) = ( 0.3800000 0.3800000 0.3800000), wk = 0.0044444 k( 142) = ( 0.3900000 0.3900000 0.3900000), wk = 0.0044444 k( 143) = ( 0.4000000 0.4000000 0.4000000), wk = 0.0044444 k( 144) = ( 0.4100000 0.4100000 0.4100000), wk = 0.0044444 k( 145) = ( 0.4200000 0.4200000 0.4200000), wk = 0.0044444 k( 146) = ( 0.4300000 0.4300000 0.4300000), wk = 0.0044444 k( 147) = ( 0.4400000 0.4400000 0.4400000), wk = 0.0044444 k( 148) = ( 0.4500000 0.4500000 0.4500000), wk = 0.0044444 k( 149) = ( 0.4600000 0.4600000 0.4600000), wk = 0.0044444 k( 150) = ( 0.4700000 0.4700000 0.4700000), wk = 0.0044444 k( 151) = ( 0.4800000 0.4800000 0.4800000), wk = 0.0044444 k( 152) = ( 0.4900000 0.4900000 0.4900000), wk = 0.0044444 k( 153) = ( 0.5000000 0.5000000 0.5000000), wk = 0.0044444 k( 154) = ( 0.5000000 0.5000000 0.5000000), wk = 0.0044444 k( 155) = ( 0.4878049 0.5000000 0.4878049), wk = 0.0044444 k( 156) = ( 0.4756098 0.5000000 0.4756098), wk = 0.0044444 k( 157) = ( 0.4634146 0.5000000 0.4634146), wk = 0.0044444 k( 158) = ( 0.4512195 0.5000000 0.4512195), wk = 0.0044444 k( 159) = ( 0.4390244 0.5000000 0.4390244), wk = 0.0044444 k( 160) = ( 0.4268293 0.5000000 0.4268293), wk = 0.0044444 k( 161) = ( 0.4146341 0.5000000 0.4146341), wk = 0.0044444 k( 162) = ( 0.4024390 0.5000000 0.4024390), wk = 0.0044444 k( 163) = ( 0.3902439 0.5000000 0.3902439), wk = 0.0044444 k( 164) = ( 0.3780488 0.5000000 0.3780488), wk = 0.0044444 k( 165) = ( 0.3658537 0.5000000 0.3658537), wk = 0.0044444 k( 166) = ( 0.3536585 0.5000000 0.3536585), wk = 0.0044444 k( 167) = ( 0.3414634 0.5000000 0.3414634), wk = 0.0044444 k( 168) = ( 0.3292683 0.5000000 0.3292683), wk = 0.0044444 k( 169) = ( 0.3170732 0.5000000 0.3170732), wk = 0.0044444 k( 170) = ( 0.3048781 0.5000000 0.3048781), wk = 0.0044444 k( 171) = ( 0.2926829 0.5000000 0.2926829), wk = 0.0044444 k( 172) = ( 0.2804878 0.5000000 0.2804878), wk = 0.0044444 k( 173) = ( 0.2682927 0.5000000 0.2682927), wk = 0.0044444 k( 174) = ( 0.2560976 0.5000000 0.2560976), wk = 0.0044444 k( 175) = ( 0.2439024 0.5000000 0.2439024), wk = 0.0044444 k( 176) = ( 0.2317073 0.5000000 0.2317073), wk = 0.0044444 k( 177) = ( 0.2195122 0.5000000 0.2195122), wk = 0.0044444 k( 178) = ( 0.2073171 0.5000000 0.2073171), wk = 0.0044444 k( 179) = ( 0.1951219 0.5000000 0.1951219), wk = 0.0044444 k( 180) = ( 0.1829268 0.5000000 0.1829268), wk = 0.0044444 k( 181) = ( 0.1707317 0.5000000 0.1707317), wk = 0.0044444 k( 182) = ( 0.1585366 0.5000000 0.1585366), wk = 0.0044444 k( 183) = ( 0.1463415 0.5000000 0.1463415), wk = 0.0044444 k( 184) = ( 0.1341463 0.5000000 0.1341463), wk = 0.0044444 k( 185) = ( 0.1219512 0.5000000 0.1219512), wk = 0.0044444 k( 186) = ( 0.1097561 0.5000000 0.1097561), wk = 0.0044444 k( 187) = ( 0.0975610 0.5000000 0.0975610), wk = 0.0044444 k( 188) = ( 0.0853658 0.5000000 0.0853658), wk = 0.0044444 k( 189) = ( 0.0731707 0.5000000 0.0731707), wk = 0.0044444 k( 190) = ( 0.0609756 0.5000000 0.0609756), wk = 0.0044444 k( 191) = ( 0.0487805 0.5000000 0.0487805), wk = 0.0044444 k( 192) = ( 0.0365854 0.5000000 0.0365854), wk = 0.0044444 k( 193) = ( 0.0243902 0.5000000 0.0243902), wk = 0.0044444 k( 194) = ( 0.0121951 0.5000000 0.0121951), wk = 0.0044444 k( 195) = ( 0.0000000 0.5000000 0.0000000), wk = 0.0044444 k( 196) = ( 0.5000000 0.5000000 0.0000000), wk = 0.0044444 k( 197) = ( 0.5000000 0.5000000 0.0172414), wk = 0.0044444 k( 198) = ( 0.5000000 0.5000000 0.0344828), wk = 0.0044444 k( 199) = ( 0.5000000 0.5000000 0.0517241), wk = 0.0044444 k( 200) = ( 0.5000000 0.5000000 0.0689655), wk = 0.0044444 k( 201) = ( 0.5000000 0.5000000 0.0862069), wk = 0.0044444 k( 202) = ( 0.5000000 0.5000000 0.1034483), wk = 0.0044444 k( 203) = ( 0.5000000 0.5000000 0.1206897), wk = 0.0044444 k( 204) = ( 0.5000000 0.5000000 0.1379310), wk = 0.0044444 k( 205) = ( 0.5000000 0.5000000 0.1551724), wk = 0.0044444 k( 206) = ( 0.5000000 0.5000000 0.1724138), wk = 0.0044444 k( 207) = ( 0.5000000 0.5000000 0.1896552), wk = 0.0044444 k( 208) = ( 0.5000000 0.5000000 0.2068966), wk = 0.0044444 k( 209) = ( 0.5000000 0.5000000 0.2241379), wk = 0.0044444 k( 210) = ( 0.5000000 0.5000000 0.2413793), wk = 0.0044444 k( 211) = ( 0.5000000 0.5000000 0.2586207), wk = 0.0044444 k( 212) = ( 0.5000000 0.5000000 0.2758621), wk = 0.0044444 k( 213) = ( 0.5000000 0.5000000 0.2931034), wk = 0.0044444 k( 214) = ( 0.5000000 0.5000000 0.3103448), wk = 0.0044444 k( 215) = ( 0.5000000 0.5000000 0.3275862), wk = 0.0044444 k( 216) = ( 0.5000000 0.5000000 0.3448276), wk = 0.0044444 k( 217) = ( 0.5000000 0.5000000 0.3620690), wk = 0.0044444 k( 218) = ( 0.5000000 0.5000000 0.3793103), wk = 0.0044444 k( 219) = ( 0.5000000 0.5000000 0.3965517), wk = 0.0044444 k( 220) = ( 0.5000000 0.5000000 0.4137931), wk = 0.0044444 k( 221) = ( 0.5000000 0.5000000 0.4310345), wk = 0.0044444 k( 222) = ( 0.5000000 0.5000000 0.4482759), wk = 0.0044444 k( 223) = ( 0.5000000 0.5000000 0.4655172), wk = 0.0044444 k( 224) = ( 0.5000000 0.5000000 0.4827586), wk = 0.0044444 k( 225) = ( 0.5000000 0.5000000 0.5000000), wk = 0.0044444 Dense grid: 84823 G-vectors FFT dimensions: ( 60, 60, 60) Smooth grid: 51867 G-vectors FFT dimensions: ( 48, 48, 48) Largest allocated arrays est. size (Mb) dimensions Kohn-Sham Wavefunctions 0.36 Mb ( 282, 84) NL pseudopotentials 0.59 Mb ( 141, 272) Each V/rho on FFT grid 0.11 Mb ( 7200) Each G-vector array 0.01 Mb ( 1771) G-vector shells 0.00 Mb ( 448) Largest temporary arrays est. size (Mb) dimensions Auxiliary wavefunctions 1.45 Mb ( 282, 336) Each subspace H/S matrix 1.72 Mb ( 336, 336) Each matrix 0.70 Mb ( 272, 2, 84) Check: negative/imaginary core charge= -0.000005 0.000000 The potential is recalculated from file : ./NbCu3S4.save/charge-density.dat Starting wfc are 112 randomized atomic wfcs Band Structure Calculation Davidson diagonalization with overlap Computing kpt #: 1 total cpu time spent up to now is 48.6 secs Computing kpt #: 2 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 59.1 secs Computing kpt #: 3 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 69.4 secs Computing kpt #: 4 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 79.6 secs Computing kpt #: 5 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 89.8 secs Computing kpt #: 6 total cpu time spent up to now is 97.0 secs Computing kpt #: 7 total cpu time spent up to now is 103.6 secs Computing kpt #: 8 total cpu time spent up to now is 109.9 secs Computing kpt #: 9 total cpu time spent up to now is 116.1 secs Computing kpt #: 10 total cpu time spent up to now is 122.0 secs Computing kpt #: 11 total cpu time spent up to now is 127.8 secs Computing kpt #: 12 total cpu time spent up to now is 133.8 secs Computing kpt #: 13 total cpu time spent up to now is 138.8 secs Computing kpt #: 14 total cpu time spent up to now is 144.1 secs Computing kpt #: 15 total cpu time spent up to now is 149.1 secs Computing kpt #: 16 total cpu time spent up to now is 154.3 secs Computing kpt #: 17 total cpu time spent up to now is 159.4 secs Computing kpt #: 18 total cpu time spent up to now is 164.5 secs Computing kpt #: 19 total cpu time spent up to now is 169.7 secs Computing kpt #: 20 total cpu time spent up to now is 175.2 secs Computing kpt #: 21 total cpu time spent up to now is 180.4 secs Computing kpt #: 22 total cpu time spent up to now is 185.7 secs Computing kpt #: 23 total cpu time spent up to now is 190.9 secs Computing kpt #: 24 total cpu time spent up to now is 196.1 secs Computing kpt #: 25 total cpu time spent up to now is 201.3 secs Computing kpt #: 26 total cpu time spent up to now is 206.5 secs Computing kpt #: 27 total cpu time spent up to now is 211.5 secs Computing kpt #: 28 total cpu time spent up to now is 216.5 secs Computing kpt #: 29 total cpu time spent up to now is 221.5 secs Computing kpt #: 30 total cpu time spent up to now is 226.5 secs Computing kpt #: 31 total cpu time spent up to now is 231.5 secs Computing kpt #: 32 total cpu time spent up to now is 236.6 secs Computing kpt #: 33 total cpu time spent up to now is 241.8 secs Computing kpt #: 34 total cpu time spent up to now is 247.2 secs Computing kpt #: 35 total cpu time spent up to now is 252.4 secs Computing kpt #: 36 total cpu time spent up to now is 258.0 secs Computing kpt #: 37 total cpu time spent up to now is 265.0 secs Computing kpt #: 38 total cpu time spent up to now is 270.2 secs Computing kpt #: 39 total cpu time spent up to now is 275.6 secs Computing kpt #: 40 total cpu time spent up to now is 280.9 secs Computing kpt #: 41 total cpu time spent up to now is 286.0 secs Computing kpt #: 42 total cpu time spent up to now is 291.2 secs Computing kpt #: 43 total cpu time spent up to now is 296.4 secs Computing kpt #: 44 total cpu time spent up to now is 301.5 secs Computing kpt #: 45 total cpu time spent up to now is 306.5 secs Computing kpt #: 46 total cpu time spent up to now is 311.4 secs Computing kpt #: 47 total cpu time spent up to now is 316.2 secs Computing kpt #: 48 total cpu time spent up to now is 321.0 secs Computing kpt #: 49 total cpu time spent up to now is 325.7 secs Computing kpt #: 50 total cpu time spent up to now is 330.3 secs Computing kpt #: 51 total cpu time spent up to now is 334.9 secs Computing kpt #: 52 total cpu time spent up to now is 339.5 secs Computing kpt #: 53 total cpu time spent up to now is 343.9 secs Computing kpt #: 54 total cpu time spent up to now is 348.5 secs Computing kpt #: 55 total cpu time spent up to now is 353.1 secs Computing kpt #: 56 total cpu time spent up to now is 357.7 secs Computing kpt #: 57 total cpu time spent up to now is 362.5 secs Computing kpt #: 58 total cpu time spent up to now is 367.4 secs Computing kpt #: 59 total cpu time spent up to now is 372.2 secs Computing kpt #: 60 total cpu time spent up to now is 376.7 secs Computing kpt #: 61 total cpu time spent up to now is 381.3 secs Computing kpt #: 62 total cpu time spent up to now is 386.1 secs Computing kpt #: 63 total cpu time spent up to now is 390.8 secs Computing kpt #: 64 total cpu time spent up to now is 395.4 secs Computing kpt #: 65 total cpu time spent up to now is 400.0 secs Computing kpt #: 66 total cpu time spent up to now is 404.6 secs Computing kpt #: 67 total cpu time spent up to now is 409.2 secs Computing kpt #: 68 total cpu time spent up to now is 413.8 secs Computing kpt #: 69 total cpu time spent up to now is 418.4 secs Computing kpt #: 70 total cpu time spent up to now is 422.9 secs Computing kpt #: 71 total cpu time spent up to now is 427.5 secs Computing kpt #: 72 total cpu time spent up to now is 432.1 secs Computing kpt #: 73 total cpu time spent up to now is 436.7 secs Computing kpt #: 74 total cpu time spent up to now is 441.4 secs Computing kpt #: 75 total cpu time spent up to now is 446.2 secs Computing kpt #: 76 total cpu time spent up to now is 451.1 secs Computing kpt #: 77 total cpu time spent up to now is 456.3 secs Computing kpt #: 78 total cpu time spent up to now is 461.5 secs Computing kpt #: 79 total cpu time spent up to now is 467.1 secs Computing kpt #: 80 total cpu time spent up to now is 473.3 secs Computing kpt #: 81 total cpu time spent up to now is 479.5 secs Computing kpt #: 82 total cpu time spent up to now is 485.6 secs Computing kpt #: 83 total cpu time spent up to now is 491.7 secs Computing kpt #: 84 total cpu time spent up to now is 499.5 secs Computing kpt #: 85 total cpu time spent up to now is 505.0 secs Computing kpt #: 86 total cpu time spent up to now is 511.8 secs Computing kpt #: 87 total cpu time spent up to now is 519.3 secs Computing kpt #: 88 total cpu time spent up to now is 529.3 secs Computing kpt #: 89 total cpu time spent up to now is 535.4 secs Computing kpt #: 90 total cpu time spent up to now is 544.1 secs Computing kpt #: 91 total cpu time spent up to now is 551.5 secs Computing kpt #: 92 total cpu time spent up to now is 561.0 secs Computing kpt #: 93 total cpu time spent up to now is 570.8 secs Computing kpt #: 94 total cpu time spent up to now is 579.6 secs Computing kpt #: 95 total cpu time spent up to now is 588.3 secs Computing kpt #: 96 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 598.9 secs Computing kpt #: 97 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 609.7 secs Computing kpt #: 98 total cpu time spent up to now is 618.9 secs Computing kpt #: 99 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 629.7 secs Computing kpt #: 100 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 640.5 secs Computing kpt #: 101 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 651.2 secs Computing kpt #: 102 total cpu time spent up to now is 656.3 secs Computing kpt #: 103 total cpu time spent up to now is 661.4 secs Computing kpt #: 104 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 672.0 secs Computing kpt #: 105 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 682.4 secs Computing kpt #: 106 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 693.2 secs Computing kpt #: 107 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 703.7 secs Computing kpt #: 108 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 714.1 secs Computing kpt #: 109 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 724.6 secs Computing kpt #: 110 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 735.1 secs Computing kpt #: 111 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 745.7 secs Computing kpt #: 112 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 756.2 secs Computing kpt #: 113 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 766.9 secs Computing kpt #: 114 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 777.4 secs Computing kpt #: 115 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 788.0 secs Computing kpt #: 116 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 798.6 secs Computing kpt #: 117 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 809.2 secs Computing kpt #: 118 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 819.8 secs Computing kpt #: 119 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 830.4 secs Computing kpt #: 120 total cpu time spent up to now is 838.9 secs Computing kpt #: 121 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 849.6 secs Computing kpt #: 122 total cpu time spent up to now is 858.5 secs Computing kpt #: 123 total cpu time spent up to now is 866.4 secs Computing kpt #: 124 total cpu time spent up to now is 871.9 secs Computing kpt #: 125 total cpu time spent up to now is 877.3 secs Computing kpt #: 126 total cpu time spent up to now is 882.7 secs Computing kpt #: 127 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 893.3 secs Computing kpt #: 128 total cpu time spent up to now is 898.6 secs Computing kpt #: 129 total cpu time spent up to now is 903.9 secs Computing kpt #: 130 total cpu time spent up to now is 909.0 secs Computing kpt #: 131 total cpu time spent up to now is 914.3 secs Computing kpt #: 132 total cpu time spent up to now is 919.5 secs Computing kpt #: 133 total cpu time spent up to now is 924.7 secs Computing kpt #: 134 total cpu time spent up to now is 929.7 secs Computing kpt #: 135 total cpu time spent up to now is 934.9 secs Computing kpt #: 136 total cpu time spent up to now is 940.1 secs Computing kpt #: 137 total cpu time spent up to now is 945.2 secs Computing kpt #: 138 total cpu time spent up to now is 950.3 secs Computing kpt #: 139 total cpu time spent up to now is 955.4 secs Computing kpt #: 140 total cpu time spent up to now is 960.3 secs Computing kpt #: 141 total cpu time spent up to now is 965.5 secs Computing kpt #: 142 total cpu time spent up to now is 970.4 secs Computing kpt #: 143 total cpu time spent up to now is 975.4 secs Computing kpt #: 144 total cpu time spent up to now is 980.5 secs Computing kpt #: 145 total cpu time spent up to now is 985.5 secs Computing kpt #: 146 total cpu time spent up to now is 990.6 secs Computing kpt #: 147 total cpu time spent up to now is 995.5 secs Computing kpt #: 148 total cpu time spent up to now is 1000.4 secs Computing kpt #: 149 total cpu time spent up to now is 1005.4 secs Computing kpt #: 150 total cpu time spent up to now is 1010.2 secs Computing kpt #: 151 total cpu time spent up to now is 1015.1 secs Computing kpt #: 152 total cpu time spent up to now is 1019.9 secs Computing kpt #: 153 total cpu time spent up to now is 1024.6 secs Computing kpt #: 154 total cpu time spent up to now is 1029.4 secs Computing kpt #: 155 total cpu time spent up to now is 1034.4 secs Computing kpt #: 156 total cpu time spent up to now is 1039.3 secs Computing kpt #: 157 total cpu time spent up to now is 1044.1 secs Computing kpt #: 158 total cpu time spent up to now is 1049.0 secs Computing kpt #: 159 total cpu time spent up to now is 1053.8 secs Computing kpt #: 160 total cpu time spent up to now is 1058.6 secs Computing kpt #: 161 total cpu time spent up to now is 1063.4 secs Computing kpt #: 162 total cpu time spent up to now is 1068.2 secs Computing kpt #: 163 total cpu time spent up to now is 1072.9 secs Computing kpt #: 164 total cpu time spent up to now is 1077.6 secs Computing kpt #: 165 total cpu time spent up to now is 1082.4 secs Computing kpt #: 166 total cpu time spent up to now is 1087.1 secs Computing kpt #: 167 total cpu time spent up to now is 1091.7 secs Computing kpt #: 168 total cpu time spent up to now is 1096.3 secs Computing kpt #: 169 total cpu time spent up to now is 1101.0 secs Computing kpt #: 170 total cpu time spent up to now is 1105.7 secs Computing kpt #: 171 total cpu time spent up to now is 1110.4 secs Computing kpt #: 172 total cpu time spent up to now is 1115.1 secs Computing kpt #: 173 total cpu time spent up to now is 1119.7 secs Computing kpt #: 174 total cpu time spent up to now is 1124.3 secs Computing kpt #: 175 total cpu time spent up to now is 1128.9 secs Computing kpt #: 176 total cpu time spent up to now is 1133.6 secs Computing kpt #: 177 total cpu time spent up to now is 1138.2 secs Computing kpt #: 178 total cpu time spent up to now is 1142.9 secs Computing kpt #: 179 total cpu time spent up to now is 1147.6 secs Computing kpt #: 180 total cpu time spent up to now is 1152.5 secs Computing kpt #: 181 total cpu time spent up to now is 1157.3 secs Computing kpt #: 182 total cpu time spent up to now is 1164.0 secs Computing kpt #: 183 total cpu time spent up to now is 1169.3 secs Computing kpt #: 184 total cpu time spent up to now is 1174.3 secs Computing kpt #: 185 total cpu time spent up to now is 1179.6 secs Computing kpt #: 186 total cpu time spent up to now is 1184.9 secs Computing kpt #: 187 total cpu time spent up to now is 1190.3 secs Computing kpt #: 188 total cpu time spent up to now is 1195.7 secs Computing kpt #: 189 total cpu time spent up to now is 1201.0 secs Computing kpt #: 190 total cpu time spent up to now is 1206.3 secs Computing kpt #: 191 total cpu time spent up to now is 1211.5 secs Computing kpt #: 192 total cpu time spent up to now is 1216.8 secs Computing kpt #: 193 total cpu time spent up to now is 1222.0 secs Computing kpt #: 194 total cpu time spent up to now is 1227.2 secs Computing kpt #: 195 total cpu time spent up to now is 1232.2 secs Computing kpt #: 196 total cpu time spent up to now is 1236.7 secs Computing kpt #: 197 total cpu time spent up to now is 1241.2 secs Computing kpt #: 198 total cpu time spent up to now is 1245.7 secs Computing kpt #: 199 total cpu time spent up to now is 1250.2 secs Computing kpt #: 200 total cpu time spent up to now is 1254.8 secs Computing kpt #: 201 total cpu time spent up to now is 1259.3 secs Computing kpt #: 202 total cpu time spent up to now is 1263.8 secs Computing kpt #: 203 total cpu time spent up to now is 1268.5 secs Computing kpt #: 204 total cpu time spent up to now is 1273.0 secs Computing kpt #: 205 total cpu time spent up to now is 1277.7 secs Computing kpt #: 206 total cpu time spent up to now is 1282.3 secs Computing kpt #: 207 total cpu time spent up to now is 1286.9 secs Computing kpt #: 208 total cpu time spent up to now is 1291.5 secs Computing kpt #: 209 total cpu time spent up to now is 1296.2 secs Computing kpt #: 210 total cpu time spent up to now is 1301.0 secs Computing kpt #: 211 total cpu time spent up to now is 1305.8 secs Computing kpt #: 212 total cpu time spent up to now is 1310.7 secs Computing kpt #: 213 total cpu time spent up to now is 1315.5 secs Computing kpt #: 214 total cpu time spent up to now is 1320.5 secs Computing kpt #: 215 total cpu time spent up to now is 1325.4 secs Computing kpt #: 216 total cpu time spent up to now is 1330.2 secs Computing kpt #: 217 total cpu time spent up to now is 1335.1 secs Computing kpt #: 218 total cpu time spent up to now is 1340.0 secs Computing kpt #: 219 total cpu time spent up to now is 1344.9 secs Computing kpt #: 220 total cpu time spent up to now is 1349.8 secs Computing kpt #: 221 total cpu time spent up to now is 1354.6 secs Computing kpt #: 222 total cpu time spent up to now is 1359.4 secs Computing kpt #: 223 total cpu time spent up to now is 1364.1 secs Computing kpt #: 224 total cpu time spent up to now is 1368.9 secs Computing kpt #: 225 total cpu time spent up to now is 1373.6 secs ethr = 1.43E-11, avg # of iterations = 43.9 total cpu time spent up to now is 1373.7 secs End of band structure calculation k = 0.0000 0.0000 0.0000 ( 6451 PWs) bands (ev): -48.9714 -48.9714 -26.6269 -26.6269 -24.5536 -24.5536 -24.5536 -24.5536 -7.3671 -7.3671 -6.3891 -6.3891 -6.3522 -6.3522 -6.3522 -6.3522 0.3162 0.3162 0.3162 0.3162 1.3844 1.3844 1.9344 1.9344 1.9344 1.9344 1.9611 1.9611 2.6170 2.6170 2.6557 2.6557 2.6557 2.6557 3.2115 3.2115 3.2354 3.2354 3.2354 3.2354 3.3420 3.3420 3.3420 3.3420 3.9651 3.9651 4.0838 4.0838 4.0838 4.0838 4.1706 4.1706 4.1706 4.1706 4.2373 4.2373 4.5675 4.5675 4.6889 4.6889 4.6889 4.6889 4.7739 4.7739 5.5752 5.5752 5.5752 5.5752 5.6654 5.6654 8.0293 8.0293 8.0293 8.0293 8.0762 8.0762 8.1019 8.1019 8.1297 8.1297 8.1297 8.1297 11.7344 11.7344 k = 0.0000 0.0172-0.0000 ( 6475 PWs) bands (ev): -48.9715 -48.9715 -26.6269 -26.6269 -24.5537 -24.5537 -24.5537 -24.5537 -7.3665 -7.3665 -6.3893 -6.3893 -6.3527 -6.3527 -6.3522 -6.3522 0.3167 0.3167 0.3174 0.3174 1.3850 1.3850 1.9335 1.9335 1.9350 1.9350 1.9609 1.9609 2.6163 2.6163 2.6545 2.6545 2.6556 2.6556 3.2099 3.2099 3.2322 3.2322 3.2354 3.2354 3.3418 3.3418 3.3471 3.3471 3.9646 3.9646 4.0760 4.0760 4.0912 4.0912 4.1652 4.1652 4.1757 4.1757 4.2370 4.2370 4.5676 4.5676 4.6856 4.6856 4.6917 4.6917 4.7737 4.7737 5.5731 5.5731 5.5752 5.5752 5.6644 5.6644 8.0243 8.0243 8.0311 8.0311 8.0661 8.0661 8.0998 8.0998 8.1307 8.1307 8.1519 8.1519 11.7321 11.7323 k = 0.0000 0.0345-0.0000 ( 6503 PWs) bands (ev): -48.9717 -48.9717 -26.6270 -26.6270 -24.5537 -24.5537 -24.5537 -24.5537 -7.3648 -7.3648 -6.3900 -6.3900 -6.3540 -6.3540 -6.3522 -6.3522 0.3184 0.3184 0.3212 0.3212 1.3870 1.3870 1.9311 1.9311 1.9360 1.9360 1.9606 1.9606 2.6143 2.6143 2.6513 2.6513 2.6549 2.6549 3.2031 3.2031 3.2260 3.2260 3.2354 3.2354 3.3432 3.3432 3.3591 3.3591 3.9632 3.9632 4.0679 4.0679 4.0980 4.0980 4.1595 4.1595 4.1807 4.1807 4.2363 4.2363 4.5677 4.5677 4.6817 4.6817 4.6943 4.6943 4.7731 4.7731 5.5676 5.5676 5.5746 5.5746 5.6613 5.6613 8.0079 8.0079 8.0336 8.0336 8.0574 8.0574 8.1025 8.1025 8.1342 8.1342 8.1917 8.1917 11.7258 11.7258 k = 0.0000 0.0517-0.0000 ( 6511 PWs) bands (ev): -48.9717 -48.9717 -26.6270 -26.6270 -24.5537 -24.5537 -24.5537 -24.5537 -7.3618 -7.3618 -6.3913 -6.3913 -6.3561 -6.3561 -6.3522 -6.3522 0.3213 0.3213 0.3274 0.3274 1.3903 1.3903 1.9265 1.9265 1.9377 1.9377 1.9606 1.9606 2.6107 2.6107 2.6465 2.6465 2.6538 2.6538 3.1888 3.1888 3.2222 3.2222 3.2354 3.2354 3.3456 3.3456 3.3754 3.3754 3.9609 3.9609 4.0600 4.0600 4.1038 4.1038 4.1537 4.1537 4.1858 4.1858 4.2353 4.2353 4.5678 4.5678 4.6771 4.6771 4.6969 4.6969 4.7723 4.7723 5.5583 5.5583 5.5737 5.5737 5.6568 5.6568 7.9826 7.9826 8.0375 8.0375 8.0591 8.0591 8.1086 8.1086 8.1401 8.1401 8.2382 8.2382 11.7155 11.7155 k = 0.0000 0.0690-0.0000 ( 6503 PWs) bands (ev): -48.9717 -48.9717 -26.6270 -26.6270 -24.5538 -24.5538 -24.5537 -24.5537 -7.3578 -7.3578 -6.3934 -6.3934 -6.3587 -6.3587 -6.3522 -6.3522 0.3254 0.3254 0.3361 0.3361 1.3949 1.3949 1.9194 1.9194 1.9401 1.9401 1.9615 1.9615 2.6047 2.6047 2.6408 2.6408 2.6523 2.6523 3.1694 3.1694 3.2204 3.2204 3.2354 3.2354 3.3488 3.3488 3.3944 3.3944 3.9576 3.9576 4.0524 4.0524 4.1084 4.1084 4.1477 4.1477 4.1909 4.1909 4.2343 4.2343 4.5677 4.5677 4.6717 4.6717 4.6997 4.6997 4.7713 4.7713 5.5450 5.5450 5.5723 5.5723 5.6511 5.6511 7.9555 7.9555 8.0430 8.0430 8.0656 8.0656 8.1175 8.1175 8.1482 8.1482 8.2896 8.2896 11.7014 11.7014 k = 0.0000 0.0862-0.0000 ( 6515 PWs) bands (ev): -48.9717 -48.9717 -26.6270 -26.6270 -24.5538 -24.5538 -24.5537 -24.5537 -7.3526 -7.3526 -6.3966 -6.3966 -6.3616 -6.3616 -6.3523 -6.3523 0.3305 0.3305 0.3472 0.3472 1.4009 1.4009 1.9097 1.9097 1.9432 1.9432 1.9633 1.9633 2.5958 2.5958 2.6351 2.6351 2.6504 2.6504 3.1470 3.1470 3.2194 3.2194 3.2353 3.2353 3.3528 3.3528 3.4147 3.4147 3.9531 3.9531 4.0452 4.0452 4.1111 4.1111 4.1421 4.1421 4.1960 4.1960 4.2334 4.2334 4.5672 4.5672 4.6655 4.6655 4.7028 4.7028 4.7700 4.7700 5.5276 5.5276 5.5707 5.5707 5.6449 5.6449 7.9290 7.9290 8.0499 8.0499 8.0749 8.0749 8.1287 8.1287 8.1584 8.1584 8.3457 8.3457 11.6840 11.6840 k = 0.0000 0.1034-0.0000 ( 6507 PWs) bands (ev): -48.9717 -48.9717 -26.6270 -26.6270 -24.5539 -24.5539 -24.5537 -24.5537 -7.3463 -7.3463 -6.4012 -6.4012 -6.3644 -6.3644 -6.3523 -6.3523 0.3367 0.3367 0.3606 0.3606 1.4082 1.4082 1.8973 1.8973 1.9468 1.9468 1.9661 1.9661 2.5835 2.5835 2.6299 2.6299 2.6480 2.6480 3.1226 3.1226 3.2186 3.2186 3.2354 3.2354 3.3575 3.3575 3.4360 3.4360 3.9477 3.9477 4.0386 4.0386 4.1106 4.1106 4.1381 4.1381 4.2007 4.2007 4.2330 4.2330 4.5661 4.5661 4.6584 4.6584 4.7064 4.7064 4.7686 4.7686 5.5064 5.5064 5.5687 5.5687 5.6385 5.6385 7.9035 7.9035 8.0583 8.0583 8.0862 8.0862 8.1420 8.1420 8.1706 8.1706 8.4062 8.4062 11.6636 11.6636 k = 0.0000 0.1207-0.0000 ( 6503 PWs) bands (ev): -48.9717 -48.9717 -26.6270 -26.6270 -24.5540 -24.5540 -24.5537 -24.5537 -7.3389 -7.3389 -6.4073 -6.4073 -6.3668 -6.3668 -6.3523 -6.3523 0.3439 0.3439 0.3764 0.3764 1.4168 1.4168 1.8826 1.8826 1.9511 1.9511 1.9697 1.9697 2.5681 2.5681 2.6252 2.6252 2.6453 2.6453 3.0965 3.0965 3.2178 3.2178 3.2354 3.2354 3.3628 3.3628 3.4580 3.4580 3.9413 3.9413 4.0328 4.0328 4.1063 4.1063 4.1366 4.1366 4.2047 4.2047 4.2334 4.2334 4.5642 4.5642 4.6506 4.6506 4.7104 4.7104 4.7670 4.7670 5.4818 5.4818 5.5666 5.5666 5.6321 5.6321 7.8793 7.8793 8.0679 8.0679 8.0991 8.0991 8.1572 8.1572 8.1846 8.1846 8.4710 8.4710 11.6409 11.6409 k = 0.0000 0.1379-0.0000 ( 6495 PWs) bands (ev): -48.9716 -48.9716 -26.6271 -26.6271 -24.5541 -24.5541 -24.5537 -24.5537 -7.3304 -7.3304 -6.4152 -6.4152 -6.3687 -6.3687 -6.3523 -6.3523 0.3521 0.3521 0.3945 0.3945 1.4268 1.4268 1.8656 1.8656 1.9559 1.9559 1.9740 1.9740 2.5499 2.5499 2.6208 2.6208 2.6423 2.6423 3.0689 3.0689 3.2171 3.2171 3.2354 3.2354 3.3685 3.3685 3.4806 3.4806 3.9341 3.9341 4.0276 4.0276 4.0988 4.0988 4.1369 4.1369 4.2078 4.2078 4.2349 4.2349 4.5614 4.5614 4.6421 4.6421 4.7149 4.7149 4.7654 4.7654 5.4542 5.4542 5.5642 5.5642 5.6256 5.6256 7.8561 7.8561 8.0785 8.0785 8.1133 8.1133 8.1742 8.1742 8.2003 8.2003 8.5397 8.5397 11.6163 11.6163 k = 0.0000 0.1552-0.0000 ( 6491 PWs) bands (ev): -48.9716 -48.9716 -26.6271 -26.6271 -24.5541 -24.5541 -24.5537 -24.5537 -7.3209 -7.3209 -6.4247 -6.4247 -6.3702 -6.3702 -6.3524 -6.3524 0.3613 0.3613 0.4148 0.4148 1.4381 1.4381 1.8466 1.8466 1.9613 1.9613 1.9789 1.9789 2.5295 2.5295 2.6166 2.6166 2.6389 2.6389 3.0397 3.0397 3.2164 3.2164 3.2354 3.2354 3.3746 3.3746 3.5036 3.5036 3.9261 3.9261 4.0231 4.0231 4.0895 4.0895 4.1379 4.1379 4.2096 4.2096 4.2375 4.2375 4.5577 4.5577 4.6330 4.6330 4.7197 4.7197 4.7639 4.7639 5.4243 5.4243 5.5616 5.5616 5.6193 5.6193 7.8340 7.8340 8.0898 8.0898 8.1286 8.1286 8.1925 8.1925 8.2173 8.2173 8.6122 8.6122 11.5905 11.5905 k = 0.0000 0.1724-0.0000 ( 6495 PWs) bands (ev): -48.9716 -48.9716 -26.6271 -26.6271 -24.5543 -24.5543 -24.5537 -24.5537 -7.3104 -7.3104 -6.4356 -6.4356 -6.3712 -6.3712 -6.3524 -6.3524 0.3712 0.3712 0.4372 0.4372 1.4506 1.4506 1.8258 1.8258 1.9671 1.9671 1.9843 1.9843 2.5071 2.5071 2.6124 2.6124 2.6352 2.6352 3.0091 3.0091 3.2157 3.2157 3.2355 3.2355 3.3810 3.3810 3.5269 3.5269 3.9175 3.9175 4.0191 4.0191 4.0791 4.0791 4.1390 4.1390 4.2104 4.2104 4.2409 4.2409 4.5531 4.5531 4.6235 4.6235 4.7247 4.7247 4.7626 4.7626 5.3927 5.3927 5.5589 5.5589 5.6130 5.6130 7.8130 7.8130 8.1016 8.1016 8.1448 8.1448 8.2121 8.2121 8.2355 8.2355 8.6880 8.6880 11.5639 11.5639 k = 0.0000 0.1897-0.0000 ( 6495 PWs) bands (ev): -48.9716 -48.9716 -26.6272 -26.6272 -24.5544 -24.5544 -24.5537 -24.5537 -7.2990 -7.2990 -6.4479 -6.4479 -6.3720 -6.3720 -6.3525 -6.3525 0.3820 0.3820 0.4616 0.4616 1.4644 1.4644 1.8033 1.8033 1.9733 1.9733 1.9901 1.9901 2.4833 2.4833 2.6082 2.6082 2.6313 2.6313 2.9770 2.9770 3.2149 3.2149 3.2355 3.2355 3.3875 3.3875 3.5506 3.5506 3.9087 3.9087 4.0155 4.0155 4.0683 4.0683 4.1399 4.1399 4.2105 4.2105 4.2444 4.2444 4.5477 4.5477 4.6137 4.6137 4.7296 4.7296 4.7617 4.7617 5.3598 5.3598 5.5562 5.5562 5.6069 5.6069 7.7929 7.7929 8.1138 8.1138 8.1618 8.1618 8.2326 8.2326 8.2546 8.2546 8.7669 8.7669 11.5369 11.5369 k = 0.0000 0.2069-0.0000 ( 6503 PWs) bands (ev): -48.9717 -48.9717 -26.6272 -26.6272 -24.5545 -24.5545 -24.5537 -24.5537 -7.2867 -7.2867 -6.4613 -6.4613 -6.3726 -6.3726 -6.3525 -6.3525 0.3934 0.3934 0.4879 0.4879 1.4792 1.4792 1.7794 1.7794 1.9799 1.9799 1.9963 1.9963 2.4584 2.4584 2.6038 2.6038 2.6271 2.6271 2.9434 2.9434 3.2141 3.2141 3.2356 3.2356 3.3940 3.3940 3.5746 3.5746 3.8996 3.8996 4.0122 4.0122 4.0572 4.0572 4.1405 4.1405 4.2102 4.2102 4.2476 4.2476 4.5416 4.5416 4.6037 4.6037 4.7343 4.7343 4.7615 4.7615 5.3261 5.3261 5.5534 5.5534 5.6009 5.6009 7.7738 7.7738 8.1261 8.1261 8.1792 8.1792 8.2537 8.2537 8.2744 8.2744 8.8484 8.8484 11.5101 11.5101 k = 0.0000 0.2241-0.0000 ( 6499 PWs) bands (ev): -48.9716 -48.9716 -26.6273 -26.6273 -24.5546 -24.5546 -24.5537 -24.5537 -7.2736 -7.2736 -6.4757 -6.4757 -6.3730 -6.3730 -6.3525 -6.3525 0.4054 0.4054 0.5161 0.5161 1.4949 1.4949 1.7545 1.7545 1.9867 1.9867 2.0028 2.0028 2.4325 2.4325 2.5994 2.5994 2.6228 2.6228 2.9085 2.9085 3.2133 3.2133 3.2357 3.2357 3.4007 3.4007 3.5988 3.5988 3.8906 3.8906 4.0091 4.0091 4.0461 4.0461 4.1406 4.1406 4.2097 4.2097 4.2501 4.2501 4.5351 4.5351 4.5937 4.5937 4.7383 4.7383 4.7624 4.7624 5.2922 5.2922 5.5506 5.5506 5.5952 5.5952 7.7557 7.7557 8.1385 8.1385 8.1970 8.1970 8.2752 8.2752 8.2945 8.2945 8.9320 8.9320 11.4837 11.4837 k = 0.0000 0.2414-0.0000 ( 6491 PWs) bands (ev): -48.9716 -48.9716 -26.6273 -26.6273 -24.5547 -24.5547 -24.5537 -24.5537 -7.2598 -7.2598 -6.4911 -6.4911 -6.3733 -6.3733 -6.3526 -6.3526 0.4179 0.4179 0.5461 0.5461 1.5110 1.5110 1.7290 1.7290 1.9938 1.9938 2.0096 2.0096 2.4061 2.4061 2.5950 2.5950 2.6184 2.6184 2.8721 2.8721 3.2125 3.2125 3.2358 3.2358 3.4072 3.4072 3.6233 3.6233 3.8818 3.8818 4.0061 4.0061 4.0353 4.0353 4.1404 4.1404 4.2092 4.2092 4.2518 4.2518 4.5282 4.5282 4.5838 4.5838 4.7414 4.7414 4.7646 4.7646 5.2583 5.2583 5.5479 5.5479 5.5898 5.5898 7.7385 7.7385 8.1507 8.1507 8.2149 8.2149 8.2968 8.2968 8.3148 8.3148 9.0173 9.0173 11.4580 11.4580 k = 0.0000 0.2586-0.0000 ( 6495 PWs) bands (ev): -48.9716 -48.9716 -26.6274 -26.6274 -24.5548 -24.5548 -24.5537 -24.5537 -7.2452 -7.2452 -6.5072 -6.5072 -6.3735 -6.3735 -6.3526 -6.3526 0.4307 0.4307 0.5776 0.5776 1.5265 1.5265 1.7041 1.7041 2.0011 2.0011 2.0164 2.0164 2.3794 2.3794 2.5904 2.5904 2.6138 2.6138 2.8345 2.8345 3.2117 3.2117 3.2359 3.2359 3.4136 3.4136 3.6479 3.6479 3.8732 3.8732 4.0032 4.0032 4.0248 4.0248 4.1397 4.1397 4.2085 4.2085 4.2521 4.2521 4.5211 4.5211 4.5741 4.5741 4.7437 4.7437 4.7680 4.7680 5.2249 5.2249 5.5452 5.5452 5.5847 5.5847 7.7223 7.7223 8.1626 8.1626 8.2328 8.2328 8.3183 8.3183 8.3349 8.3349 9.1037 9.1037 11.4332 11.4332 k = 0.0000 0.2759-0.0000 ( 6491 PWs) bands (ev): -48.9716 -48.9716 -26.6274 -26.6274 -24.5550 -24.5550 -24.5537 -24.5537 -7.2301 -7.2301 -6.5239 -6.5239 -6.3737 -6.3737 -6.3527 -6.3527 0.4437 0.4437 0.6105 0.6105 1.5396 1.5396 1.6818 1.6818 2.0084 2.0084 2.0234 2.0234 2.3528 2.3528 2.5858 2.5858 2.6092 2.6092 2.7958 2.7958 3.2109 3.2109 3.2360 3.2360 3.4199 3.4199 3.6725 3.6725 3.8650 3.8650 4.0001 4.0001 4.0149 4.0149 4.1386 4.1386 4.2078 4.2078 4.2512 4.2512 4.5139 4.5139 4.5646 4.5646 4.7457 4.7457 4.7722 4.7722 5.1922 5.1922 5.5426 5.5426 5.5799 5.5799 7.7071 7.7071 8.1742 8.1742 8.2503 8.2503 8.3394 8.3394 8.3547 8.3547 9.1908 9.1908 11.4093 11.4093 k = 0.0000 0.2931-0.0000 ( 6483 PWs) bands (ev): -48.9715 -48.9715 -26.6274 -26.6274 -24.5551 -24.5551 -24.5537 -24.5537 -7.2146 -7.2146 -6.5411 -6.5411 -6.3738 -6.3738 -6.3527 -6.3527 0.4568 0.4568 0.6448 0.6448 1.5459 1.5459 1.6663 1.6663 2.0158 2.0158 2.0303 2.0303 2.3265 2.3265 2.5813 2.5813 2.6047 2.6047 2.7562 2.7562 3.2101 3.2101 3.2362 3.2362 3.4259 3.4259 3.6972 3.6972 3.8572 3.8572 3.9964 3.9964 4.0062 4.0062 4.1371 4.1371 4.2070 4.2070 4.2489 4.2489 4.5069 4.5069 4.5557 4.5557 4.7479 4.7479 4.7768 4.7768 5.1604 5.1604 5.5401 5.5401 5.5755 5.5755 7.6929 7.6929 8.1854 8.1854 8.2674 8.2674 8.3599 8.3599 8.3738 8.3738 9.2779 9.2779 11.3866 11.3866 k = 0.0000 0.3103-0.0000 ( 6491 PWs) bands (ev): -48.9716 -48.9716 -26.6275 -26.6275 -24.5552 -24.5552 -24.5537 -24.5537 -7.1987 -7.1987 -6.5586 -6.5586 -6.3739 -6.3739 -6.3528 -6.3528 0.4698 0.4698 0.6802 0.6802 1.5400 1.5400 1.6632 1.6632 2.0229 2.0229 2.0371 2.0371 2.3008 2.3008 2.5768 2.5768 2.6002 2.6002 2.7160 2.7160 3.2094 3.2094 3.2363 3.2363 3.4316 3.4316 3.7218 3.7218 3.8499 3.8499 3.9910 3.9910 3.9999 3.9999 4.1350 4.1350 4.2062 4.2062 4.2452 4.2452 4.5000 4.5000 4.5471 4.5471 4.7505 4.7505 4.7815 4.7815 5.1296 5.1296 5.5376 5.5376 5.5714 5.5714 7.6798 7.6798 8.1960 8.1960 8.2838 8.2838 8.3795 8.3795 8.3921 8.3921 9.3644 9.3644 11.3650 11.3650 k = 0.0000 0.3276-0.0000 ( 6507 PWs) bands (ev): -48.9716 -48.9716 -26.6275 -26.6275 -24.5553 -24.5553 -24.5537 -24.5537 -7.1826 -7.1826 -6.5763 -6.5763 -6.3739 -6.3739 -6.3528 -6.3528 0.4825 0.4825 0.7166 0.7166 1.5212 1.5212 1.6730 1.6730 2.0299 2.0299 2.0437 2.0437 2.2761 2.2761 2.5722 2.5722 2.5958 2.5958 2.6755 2.6755 3.2087 3.2087 3.2364 3.2364 3.4370 3.4370 3.7462 3.7462 3.8431 3.8431 3.9840 3.9840 3.9959 3.9959 4.1323 4.1323 4.2054 4.2054 4.2402 4.2402 4.4935 4.4935 4.5391 4.5391 4.7538 4.7538 4.7863 4.7863 5.1001 5.1001 5.5353 5.5353 5.5678 5.5678 7.6677 7.6677 8.2060 8.2060 8.2994 8.2994 8.3981 8.3981 8.4094 8.4094 9.4495 9.4495 11.3445 11.3445 k = 0.0000 0.3448-0.0000 ( 6499 PWs) bands (ev): -48.9716 -48.9716 -26.6276 -26.6276 -24.5554 -24.5554 -24.5537 -24.5537 -7.1665 -7.1665 -6.5939 -6.5939 -6.3740 -6.3740 -6.3528 -6.3528 0.4948 0.4948 0.7539 0.7539 1.4944 1.4944 1.6910 1.6910 2.0367 2.0367 2.0501 2.0501 2.2526 2.2526 2.5675 2.5675 2.5915 2.5915 2.6353 2.6353 3.2080 3.2080 3.2365 3.2365 3.4420 3.4420 3.7704 3.7704 3.8369 3.8369 3.9767 3.9767 3.9930 3.9930 4.1291 4.1291 4.2045 4.2045 4.2340 4.2340 4.4874 4.4874 4.5316 4.5316 4.7580 4.7580 4.7910 4.7910 5.0720 5.0720 5.5332 5.5332 5.5646 5.5646 7.6567 7.6567 8.2153 8.2153 8.3140 8.3140 8.4155 8.4155 8.4255 8.4255 9.5325 9.5325 11.3249 11.3249 k = 0.0000 0.3621-0.0000 ( 6495 PWs) bands (ev): -48.9716 -48.9716 -26.6276 -26.6276 -24.5555 -24.5555 -24.5537 -24.5537 -7.1507 -7.1507 -6.6111 -6.6111 -6.3740 -6.3740 -6.3529 -6.3529 0.5065 0.5065 0.7917 0.7917 1.4633 1.4633 1.7133 1.7133 2.0431 2.0431 2.0561 2.0561 2.2305 2.2305 2.5615 2.5615 2.5869 2.5869 2.5977 2.5977 3.2074 3.2074 3.2367 3.2367 3.4467 3.4467 3.7939 3.7939 3.8315 3.8315 3.9700 3.9700 3.9906 3.9906 4.1253 4.1253 4.2034 4.2034 4.2271 4.2271 4.4818 4.4818 4.5248 4.5248 4.7629 4.7629 4.7957 4.7957 5.0453 5.0453 5.5312 5.5312 5.5618 5.5618 7.6468 7.6468 8.2239 8.2239 8.3274 8.3274 8.4314 8.4314 8.4402 8.4402 9.6124 9.6124 11.3063 11.3063 k = 0.0000 0.3793-0.0000 ( 6495 PWs) bands (ev): -48.9716 -48.9716 -26.6276 -26.6276 -24.5556 -24.5556 -24.5537 -24.5537 -7.1353 -7.1353 -6.6278 -6.6278 -6.3740 -6.3740 -6.3529 -6.3529 0.5173 0.5173 0.8299 0.8299 1.4299 1.4299 1.7376 1.7376 2.0491 2.0491 2.0616 2.0616 2.2103 2.2103 2.5450 2.5450 2.5697 2.5697 2.5845 2.5845 3.2068 3.2068 3.2368 3.2368 3.4508 3.4508 3.8160 3.8160 3.8275 3.8275 3.9639 3.9639 3.9885 3.9885 4.1208 4.1208 4.2019 4.2019 4.2199 4.2199 4.4767 4.4767 4.5186 4.5186 4.7685 4.7685 4.8006 4.8006 5.0200 5.0200 5.5294 5.5294 5.5595 5.5595 7.6380 7.6380 8.2316 8.2316 8.3396 8.3396 8.4458 8.4458 8.4535 8.4535 9.6882 9.6882 11.2885 11.2885 k = 0.0000 0.3966-0.0000 ( 6495 PWs) bands (ev): -48.9716 -48.9716 -26.6276 -26.6276 -24.5557 -24.5557 -24.5537 -24.5537 -7.1206 -7.1206 -6.6436 -6.6436 -6.3740 -6.3740 -6.3530 -6.3530 0.5272 0.5272 0.8681 0.8681 1.3953 1.3953 1.7626 1.7626 2.0544 2.0544 2.0665 2.0665 2.1922 2.1922 2.5118 2.5118 2.5618 2.5618 2.5810 2.5810 3.2063 3.2063 3.2369 3.2369 3.4545 3.4545 3.8210 3.8210 3.8402 3.8402 3.9588 3.9588 3.9866 3.9866 4.1155 4.1155 4.1995 4.1995 4.2136 4.2136 4.4722 4.4722 4.5131 4.5131 4.7744 4.7744 4.8057 4.8057 4.9963 4.9963 5.5278 5.5278 5.5575 5.5575 7.6304 7.6304 8.2385 8.2385 8.3503 8.3503 8.4586 8.4586 8.4651 8.4651 9.7587 9.7587 11.2714 11.2714 k = 0.0000 0.4138-0.0000 ( 6495 PWs) bands (ev): -48.9716 -48.9716 -26.6277 -26.6277 -24.5557 -24.5557 -24.5537 -24.5537 -7.1071 -7.1071 -6.6582 -6.6582 -6.3740 -6.3740 -6.3530 -6.3530 0.5359 0.5359 0.9059 0.9059 1.3603 1.3603 1.7872 1.7872 2.0591 2.0591 2.0709 2.0709 2.1764 2.1764 2.4773 2.4773 2.5579 2.5579 2.5780 2.5780 3.2058 3.2058 3.2369 3.2369 3.4577 3.4577 3.8177 3.8177 3.8604 3.8604 3.9546 3.9546 3.9851 3.9851 4.1094 4.1094 4.1955 4.1955 4.2092 4.2092 4.4683 4.4683 4.5083 4.5083 4.7801 4.7801 4.8116 4.8116 4.9740 4.9740 5.5264 5.5264 5.5558 5.5558 7.6239 7.6239 8.2444 8.2444 8.3596 8.3596 8.4696 8.4696 8.4751 8.4751 9.8225 9.8225 11.2551 11.2551 k = 0.0000 0.4310-0.0000 ( 6467 PWs) bands (ev): -48.9714 -48.9714 -26.6277 -26.6277 -24.5558 -24.5558 -24.5537 -24.5537 -7.0951 -7.0951 -6.6710 -6.6710 -6.3740 -6.3740 -6.3530 -6.3530 0.5433 0.5433 0.9428 0.9428 1.3257 1.3257 1.8103 1.8103 2.0632 2.0632 2.0746 2.0746 2.1631 2.1631 2.4456 2.4456 2.5552 2.5552 2.5755 2.5755 3.2055 3.2055 3.2370 3.2370 3.4604 3.4604 3.8147 3.8147 3.8789 3.8789 3.9517 3.9517 3.9840 3.9840 4.1026 4.1026 4.1903 4.1903 4.2070 4.2070 4.4652 4.4652 4.5044 4.5044 4.7852 4.7852 4.8185 4.8185 4.9535 4.9535 5.5253 5.5253 5.5545 5.5545 7.6186 7.6186 8.2493 8.2493 8.3673 8.3673 8.4788 8.4788 8.4833 8.4833 9.8780 9.8780 11.2400 11.2400 k = 0.0000 0.4483-0.0000 ( 6472 PWs) bands (ev): -48.9715 -48.9715 -26.6277 -26.6277 -24.5558 -24.5558 -24.5537 -24.5537 -7.0851 -7.0851 -6.6817 -6.6817 -6.3739 -6.3739 -6.3530 -6.3530 0.5492 0.5492 0.9774 0.9774 1.2927 1.2927 1.8306 1.8306 2.0664 2.0664 2.0775 2.0775 2.1526 2.1526 2.4184 2.4184 2.5531 2.5531 2.5735 2.5735 3.2052 3.2052 3.2371 3.2371 3.4625 3.4625 3.8124 3.8124 3.8944 3.8944 3.9502 3.9502 3.9833 3.9833 4.0953 4.0953 4.1853 4.1853 4.2059 4.2059 4.4627 4.4627 4.5012 4.5012 4.7892 4.7892 4.8265 4.8265 4.9349 4.9349 5.5244 5.5244 5.5536 5.5536 7.6145 7.6145 8.2531 8.2531 8.3734 8.3734 8.4861 8.4861 8.4897 8.4897 9.9237 9.9237 11.2266 11.2266 k = 0.0000 0.4655-0.0000 ( 6472 PWs) bands (ev): -48.9714 -48.9714 -26.6277 -26.6277 -24.5558 -24.5558 -24.5537 -24.5537 -7.0775 -7.0775 -6.6898 -6.6898 -6.3739 -6.3739 -6.3530 -6.3530 0.5535 0.5535 1.0079 1.0079 1.2634 1.2634 1.8466 1.8466 2.0687 2.0687 2.0796 2.0796 2.1449 2.1449 2.3973 2.3973 2.5516 2.5516 2.5721 2.5721 3.2050 3.2050 3.2371 3.2371 3.4641 3.4641 3.8106 3.8106 3.9057 3.9057 3.9501 3.9501 3.9831 3.9831 4.0886 4.0886 4.1813 4.1813 4.2052 4.2052 4.4609 4.4609 4.4990 4.4990 4.7920 4.7920 4.8352 4.8352 4.9189 4.9189 5.5238 5.5238 5.5529 5.5529 7.6115 7.6115 8.2559 8.2559 8.3778 8.3778 8.4913 8.4913 8.4942 8.4942 9.9578 9.9578 11.2160 11.2160 k = 0.0000 0.4828-0.0000 ( 6480 PWs) bands (ev): -48.9715 -48.9715 -26.6277 -26.6277 -24.5559 -24.5559 -24.5537 -24.5537 -7.0727 -7.0727 -6.6948 -6.6948 -6.3739 -6.3739 -6.3530 -6.3530 0.5562 0.5562 1.0304 1.0304 1.2416 1.2416 1.8570 1.8570 2.0702 2.0702 2.0809 2.0809 2.1403 2.1403 2.3839 2.3839 2.5507 2.5507 2.5712 2.5712 3.2048 3.2048 3.2372 3.2372 3.4650 3.4650 3.8096 3.8096 3.9123 3.9123 3.9509 3.9509 3.9831 3.9831 4.0837 4.0837 4.1789 4.1789 4.2048 4.2048 4.4598 4.4598 4.4976 4.4976 4.7936 4.7936 4.8428 4.8428 4.9069 4.9069 5.5234 5.5234 5.5525 5.5525 7.6097 7.6097 8.2576 8.2576 8.3804 8.3804 8.4946 8.4946 8.4968 8.4968 9.9789 9.9789 11.2091 11.2091 k = 0.0000 0.5000-0.0000 ( 6480 PWs) bands (ev): -48.9715 -48.9715 -26.6277 -26.6277 -24.5559 -24.5559 -24.5537 -24.5537 -7.0711 -7.0711 -6.6965 -6.6965 -6.3739 -6.3739 -6.3530 -6.3530 0.5571 0.5571 1.0391 1.0391 1.2332 1.2332 1.8606 1.8606 2.0707 2.0707 2.0813 2.0813 2.1387 2.1387 2.3793 2.3793 2.5504 2.5504 2.5709 2.5709 3.2048 3.2048 3.2372 3.2372 3.4653 3.4653 3.8093 3.8093 3.9143 3.9143 3.9515 3.9515 3.9832 3.9832 4.0819 4.0819 4.1781 4.1781 4.2047 4.2047 4.4594 4.4594 4.4971 4.4971 4.7941 4.7941 4.8462 4.8462 4.9022 4.9022 5.5232 5.5232 5.5523 5.5523 7.6091 7.6091 8.2582 8.2582 8.3813 8.3813 8.4957 8.4957 8.4977 8.4977 9.9861 9.9861 11.2067 11.2067 k = 0.0000 0.5000-0.0000 ( 6480 PWs) bands (ev): -48.9715 -48.9715 -26.6277 -26.6277 -24.5559 -24.5559 -24.5537 -24.5537 -7.0711 -7.0711 -6.6965 -6.6965 -6.3739 -6.3739 -6.3530 -6.3530 0.5571 0.5571 1.0391 1.0391 1.2332 1.2332 1.8606 1.8606 2.0707 2.0707 2.0813 2.0813 2.1387 2.1387 2.3793 2.3793 2.5504 2.5504 2.5709 2.5709 3.2048 3.2048 3.2372 3.2372 3.4653 3.4653 3.8093 3.8093 3.9143 3.9143 3.9515 3.9515 3.9832 3.9832 4.0819 4.0819 4.1781 4.1781 4.2047 4.2047 4.4594 4.4594 4.4971 4.4971 4.7941 4.7941 4.8462 4.8462 4.9022 4.9022 5.5232 5.5232 5.5523 5.5523 7.6091 7.6091 8.2582 8.2582 8.3813 8.3813 8.4957 8.4957 8.4977 8.4977 9.9861 9.9861 11.2067 11.2067 k = 0.0172 0.5000-0.0000 ( 6480 PWs) bands (ev): -48.9715 -48.9715 -26.6277 -26.6277 -24.5559 -24.5559 -24.5537 -24.5537 -7.0707 -7.0706 -6.6966 -6.6960 -6.3747 -6.3738 -6.3534 -6.3533 0.5576 0.5582 1.0392 1.0392 1.2332 1.2332 1.8602 1.8612 2.0698 2.0712 2.0808 2.0814 2.1379 2.1396 2.3785 2.3800 2.5498 2.5502 2.5702 2.5709 3.2034 3.2036 3.2348 3.2368 3.4661 3.4661 3.8076 3.8102 3.9081 3.9193 3.9477 3.9517 3.9780 3.9938 4.0808 4.0829 4.1741 4.1808 4.1980 4.2158 4.4536 4.4623 4.4899 4.5029 4.7911 4.8010 4.8437 4.8488 4.8977 4.9077 5.5190 5.5258 5.5509 5.5520 7.6095 7.6116 8.2575 8.2611 8.3733 8.3837 8.4904 8.4950 8.4988 8.5082 9.9872 9.9880 11.2077 11.2097 k = 0.0345 0.5000-0.0000 ( 6482 PWs) bands (ev): -48.9715 -48.9715 -26.6277 -26.6277 -24.5559 -24.5559 -24.5537 -24.5537 -7.0692 -7.0692 -6.6964 -6.6950 -6.3761 -6.3744 -6.3544 -6.3543 0.5598 0.5609 1.0397 1.0397 1.2331 1.2331 1.8601 1.8621 2.0685 2.0713 2.0802 2.0813 2.1373 2.1406 2.3776 2.3806 2.5486 2.5492 2.5689 2.5704 3.1995 3.2000 3.2299 3.2336 3.4686 3.4686 3.8052 3.8103 3.9014 3.9224 3.9403 3.9507 3.9786 4.0069 4.0795 4.0844 4.1713 4.1773 4.2008 4.2288 4.4436 4.4632 4.4839 4.5055 4.7923 4.8095 4.8420 4.8520 4.8941 4.9150 5.5131 5.5267 5.5478 5.5500 7.6126 7.6169 8.2587 8.2662 8.3627 8.3794 8.4884 8.4912 8.5033 8.5248 9.9913 9.9928 11.2126 11.2166 k = 0.0517 0.5000-0.0000 ( 6474 PWs) bands (ev): -48.9715 -48.9715 -26.6277 -26.6277 -24.5559 -24.5559 -24.5537 -24.5537 -7.0669 -7.0667 -6.6957 -6.6937 -6.3782 -6.3756 -6.3560 -6.3558 0.5636 0.5653 1.0405 1.0405 1.2328 1.2329 1.8601 1.8632 2.0667 2.0705 2.0798 2.0813 2.1367 2.1417 2.3767 2.3811 2.5468 2.5473 2.5668 2.5696 3.1930 3.1941 3.2225 3.2276 3.4726 3.4727 3.8023 3.8097 3.8947 3.9217 3.9341 3.9498 3.9818 4.0202 4.0785 4.0868 4.1697 4.1705 4.2099 4.2431 4.4293 4.4625 4.4800 4.5047 4.7959 4.8168 4.8426 4.8564 4.8917 4.9250 5.5057 5.5260 5.5432 5.5463 7.6185 7.6249 8.2608 8.2729 8.3525 8.3708 8.4848 8.4857 8.5142 8.5443 9.9984 10.0005 11.2215 11.2274 k = 0.0690 0.5000-0.0000 ( 6470 PWs) bands (ev): -48.9714 -48.9714 -26.6278 -26.6277 -24.5559 -24.5559 -24.5538 -24.5538 -7.0635 -7.0634 -6.6947 -6.6920 -6.3809 -6.3776 -6.3581 -6.3580 0.5691 0.5714 1.0416 1.0417 1.2325 1.2325 1.8605 1.8645 2.0641 2.0685 2.0801 2.0814 2.1363 2.1429 2.3758 2.3816 2.5442 2.5443 2.5642 2.5685 3.1840 3.1860 3.2130 3.2190 3.4779 3.4781 3.7988 3.8085 3.8885 3.9155 3.9328 3.9492 3.9852 4.0319 4.0789 4.0903 4.1640 4.1695 4.2216 4.2583 4.4123 4.4599 4.4778 4.5012 4.7980 4.8204 4.8473 4.8622 4.8920 4.9390 5.4970 5.5236 5.5371 5.5412 7.6271 7.6356 8.2619 8.2799 8.3455 8.3617 8.4786 8.4791 8.5300 8.5653 10.0084 10.0112 11.2343 11.2419 k = 0.0862 0.5000-0.0000 ( 6462 PWs) bands (ev): -48.9714 -48.9714 -26.6278 -26.6278 -24.5559 -24.5559 -24.5538 -24.5538 -7.0593 -7.0591 -6.6932 -6.6899 -6.3843 -6.3804 -6.3608 -6.3606 0.5761 0.5789 1.0430 1.0431 1.2320 1.2321 1.8613 1.8662 2.0606 2.0653 2.0810 2.0819 2.1361 2.1441 2.3749 2.3820 2.5400 2.5409 2.5611 2.5673 3.1726 3.1758 3.2017 3.2079 3.4843 3.4846 3.7952 3.8067 3.8832 3.9080 3.9332 3.9489 3.9878 4.0398 4.0823 4.0948 4.1588 4.1707 4.2348 4.2743 4.3940 4.4546 4.4768 4.4967 4.7960 4.8202 4.8533 4.8678 4.8989 4.9576 5.4870 5.5197 5.5298 5.5350 7.6384 7.6489 8.2598 8.2844 8.3444 8.3560 8.4703 8.4718 8.5484 8.5871 10.0213 10.0247 11.2508 11.2598 k = 0.1034 0.5000-0.0000 ( 6458 PWs) bands (ev): -48.9714 -48.9714 -26.6278 -26.6278 -24.5559 -24.5559 -24.5538 -24.5538 -7.0541 -7.0539 -6.6914 -6.6874 -6.3885 -6.3841 -6.3640 -6.3635 0.5847 0.5880 1.0447 1.0448 1.2313 1.2313 1.8624 1.8683 2.0564 2.0612 2.0824 2.0828 2.1361 2.1455 2.3740 2.3823 2.5345 2.5366 2.5578 2.5660 3.1589 3.1638 3.1887 3.1946 3.4914 3.4920 3.7915 3.8045 3.8790 3.9011 3.9338 3.9489 3.9896 4.0427 4.0890 4.0997 4.1555 4.1734 4.2490 4.2906 4.3752 4.4462 4.4767 4.4929 4.7906 4.8170 4.8550 4.8720 4.9163 4.9804 5.4760 5.5139 5.5218 5.5284 7.6521 7.6646 8.2536 8.2831 8.3497 8.3575 8.4613 8.4640 8.5680 8.6093 10.0371 10.0411 11.2706 11.2805 k = 0.1207 0.5000-0.0000 ( 6458 PWs) bands (ev): -48.9714 -48.9714 -26.6278 -26.6278 -24.5560 -24.5560 -24.5539 -24.5539 -7.0480 -7.0478 -6.6892 -6.6846 -6.3934 -6.3888 -6.3677 -6.3667 0.5947 0.5986 1.0466 1.0467 1.2304 1.2304 1.8642 1.8710 2.0514 2.0565 2.0839 2.0840 2.1364 2.1470 2.3732 2.3827 2.5278 2.5312 2.5544 2.5646 3.1432 3.1500 3.1744 3.1793 3.4990 3.4999 3.7880 3.8021 3.8759 3.8954 3.9341 3.9490 3.9906 4.0421 4.0966 4.1042 4.1553 4.1778 4.2639 4.3069 4.3566 4.4350 4.4773 4.4902 4.7830 4.8117 4.8521 4.8742 4.9418 5.0061 5.4639 5.5056 5.5136 5.5224 7.6682 7.6827 8.2443 8.2759 8.3595 8.3651 8.4530 8.4571 8.5884 8.6316 10.0556 10.0602 11.2928 11.3024 k = 0.1379 0.5000-0.0000 ( 6462 PWs) bands (ev): -48.9714 -48.9714 -26.6279 -26.6278 -24.5560 -24.5560 -24.5540 -24.5540 -7.0411 -7.0408 -6.6866 -6.6814 -6.3990 -6.3943 -6.3717 -6.3701 0.6060 0.6105 1.0487 1.0488 1.2291 1.2291 1.8665 1.8742 2.0460 2.0512 2.0855 2.0856 2.1371 2.1486 2.3726 2.3831 2.5201 2.5245 2.5512 2.5631 3.1256 3.1345 3.1588 3.1623 3.5069 3.5081 3.7849 3.7998 3.8739 3.8910 3.9343 3.9492 3.9911 4.0398 4.1016 4.1074 4.1597 4.1837 4.2789 4.3225 4.3394 4.4220 4.4787 4.4885 4.7740 4.8048 4.8466 4.8745 4.9715 5.0334 5.4510 5.4949 5.5059 5.5176 7.6866 7.7030 8.2335 8.2654 8.3697 8.3737 8.4480 8.4543 8.6089 8.6536 10.0770 10.0821 11.3157 11.3221 k = 0.1552 0.5000-0.0000 ( 6470 PWs) bands (ev): -48.9714 -48.9714 -26.6279 -26.6279 -24.5560 -24.5560 -24.5540 -24.5540 -7.0333 -7.0330 -6.6837 -6.6779 -6.4055 -6.4009 -6.3761 -6.3738 0.6187 0.6237 1.0510 1.0510 1.2274 1.2275 1.8695 1.8780 2.0402 2.0457 2.0872 2.0872 2.1381 2.1504 2.3722 2.3835 2.5113 2.5166 2.5482 2.5616 3.1063 3.1176 3.1421 3.1439 3.5149 3.5165 3.7823 3.7979 3.8730 3.8877 3.9344 3.9494 3.9915 4.0368 4.1028 4.1092 4.1687 4.1906 4.2935 4.3212 4.3398 4.4084 4.4810 4.4874 4.7641 4.7965 4.8395 4.8731 5.0033 5.0611 5.4372 5.4820 5.4997 5.5144 7.7070 7.7253 8.2223 8.2537 8.3748 8.3769 8.4508 8.4600 8.6293 8.6752 10.1010 10.1065 11.3336 11.3343 k = 0.1724 0.5000-0.0000 ( 6480 PWs) bands (ev): -48.9715 -48.9715 -26.6279 -26.6279 -24.5561 -24.5561 -24.5541 -24.5541 -7.0248 -7.0244 -6.6805 -6.6741 -6.4128 -6.4083 -6.3807 -6.3776 0.6326 0.6380 1.0534 1.0534 1.2252 1.2254 1.8734 1.8826 2.0343 2.0400 2.0887 2.0890 2.1397 2.1524 2.3719 2.3841 2.5015 2.5075 2.5454 2.5599 3.0858 3.0993 3.1242 3.1244 3.5229 3.5248 3.7803 3.7966 3.8733 3.8855 3.9343 3.9495 3.9919 4.0337 4.1014 4.1095 4.1809 4.1972 4.3065 4.3074 4.3541 4.3956 4.4842 4.4867 4.7535 4.7870 4.8311 4.8699 5.0354 5.0878 5.4224 5.4676 5.4961 5.5130 7.7293 7.7493 8.2113 8.2418 8.3714 8.3723 8.4642 8.4755 8.6494 8.6962 10.1275 10.1335 11.3328 11.3411 k = 0.1897 0.5000-0.0000 ( 6488 PWs) bands (ev): -48.9715 -48.9715 -26.6280 -26.6280 -24.5561 -24.5561 -24.5542 -24.5542 -7.0154 -7.0150 -6.6769 -6.6700 -6.4209 -6.4165 -6.3855 -6.3817 0.6476 0.6535 1.0559 1.0560 1.2224 1.2227 1.8782 1.8882 2.0284 2.0344 2.0901 2.0908 2.1417 2.1546 2.3720 2.3848 2.4908 2.4973 2.5428 2.5581 3.0642 3.0797 3.1036 3.1056 3.5307 3.5328 3.7790 3.7960 3.8745 3.8843 3.9342 3.9496 3.9926 4.0308 4.0984 4.1086 4.1948 4.2021 4.2967 4.3161 4.3675 4.3860 4.4862 4.4885 4.7425 4.7766 4.8215 4.8650 5.0667 5.1124 5.4067 5.4518 5.4962 5.5141 7.7533 7.7750 8.2009 8.2304 8.3620 8.3623 8.4852 8.4979 8.6690 8.7164 10.1565 10.1628 11.3219 11.3342 k = 0.2069 0.5000-0.0000 ( 6492 PWs) bands (ev): -48.9715 -48.9715 -26.6280 -26.6280 -24.5562 -24.5562 -24.5542 -24.5542 -7.0054 -7.0049 -6.6731 -6.6656 -6.4297 -6.4255 -6.3906 -6.3860 0.6635 0.6699 1.0586 1.0586 1.2191 1.2195 1.8841 1.8947 2.0226 2.0289 2.0913 2.0927 2.1444 2.1571 2.3723 2.3857 2.4793 2.4861 2.5403 2.5562 3.0419 3.0592 3.0821 3.0859 3.5380 3.5404 3.7783 3.7964 3.8768 3.8838 3.9340 3.9495 3.9935 4.0281 4.0949 4.1068 4.2033 4.2094 4.2910 4.3186 4.3796 4.3830 4.4858 4.4937 4.7311 4.7653 4.8110 4.8585 5.0961 5.1341 5.3902 5.4351 5.5009 5.5181 7.7787 7.8019 8.1912 8.2197 8.3498 8.3498 8.5107 8.5242 8.6880 8.7357 10.1879 10.1944 11.3038 11.3174 k = 0.2241 0.5000-0.0000 ( 6484 PWs) bands (ev): -48.9715 -48.9715 -26.6281 -26.6281 -24.5562 -24.5562 -24.5543 -24.5543 -6.9947 -6.9942 -6.6689 -6.6610 -6.4393 -6.4352 -6.3958 -6.3906 0.6804 0.6872 1.0612 1.0613 1.2151 1.2157 1.8912 1.9023 2.0172 2.0237 2.0922 2.0945 2.1475 2.1598 2.3729 2.3867 2.4670 2.4740 2.5381 2.5542 3.0191 3.0378 3.0598 3.0653 3.5450 3.5475 3.7784 3.7978 3.8800 3.8839 3.9339 3.9491 3.9947 4.0259 4.0913 4.1043 4.1998 4.2242 4.2913 4.3128 4.3881 4.3902 4.4856 4.4999 4.7195 4.7534 4.7994 4.8503 5.1226 5.1520 5.3731 5.4176 5.5107 5.5257 7.8053 7.8298 8.1824 8.2097 8.3362 8.3365 8.5385 8.5525 8.7063 8.7541 10.2214 10.2282 11.2801 11.2937 k = 0.2414 0.5000-0.0000 ( 6472 PWs) bands (ev): -48.9714 -48.9714 -26.6281 -26.6281 -24.5563 -24.5563 -24.5544 -24.5544 -6.9833 -6.9828 -6.6645 -6.6562 -6.4495 -6.4456 -6.4012 -6.3953 0.6980 0.7052 1.0638 1.0640 1.2103 1.2111 1.8995 1.9110 2.0122 2.0190 2.0930 2.0961 2.1512 2.1629 2.3738 2.3880 2.4540 2.4612 2.5360 2.5522 2.9960 3.0159 3.0370 3.0438 3.5515 3.5540 3.7791 3.8003 3.8840 3.8846 3.9339 3.9483 3.9963 4.0243 4.0878 4.1012 4.1924 4.2388 4.2965 4.3017 4.3982 4.3994 4.4856 4.5068 4.7079 4.7409 4.7869 4.8404 5.1456 5.1659 5.3558 5.3996 5.5256 5.5372 7.8328 7.8585 8.1745 8.2005 8.3224 8.3230 8.5677 8.5819 8.7238 8.7713 10.2570 10.2639 11.2515 11.2646 k = 0.2586 0.5000-0.0000 ( 6464 PWs) bands (ev): -48.9714 -48.9714 -26.6281 -26.6281 -24.5563 -24.5563 -24.5544 -24.5544 -6.9714 -6.9709 -6.6599 -6.6512 -6.4603 -6.4565 -6.4067 -6.4002 0.7163 0.7238 1.0664 1.0666 1.2048 1.2058 1.9091 1.9210 2.0078 2.0148 2.0937 2.0977 2.1554 2.1662 2.3750 2.3894 2.4403 2.4475 2.5341 2.5501 2.9728 2.9936 3.0137 3.0218 3.5574 3.5598 3.7805 3.8038 3.8856 3.8886 3.9340 3.9472 3.9982 4.0233 4.0846 4.0976 4.1829 4.2526 4.2887 4.3048 4.4073 4.4103 4.4856 4.5139 4.6963 4.7280 4.7736 4.8290 5.1647 5.1761 5.3384 5.3814 5.5449 5.5527 7.8609 7.8876 8.1674 8.1922 8.3090 8.3099 8.5974 8.6117 8.7404 8.7874 10.2944 10.3014 11.2190 11.2311 k = 0.2759 0.5000-0.0000 ( 6472 PWs) bands (ev): -48.9714 -48.9714 -26.6282 -26.6282 -24.5564 -24.5564 -24.5545 -24.5545 -6.9591 -6.9585 -6.6552 -6.6461 -6.4716 -6.4680 -6.4122 -6.4053 0.7350 0.7428 1.0689 1.0691 1.1984 1.1996 1.9200 1.9322 2.0041 2.0111 2.0943 2.0990 2.1598 2.1698 2.3765 2.3908 2.4260 2.4332 2.5323 2.5479 2.9498 2.9711 2.9900 2.9991 3.5628 3.5650 3.7824 3.8081 3.8868 3.8935 3.9341 3.9455 4.0004 4.0231 4.0818 4.0936 4.1726 4.2615 4.2794 4.3150 4.4143 4.4227 4.4858 4.5208 4.6847 4.7148 4.7596 4.8161 5.1797 5.1831 5.3214 5.3632 5.5679 5.5717 7.8894 7.9168 8.1612 8.1846 8.2963 8.2976 8.6272 8.6414 8.7560 8.8021 10.3335 10.3405 11.1831 11.1941 k = 0.2931 0.5000-0.0000 ( 6462 PWs) bands (ev): -48.9714 -48.9714 -26.6282 -26.6282 -24.5565 -24.5565 -24.5545 -24.5545 -6.9463 -6.9458 -6.6502 -6.6410 -6.4833 -6.4798 -6.4179 -6.4106 0.7541 0.7621 1.0713 1.0716 1.1911 1.1926 1.9323 1.9447 2.0013 2.0083 2.0949 2.1003 2.1646 2.1737 2.3783 2.3920 2.4111 2.4186 2.5307 2.5457 2.9272 2.9487 2.9663 2.9762 3.5676 3.5695 3.7849 3.8132 3.8880 3.8987 3.9344 3.9434 4.0030 4.0239 4.0794 4.0895 4.1624 4.2532 4.2868 4.3261 4.4206 4.4348 4.4864 4.5270 4.6734 4.7015 4.7451 4.8020 5.1878 5.1911 5.3050 5.3452 5.5933 5.5938 7.9179 7.9457 8.1558 8.1778 8.2846 8.2863 8.6567 8.6704 8.7707 8.8155 10.3741 10.3810 11.1448 11.1545 k = 0.3103 0.5000-0.0000 ( 6462 PWs) bands (ev): -48.9714 -48.9714 -26.6283 -26.6283 -24.5565 -24.5565 -24.5546 -24.5546 -6.9332 -6.9327 -6.6452 -6.6358 -6.4954 -6.4920 -6.4235 -6.4159 0.7734 0.7816 1.0736 1.0738 1.1830 1.1849 1.9457 1.9582 1.9995 2.0063 2.0954 2.1013 2.1696 2.1777 2.3803 2.3916 2.3957 2.4052 2.5293 2.5435 2.9052 2.9264 2.9427 2.9531 3.5718 3.5734 3.7880 3.8189 3.8891 3.9038 3.9347 3.9409 4.0062 4.0257 4.0774 4.0851 4.1529 4.2388 4.3000 4.3376 4.4266 4.4460 4.4873 4.5321 4.6624 4.6883 4.7301 4.7869 5.1907 5.1993 5.2895 5.3277 5.6179 5.6201 7.9460 7.9739 8.1513 8.1717 8.2740 8.2761 8.6853 8.6985 8.7844 8.8274 10.4159 10.4227 11.1050 11.1134 k = 0.3276 0.5000-0.0000 ( 6470 PWs) bands (ev): -48.9714 -48.9714 -26.6283 -26.6283 -24.5566 -24.5566 -24.5546 -24.5546 -6.9200 -6.9194 -6.6402 -6.6306 -6.5077 -6.5043 -6.4290 -6.4214 0.7928 0.8011 1.0757 1.0760 1.1742 1.1763 1.9599 1.9724 1.9990 2.0056 2.0960 2.1022 2.1746 2.1818 2.3789 2.3823 2.3834 2.4000 2.5281 2.5414 2.8839 2.9043 2.9198 2.9301 3.5755 3.5767 3.7916 3.8250 3.8899 3.9085 3.9351 3.9380 4.0098 4.0286 4.0759 4.0807 4.1443 4.2237 4.3138 4.3492 4.4325 4.4556 4.4891 4.5355 4.6519 4.6754 4.7148 4.7709 5.1925 5.2050 5.2751 5.3108 5.6431 5.6472 7.9735 8.0011 8.1474 8.1663 8.2648 8.2673 8.7128 8.7252 8.7971 8.8380 10.4587 10.4653 11.0645 11.0717 k = 0.3448 0.5000-0.0000 ( 6470 PWs) bands (ev): -48.9714 -48.9714 -26.6283 -26.6283 -24.5567 -24.5567 -24.5547 -24.5547 -6.9067 -6.9061 -6.6352 -6.6256 -6.5200 -6.5167 -6.4345 -6.4268 0.8122 0.8204 1.0777 1.0779 1.1645 1.1670 1.9735 1.9856 2.0013 2.0079 2.0967 2.1030 2.1796 2.1859 2.3627 2.3666 2.3855 2.4007 2.5271 2.5394 2.8635 2.8825 2.8979 2.9076 3.5788 3.5795 3.7957 3.8312 3.8902 3.9125 3.9349 3.9355 4.0140 4.0325 4.0747 4.0765 4.1366 4.2085 4.3276 4.3607 4.4386 4.4632 4.4922 4.5370 4.6420 4.6631 4.6994 4.7544 5.1935 5.2088 5.2621 5.2948 5.6684 5.6737 7.9999 8.0269 8.1442 8.1614 8.2570 8.2598 8.7388 8.7502 8.8089 8.8471 10.5023 10.5087 11.0245 11.0305 k = 0.3621 0.5000-0.0000 ( 6460 PWs) bands (ev): -48.9713 -48.9713 -26.6284 -26.6284 -24.5567 -24.5567 -24.5547 -24.5547 -6.8934 -6.8929 -6.6304 -6.6209 -6.5322 -6.5290 -6.4397 -6.4321 0.8313 0.8394 1.0794 1.0796 1.1543 1.1571 1.9831 1.9933 2.0096 2.0173 2.0974 2.1036 2.1845 2.1900 2.3456 2.3495 2.3881 2.4023 2.5265 2.5374 2.8444 2.8612 2.8775 2.8859 3.5816 3.5820 3.8003 3.8374 3.8901 3.9156 3.9320 3.9359 4.0188 4.0372 4.0727 4.0740 4.1301 4.1934 4.3415 4.3721 4.4451 4.4681 4.4970 4.5363 4.6328 4.6516 4.6842 4.7376 5.1942 5.2111 5.2507 5.2799 5.6932 5.6990 8.0249 8.0508 8.1417 8.1571 8.2507 8.2536 8.7630 8.7732 8.8196 8.8547 10.5462 10.5524 10.9857 10.9906 k = 0.3793 0.5000-0.0000 ( 6456 PWs) bands (ev): -48.9713 -48.9713 -26.6284 -26.6284 -24.5568 -24.5568 -24.5547 -24.5547 -6.8805 -6.8799 -6.6259 -6.6166 -6.5440 -6.5408 -6.4447 -6.4373 0.8500 0.8579 1.0809 1.0811 1.1436 1.1467 1.9875 1.9958 2.0247 2.0334 2.0982 2.1040 2.1892 2.1939 2.3279 2.3316 2.3909 2.4040 2.5260 2.5356 2.8266 2.8408 2.8588 2.8654 3.5839 3.5840 3.8053 3.8433 3.8894 3.9170 3.9300 3.9362 4.0244 4.0426 4.0693 4.0736 4.1243 4.1786 4.3552 4.3829 4.4522 4.4706 4.5032 4.5331 4.6246 4.6413 4.6693 4.7208 5.1946 5.2123 5.2409 5.2662 5.7165 5.7224 8.0481 8.0725 8.1398 8.1533 8.2457 8.2488 8.7852 8.7939 8.8294 8.8608 10.5902 10.5960 10.9491 10.9531 k = 0.3966 0.5000-0.0000 ( 6468 PWs) bands (ev): -48.9714 -48.9714 -26.6284 -26.6284 -24.5568 -24.5568 -24.5547 -24.5547 -6.8681 -6.8675 -6.6217 -6.6129 -6.5551 -6.5520 -6.4492 -6.4424 0.8681 0.8756 1.0822 1.0823 1.1327 1.1360 1.9898 1.9968 2.0435 2.0522 2.0990 2.1044 2.1936 2.1975 2.3096 2.3131 2.3937 2.4055 2.5257 2.5340 2.8104 2.8216 2.8419 2.8466 3.5857 3.5858 3.8107 3.8486 3.8882 3.9160 3.9295 3.9363 4.0306 4.0481 4.0666 4.0737 4.1193 4.1641 4.3689 4.3933 4.4599 4.4711 4.5099 4.5275 4.6175 4.6323 4.6551 4.7042 5.1950 5.2128 5.2328 5.2537 5.7378 5.7435 8.0692 8.0916 8.1384 8.1499 8.2421 8.2451 8.8051 8.8121 8.8383 8.8656 10.6337 10.6392 10.9155 10.9186 k = 0.4138 0.5000-0.0000 ( 6462 PWs) bands (ev): -48.9713 -48.9713 -26.6284 -26.6284 -24.5569 -24.5569 -24.5548 -24.5548 -6.8564 -6.8560 -6.6183 -6.6102 -6.5650 -6.5621 -6.4532 -6.4470 0.8852 0.8923 1.0831 1.0831 1.1219 1.1254 1.9914 1.9974 2.0641 2.0723 2.0998 2.1046 2.1976 2.2008 2.2908 2.2941 2.3966 2.4068 2.5257 2.5325 2.7960 2.8043 2.8271 2.8299 3.5872 3.5874 3.8164 3.8530 3.8870 3.9133 3.9302 3.9363 4.0375 4.0531 4.0648 4.0747 4.1149 4.1499 4.3824 4.4030 4.4684 4.4704 4.5163 4.5195 4.6118 4.6246 4.6421 4.6882 5.1954 5.2128 5.2264 5.2427 5.7568 5.7618 8.0878 8.1077 8.1376 8.1470 8.2397 8.2426 8.8224 8.8276 8.8464 8.8690 10.6761 10.6811 10.8857 10.8881 k = 0.4310 0.5000-0.0000 ( 6466 PWs) bands (ev): -48.9714 -48.9714 -26.6285 -26.6285 -24.5569 -24.5569 -24.5548 -24.5548 -6.8460 -6.8456 -6.6157 -6.6088 -6.5731 -6.5706 -6.4566 -6.4513 0.9011 0.9074 1.0835 1.0835 1.1118 1.1152 1.9929 1.9978 2.0855 2.0930 2.1008 2.1047 2.2010 2.2035 2.2714 2.2747 2.3993 2.4078 2.5259 2.5313 2.7836 2.7893 2.8145 2.8158 3.5883 3.5886 3.8224 3.8558 3.8861 3.9098 3.9314 3.9362 4.0451 4.0571 4.0637 4.0768 4.1108 4.1362 4.3958 4.4119 4.4685 4.4775 4.5098 4.5216 4.6075 4.6182 4.6309 4.6728 5.1960 5.2123 5.2216 5.2331 5.7728 5.7771 8.1036 8.1205 8.1372 8.1445 8.2384 8.2409 8.8371 8.8401 8.8537 8.8710 10.7164 10.7209 10.8604 10.8622 k = 0.4483 0.5000-0.0000 ( 6470 PWs) bands (ev): -48.9714 -48.9714 -26.6285 -26.6285 -24.5570 -24.5570 -24.5548 -24.5548 -6.8371 -6.8368 -6.6144 -6.6090 -6.5788 -6.5770 -6.4592 -6.4550 0.9151 0.9204 1.0832 1.0833 1.1032 1.1062 1.9943 1.9980 2.1013 2.1041 2.1078 2.1142 2.2039 2.2057 2.2518 2.2551 2.4017 2.4084 2.5262 2.5302 2.7735 2.7771 2.8043 2.8045 3.5893 3.5895 3.8285 3.8565 3.8862 3.9058 3.9324 3.9360 4.0529 4.0595 4.0638 4.0801 4.1069 4.1230 4.4089 4.4201 4.4660 4.4867 4.4991 4.5250 4.6044 4.6129 4.6230 4.6585 5.1970 5.2114 5.2182 5.2252 5.7858 5.7891 8.1165 8.1300 8.1372 8.1423 8.2379 8.2399 8.8490 8.8499 8.8599 8.8717 10.7531 10.7569 10.8402 10.8414 k = 0.4655 0.5000-0.0000 ( 6468 PWs) bands (ev): -48.9714 -48.9714 -26.6285 -26.6285 -24.5570 -24.5570 -24.5548 -24.5548 -6.8303 -6.8300 -6.6141 -6.6107 -6.5819 -6.5810 -6.4609 -6.4580 0.9265 0.9304 1.0819 1.0821 1.0974 1.0995 1.9955 1.9980 2.1022 2.1043 2.1287 2.1344 2.2061 2.2072 2.2325 2.2358 2.4040 2.4085 2.5266 2.5292 2.7661 2.7681 2.7965 2.7967 3.5899 3.5901 3.8347 3.8548 3.8878 3.9018 3.9334 3.9357 4.0587 4.0607 4.0671 4.0843 4.1029 4.1104 4.4211 4.4273 4.4633 4.4857 4.4982 4.5254 4.6025 4.6085 4.6194 4.6456 5.1986 5.2098 5.2161 5.2194 5.7953 5.7976 8.1261 8.1360 8.1378 8.1405 8.2380 8.2393 8.8573 8.8579 8.8645 8.8713 10.7838 10.7866 10.8255 10.8262 k = 0.4828 0.5000-0.0000 ( 6476 PWs) bands (ev): -48.9714 -48.9714 -26.6285 -26.6285 -24.5570 -24.5570 -24.5548 -24.5548 -6.8259 -6.8258 -6.6143 -6.6127 -6.5833 -6.5830 -6.4617 -6.4602 0.9345 0.9366 1.0799 1.0803 1.0947 1.0957 1.9965 1.9978 2.1029 2.1039 2.1477 2.1516 2.2076 2.2079 2.2155 2.2184 2.4058 2.4081 2.5271 2.5284 2.7615 2.7624 2.7917 2.7920 3.5904 3.5905 3.8407 3.8512 3.8906 3.8979 3.9341 3.9353 4.0604 4.0611 4.0754 4.0882 4.0989 4.0989 4.4310 4.4329 4.4620 4.4747 4.5074 4.5222 4.6018 4.6051 4.6205 4.6345 5.2008 5.2070 5.2151 5.2161 5.8014 5.8025 8.1324 8.1376 8.1389 8.1402 8.2383 8.2390 8.8628 8.8639 8.8670 8.8697 10.8050 10.8063 10.8168 10.8169 k = 0.5000 0.5000-0.0000 ( 6496 PWs) bands (ev): -48.9715 -48.9715 -26.6285 -26.6285 -24.5570 -24.5570 -24.5548 -24.5548 -6.8244 -6.8244 -6.6139 -6.6139 -6.5836 -6.5836 -6.4614 -6.4614 0.9380 0.9380 1.0792 1.0792 1.0943 1.0943 1.9973 1.9973 2.1034 2.1034 2.1584 2.1584 2.2076 2.2076 2.2090 2.2090 2.4072 2.4072 2.5277 2.5277 2.7602 2.7602 2.7902 2.7902 3.5905 3.5905 3.8463 3.8463 3.8940 3.8940 3.9347 3.9347 4.0609 4.0609 4.0851 4.0851 4.0952 4.0952 4.4351 4.4351 4.4656 4.4656 4.5158 4.5158 4.6027 4.6027 4.6258 4.6258 5.2037 5.2037 5.2150 5.2150 5.8038 5.8038 8.1358 8.1358 8.1402 8.1402 8.2386 8.2386 8.8668 8.8668 8.8669 8.8669 10.8117 10.8117 10.8153 10.8153 k = 0.5000 0.5000-0.0000 ( 6496 PWs) bands (ev): -48.9715 -48.9715 -26.6285 -26.6285 -24.5570 -24.5570 -24.5548 -24.5548 -6.8244 -6.8244 -6.6139 -6.6139 -6.5836 -6.5836 -6.4614 -6.4614 0.9380 0.9380 1.0792 1.0792 1.0943 1.0943 1.9973 1.9973 2.1034 2.1034 2.1584 2.1584 2.2076 2.2076 2.2090 2.2090 2.4072 2.4072 2.5277 2.5277 2.7602 2.7602 2.7902 2.7902 3.5905 3.5905 3.8463 3.8463 3.8940 3.8940 3.9347 3.9347 4.0609 4.0609 4.0851 4.0851 4.0952 4.0952 4.4351 4.4351 4.4656 4.4656 4.5158 4.5158 4.6027 4.6027 4.6258 4.6258 5.2037 5.2037 5.2150 5.2150 5.8038 5.8038 8.1358 8.1358 8.1402 8.1402 8.2386 8.2386 8.8668 8.8668 8.8669 8.8669 10.8117 10.8117 10.8153 10.8153 k = 0.4878 0.4878-0.0000 ( 6478 PWs) bands (ev): -48.9714 -48.9714 -26.6285 -26.6285 -24.5570 -24.5570 -24.5548 -24.5548 -6.8259 -6.8258 -6.6142 -6.6127 -6.5833 -6.5831 -6.4617 -6.4602 0.9345 0.9366 1.0796 1.0802 1.0949 1.0959 1.9965 1.9978 2.1029 2.1039 2.1476 2.1515 2.2084 2.2091 2.2144 2.2176 2.4058 2.4081 2.5271 2.5284 2.7616 2.7623 2.7918 2.7919 3.5903 3.5905 3.8407 3.8512 3.8905 3.8979 3.9341 3.9353 4.0604 4.0611 4.0753 4.0903 4.0938 4.1022 4.4318 4.4320 4.4622 4.4745 4.5074 4.5222 4.6018 4.6051 4.6205 4.6345 5.2007 5.2071 5.2152 5.2160 5.8014 5.8025 8.1328 8.1372 8.1390 8.1402 8.2383 8.2390 8.8617 8.8658 8.8667 8.8691 10.8032 10.8047 10.8186 10.8187 k = 0.4756 0.4756-0.0000 ( 6472 PWs) bands (ev): -48.9714 -48.9714 -26.6285 -26.6285 -24.5570 -24.5570 -24.5548 -24.5548 -6.8303 -6.8301 -6.6134 -6.6104 -6.5822 -6.5816 -6.4610 -6.4580 0.9267 0.9306 1.0785 1.0799 1.1001 1.1021 1.9955 1.9980 2.1022 2.1042 2.1281 2.1336 2.2096 2.2114 2.2285 2.2325 2.4045 2.4092 2.5266 2.5292 2.7663 2.7668 2.7967 2.7972 3.5899 3.5901 3.8347 3.8551 3.8872 3.9022 3.9334 3.9356 4.0589 4.0610 4.0668 4.0895 4.0926 4.1154 4.4220 4.4259 4.4646 4.4850 4.4982 4.5254 4.6021 4.6089 4.6194 4.6454 5.1984 5.2105 5.2170 5.2180 5.7954 5.7976 8.1285 8.1346 8.1386 8.1389 8.2379 8.2393 8.8538 8.8633 8.8652 8.8687 10.7767 10.7798 10.8329 10.8334 k = 0.4634 0.4634-0.0000 ( 6470 PWs) bands (ev): -48.9714 -48.9714 -26.6285 -26.6285 -24.5570 -24.5570 -24.5548 -24.5548 -6.8374 -6.8372 -6.6116 -6.6074 -6.5802 -6.5793 -6.4593 -6.4549 0.9157 0.9210 1.0737 1.0755 1.1117 1.1139 1.9942 1.9979 2.1012 2.1043 2.1059 2.1121 2.2120 2.2148 2.2424 2.2466 2.4045 2.4118 2.5262 2.5301 2.7727 2.7737 2.8046 2.8071 3.5893 3.5895 3.8286 3.8579 3.8839 3.9067 3.9326 3.9358 4.0545 4.0605 4.0621 4.0870 4.0916 4.1307 4.4095 4.4185 4.4691 4.4862 4.4979 4.5250 4.6038 4.6140 4.6227 4.6582 5.1967 5.2135 5.2206 5.2208 5.7859 5.7893 8.1230 8.1297 8.1353 8.1383 8.2377 8.2396 8.8432 8.8593 8.8625 8.8657 10.7383 10.7422 10.8567 10.8575 k = 0.4512 0.4512-0.0000 ( 6462 PWs) bands (ev): -48.9713 -48.9713 -26.6285 -26.6285 -24.5569 -24.5569 -24.5548 -24.5548 -6.8470 -6.8467 -6.6090 -6.6038 -6.5775 -6.5761 -6.4567 -6.4510 0.9025 0.9089 1.0658 1.0678 1.1277 1.1297 1.9927 1.9976 2.0819 2.0886 2.1008 2.1048 2.2155 2.2194 2.2528 2.2572 2.4077 2.4177 2.5259 2.5312 2.7791 2.7827 2.8160 2.8213 3.5884 3.5887 3.8226 3.8596 3.8804 3.9110 3.9316 3.9357 4.0484 4.0596 4.0598 4.0834 4.0914 4.1473 4.3961 4.4104 4.4740 4.4770 4.5076 4.5215 4.6067 4.6203 4.6301 4.6723 5.1957 5.2165 5.2246 5.2256 5.7733 5.7776 8.1163 8.1232 8.1304 8.1366 8.2379 8.2402 8.8299 8.8533 8.8584 8.8605 10.6915 10.6959 10.8892 10.8905 k = 0.4390 0.4390-0.0000 ( 6450 PWs) bands (ev): -48.9713 -48.9713 -26.6284 -26.6284 -24.5569 -24.5569 -24.5548 -24.5548 -6.8586 -6.8583 -6.6056 -6.5996 -6.5741 -6.5722 -6.4533 -6.4465 0.8878 0.8950 1.0553 1.0576 1.1467 1.1483 1.9909 1.9970 2.0576 2.0646 2.1001 2.1048 2.2202 2.2251 2.2584 2.2629 2.4158 2.4283 2.5258 2.5325 2.7861 2.7924 2.8309 2.8392 3.5874 3.5875 3.8169 3.8605 3.8770 3.9149 3.9304 3.9353 4.0430 4.0572 4.0579 4.0795 4.0930 4.1652 4.3824 4.4015 4.4678 4.4786 4.5158 4.5167 4.6107 4.6276 4.6405 4.6875 5.1952 5.2202 5.2291 5.2313 5.7579 5.7632 8.1084 8.1153 8.1239 8.1336 8.2384 8.2410 8.8143 8.8450 8.8530 8.8537 10.6388 10.6435 10.9295 10.9315 k = 0.4268 0.4268-0.0000 ( 6462 PWs) bands (ev): -48.9713 -48.9713 -26.6284 -26.6284 -24.5568 -24.5568 -24.5548 -24.5547 -6.8720 -6.8718 -6.6016 -6.5950 -6.5700 -6.5676 -6.4493 -6.4414 0.8721 0.8799 1.0424 1.0450 1.1678 1.1689 1.9891 1.9962 2.0328 2.0400 2.0995 2.1048 2.2258 2.2319 2.2594 2.2637 2.4291 2.4439 2.5258 2.5340 2.7938 2.8025 2.8487 2.8597 3.5860 3.5861 3.8115 3.8607 3.8733 3.9178 3.9290 3.9341 4.0386 4.0536 4.0547 4.0759 4.0971 4.1839 4.3687 4.3919 4.4594 4.4828 4.5090 4.5246 4.6157 4.6356 4.6530 4.7035 5.1952 5.2247 5.2342 5.2372 5.7402 5.7462 8.0995 8.1061 8.1160 8.1294 8.2395 8.2423 8.7965 8.8339 8.8458 8.8461 10.5818 10.5866 10.9766 10.9795 k = 0.4146 0.4146-0.0000 ( 6446 PWs) bands (ev): -48.9713 -48.9713 -26.6284 -26.6284 -24.5568 -24.5568 -24.5547 -24.5547 -6.8870 -6.8869 -6.5969 -6.5900 -6.5654 -6.5624 -6.4447 -6.4360 0.8556 0.8639 1.0275 1.0302 1.1907 1.1913 1.9870 1.9951 2.0076 2.0148 2.0992 2.1047 2.2326 2.2398 2.2572 2.2610 2.4470 2.4639 2.5261 2.5358 2.8023 2.8130 2.8686 2.8819 3.5842 3.5847 3.8064 3.8606 3.8698 3.9197 3.9272 3.9319 4.0353 4.0493 4.0497 4.0737 4.1040 4.2035 4.3552 4.3818 4.4520 4.4862 4.5017 4.5312 4.6216 4.6442 4.6671 4.7203 5.1955 5.2302 5.2400 5.2429 5.7209 5.7275 8.0896 8.0961 8.1069 8.1240 8.2411 8.2441 8.7766 8.8202 8.8367 8.8378 10.5212 10.5260 11.0293 11.0333 k = 0.4024 0.4024-0.0000 ( 6466 PWs) bands (ev): -48.9714 -48.9714 -26.6284 -26.6284 -24.5567 -24.5567 -24.5547 -24.5547 -6.9032 -6.9032 -6.5918 -6.5846 -6.5603 -6.5567 -6.4398 -6.4303 0.8383 0.8470 1.0104 1.0134 1.2150 1.2150 1.9817 1.9845 1.9895 1.9941 2.0990 2.1046 2.2403 2.2481 2.2531 2.2567 2.4682 2.4871 2.5266 2.5379 2.8116 2.8240 2.8898 2.9052 3.5820 3.5831 3.8016 3.8603 3.8662 3.9204 3.9247 3.9284 4.0328 4.0430 4.0445 4.0727 4.1135 4.2236 4.3419 4.3711 4.4455 4.4875 4.4956 4.5362 4.6284 4.6531 4.6824 4.7376 5.1958 5.2367 5.2464 5.2479 5.7004 5.7074 8.0789 8.0853 8.0969 8.1175 8.2433 8.2463 8.7550 8.8041 8.8262 8.8279 10.4577 10.4624 11.0862 11.0914 k = 0.3902 0.3902-0.0000 ( 6456 PWs) bands (ev): -48.9713 -48.9713 -26.6283 -26.6283 -24.5566 -24.5566 -24.5547 -24.5547 -6.9206 -6.9205 -6.5863 -6.5789 -6.5546 -6.5506 -6.4345 -6.4245 0.8205 0.8294 0.9915 0.9947 1.2400 1.2405 1.9559 1.9629 1.9828 1.9927 2.0989 2.1042 2.2484 2.2493 2.2494 2.2599 2.4917 2.5126 2.5277 2.5404 2.8216 2.8354 2.9120 2.9292 3.5796 3.5814 3.7970 3.8603 3.8630 3.9197 3.9215 3.9237 4.0316 4.0356 4.0398 4.0729 4.1255 4.2443 4.3289 4.3601 4.4400 4.4830 4.4948 4.5397 4.6360 4.6620 4.6988 4.7554 5.1957 5.2443 5.2517 5.2533 5.6796 5.6869 8.0674 8.0741 8.0863 8.1099 8.2459 8.2489 8.7319 8.7859 8.8143 8.8163 10.3916 10.3963 11.1457 11.1523 k = 0.3780 0.3780-0.0000 ( 6468 PWs) bands (ev): -48.9714 -48.9714 -26.6283 -26.6283 -24.5565 -24.5565 -24.5546 -24.5546 -6.9389 -6.9387 -6.5802 -6.5728 -6.5486 -6.5442 -6.4292 -6.4187 0.8020 0.8111 0.9709 0.9743 1.2660 1.2670 1.9298 1.9365 1.9805 1.9912 2.0989 2.1035 2.2449 2.2450 2.2586 2.2705 2.5158 2.5300 2.5393 2.5436 2.8323 2.8472 2.9345 2.9533 3.5768 3.5794 3.7926 3.8601 3.8604 3.9141 3.9171 3.9212 4.0280 4.0314 4.0354 4.0738 4.1393 4.2652 4.3162 4.3489 4.4352 4.4753 4.4965 4.5418 4.6441 4.6707 4.7163 4.7735 5.1947 5.2526 5.2544 5.2608 5.6593 5.6667 8.0553 8.0626 8.0753 8.1015 8.2488 8.2518 8.7074 8.7659 8.8008 8.8030 10.3233 10.3279 11.2062 11.2143 k = 0.3659 0.3659-0.0000 ( 6470 PWs) bands (ev): -48.9714 -48.9714 -26.6282 -26.6282 -24.5565 -24.5564 -24.5546 -24.5546 -6.9578 -6.9575 -6.5738 -6.5663 -6.5421 -6.5374 -6.4237 -6.4129 0.7830 0.7921 0.9487 0.9522 1.2928 1.2943 1.9036 1.9099 1.9781 1.9895 2.0986 2.1023 2.2414 2.2428 2.2693 2.2824 2.5278 2.5459 2.5460 2.5686 2.8435 2.8594 2.9570 2.9774 3.5738 3.5773 3.7883 3.8576 3.8610 3.9046 3.9114 3.9202 4.0212 4.0316 4.0323 4.0753 4.1547 4.2858 4.3044 4.3376 4.4311 4.4670 4.4985 4.5425 4.6526 4.6790 4.7349 4.7919 5.1920 5.2532 5.2634 5.2691 5.6403 5.6478 8.0428 8.0512 8.0642 8.0922 8.2520 8.2550 8.6817 8.7441 8.7857 8.7881 10.2530 10.2575 11.2660 11.2756 k = 0.3537 0.3537-0.0000 ( 6458 PWs) bands (ev): -48.9713 -48.9713 -26.6282 -26.6282 -24.5563 -24.5563 -24.5546 -24.5546 -6.9772 -6.9769 -6.5670 -6.5594 -6.5353 -6.5303 -6.4184 -6.4073 0.7634 0.7724 0.9250 0.9287 1.3204 1.3224 1.8774 1.8832 1.9758 1.9878 2.0979 2.1004 2.2398 2.2426 2.2807 2.2952 2.5304 2.5493 2.5728 2.5978 2.8552 2.8719 2.9793 3.0010 3.5704 3.5750 3.7843 3.8556 3.8620 3.8931 3.9041 3.9193 4.0156 4.0285 4.0343 4.0774 4.1713 4.2901 4.3093 4.3265 4.4274 4.4585 4.5004 4.5421 4.6613 4.6867 4.7546 4.8106 5.1870 5.2498 5.2747 5.2783 5.6235 5.6310 8.0299 8.0399 8.0533 8.0824 8.2552 8.2583 8.6551 8.7209 8.7690 8.7713 10.1810 10.1854 11.3233 11.3344 k = 0.3415 0.3415-0.0000 ( 6458 PWs) bands (ev): -48.9713 -48.9713 -26.6281 -26.6281 -24.5562 -24.5562 -24.5545 -24.5545 -6.9970 -6.9967 -6.5599 -6.5522 -6.5282 -6.5230 -6.4131 -6.4020 0.7433 0.7522 0.9000 0.9038 1.3486 1.3510 1.8512 1.8566 1.9734 1.9860 2.0965 2.0977 2.2408 2.2448 2.2930 2.3089 2.5327 2.5530 2.6008 2.6278 2.8673 2.8846 3.0012 3.0240 3.5667 3.5723 3.7804 3.8537 3.8636 3.8797 3.8954 3.9185 4.0116 4.0259 4.0373 4.0800 4.1885 4.2788 4.3156 4.3299 4.4239 4.4496 4.5023 4.5408 4.6700 4.6936 4.7754 4.8298 5.1790 5.2427 5.2872 5.2886 5.6094 5.6170 8.0170 8.0291 8.0426 8.0721 8.2584 8.2615 8.6276 8.6962 8.7506 8.7528 10.1075 10.1117 11.3766 11.3890 k = 0.3293 0.3293-0.0000 ( 6460 PWs) bands (ev): -48.9714 -48.9714 -26.6281 -26.6281 -24.5561 -24.5561 -24.5545 -24.5545 -7.0171 -7.0168 -6.5524 -6.5447 -6.5207 -6.5154 -6.4081 -6.3969 0.7227 0.7314 0.8740 0.8778 1.3771 1.3799 1.8253 1.8301 1.9711 1.9842 2.0940 2.0941 2.2445 2.2497 2.3061 2.3233 2.5353 2.5569 2.6296 2.6581 2.8796 2.8975 3.0224 3.0462 3.5627 3.5692 3.7769 3.8511 3.8642 3.8665 3.8862 3.9179 4.0093 4.0240 4.0412 4.0830 4.2060 4.2673 4.3052 4.3508 4.4204 4.4403 4.5044 4.5389 4.6785 4.6997 4.7974 4.8494 5.1675 5.2316 5.3002 5.3009 5.5986 5.6064 8.0040 8.0187 8.0325 8.0614 8.2614 8.2645 8.5995 8.6704 8.7306 8.7326 10.0326 10.0366 11.4246 11.4380 k = 0.3171 0.3171-0.0000 ( 6472 PWs) bands (ev): -48.9714 -48.9714 -26.6280 -26.6280 -24.5560 -24.5560 -24.5545 -24.5545 -7.0373 -7.0370 -6.5447 -6.5370 -6.5130 -6.5077 -6.4033 -6.3921 0.7017 0.7102 0.8469 0.8509 1.4059 1.4089 1.7999 1.8041 1.9687 1.9823 2.0896 2.0905 2.2512 2.2571 2.3198 2.3384 2.5381 2.5611 2.6588 2.6887 2.8920 2.9104 3.0428 3.0674 3.5583 3.5656 3.7739 3.8462 3.8487 3.8688 3.8782 3.9177 4.0088 4.0227 4.0459 4.0863 4.2232 4.2560 4.2957 4.3714 4.4166 4.4307 4.5066 4.5367 4.6867 4.7050 4.8206 4.8696 5.1524 5.2165 5.3131 5.3156 5.5910 5.5992 7.9912 8.0090 8.0228 8.0507 8.2640 8.2672 8.5709 8.6434 8.7089 8.7107 9.9564 9.9604 11.4663 11.4802 k = 0.3049 0.3049-0.0000 ( 6486 PWs) bands (ev): -48.9715 -48.9715 -26.6280 -26.6280 -24.5559 -24.5559 -24.5544 -24.5544 -7.0576 -7.0572 -6.5367 -6.5289 -6.5051 -6.4997 -6.3988 -6.3877 0.6803 0.6885 0.8191 0.8231 1.4347 1.4379 1.7751 1.7786 1.9664 1.9804 2.0842 2.0860 2.2607 2.2669 2.3343 2.3541 2.5413 2.5655 2.6883 2.7195 2.9046 2.9233 3.0622 3.0875 3.5536 3.5615 3.7714 3.8315 3.8374 3.8721 3.8738 3.9181 4.0099 4.0220 4.0513 4.0899 4.2385 4.2451 4.2884 4.3912 4.4123 4.4209 4.5092 4.5346 4.6943 4.7095 4.8451 4.8906 5.1340 5.1977 5.3273 5.3313 5.5867 5.5953 7.9786 7.9998 8.0139 8.0400 8.2662 8.2693 8.5418 8.6155 8.6858 8.6872 9.8793 9.8831 11.5014 11.5152 k = 0.2927 0.2927-0.0000 ( 6490 PWs) bands (ev): -48.9715 -48.9715 -26.6279 -26.6279 -24.5558 -24.5558 -24.5544 -24.5544 -7.0777 -7.0774 -6.5284 -6.5207 -6.4970 -6.4917 -6.3945 -6.3836 0.6587 0.6666 0.7906 0.7947 1.4631 1.4663 1.7513 1.7541 1.9641 1.9784 2.0782 2.0804 2.2728 2.2790 2.3493 2.3704 2.5448 2.5701 2.7180 2.7502 2.9172 2.9361 3.0806 3.1063 3.5486 3.5567 3.7691 3.8135 3.8254 3.8728 3.8760 3.9194 4.0126 4.0218 4.0574 4.0938 4.2346 4.2485 4.2867 4.4064 4.4075 4.4148 4.5123 4.5329 4.7013 4.7132 4.8710 4.9125 5.1129 5.1759 5.3425 5.3479 5.5851 5.5942 7.9665 7.9914 8.0058 8.0295 8.2677 8.2708 8.5125 8.5868 8.6613 8.6622 9.8011 9.8049 11.5298 11.5430 k = 0.2805 0.2805-0.0000 ( 6492 PWs) bands (ev): -48.9715 -48.9715 -26.6279 -26.6279 -24.5557 -24.5557 -24.5544 -24.5544 -7.0977 -7.0974 -6.5200 -6.5123 -6.4887 -6.4835 -6.3906 -6.3799 0.6369 0.6445 0.7617 0.7658 1.4908 1.4939 1.7289 1.7308 1.9619 1.9764 2.0717 2.0742 2.2871 2.2931 2.3649 2.3871 2.5486 2.5748 2.7479 2.7808 2.9299 2.9489 3.0979 3.1238 3.5433 3.5510 3.7659 3.7946 3.8130 3.8741 3.8802 3.9217 4.0165 4.0222 4.0640 4.0978 4.2246 4.2488 4.2947 4.3986 4.4020 4.4305 4.5160 4.5318 4.7076 4.7163 4.8981 4.9355 5.0896 5.1516 5.3585 5.3650 5.5858 5.5954 7.9548 7.9835 7.9985 8.0196 8.2685 8.2715 8.4831 8.5575 8.6356 8.6358 9.7222 9.7259 11.5522 11.5639 k = 0.2683 0.2683-0.0000 ( 6484 PWs) bands (ev): -48.9715 -48.9715 -26.6278 -26.6278 -24.5555 -24.5555 -24.5543 -24.5543 -7.1175 -7.1172 -6.5115 -6.5038 -6.4803 -6.4752 -6.3869 -6.3765 0.6151 0.6223 0.7326 0.7366 1.5170 1.5196 1.7088 1.7094 1.9598 1.9745 2.0647 2.0672 2.3035 2.3088 2.3808 2.4042 2.5527 2.5797 2.7778 2.8111 2.9425 2.9616 3.1139 3.1398 3.5375 3.5446 3.7592 3.7752 3.8039 3.8766 3.8847 3.9254 4.0217 4.0232 4.0712 4.1018 4.2153 4.2432 4.3084 4.3878 4.3959 4.4479 4.5204 4.5316 4.7133 4.7188 4.9267 4.9596 5.0648 5.1256 5.3752 5.3827 5.5882 5.5982 7.9438 7.9763 7.9921 8.0103 8.2684 8.2711 8.4538 8.5277 8.6083 8.6087 9.6426 9.6462 11.5693 11.5780 k = 0.2561 0.2561-0.0000 ( 6480 PWs) bands (ev): -48.9715 -48.9715 -26.6278 -26.6278 -24.5554 -24.5554 -24.5543 -24.5543 -7.1369 -7.1366 -6.5028 -6.4952 -6.4718 -6.4669 -6.3836 -6.3735 0.5933 0.6001 0.7033 0.7072 1.5403 1.5420 1.6914 1.6923 1.9577 1.9725 2.0573 2.0599 2.3214 2.3260 2.3972 2.4215 2.5571 2.5847 2.8075 2.8411 2.9552 2.9742 3.1287 3.1544 3.5313 3.5373 3.7468 3.7552 3.8010 3.8799 3.8893 3.9305 4.0247 4.0279 4.0787 4.1057 4.2068 4.2357 4.3232 4.3767 4.3899 4.4642 4.5257 4.5324 4.7182 4.7209 4.9564 4.9842 5.0399 5.0985 5.3924 5.4006 5.5919 5.6021 7.9335 7.9695 7.9866 8.0019 8.2672 8.2696 8.4246 8.4975 8.5797 8.5810 9.5624 9.5660 11.5822 11.5874 k = 0.2439 0.2439-0.0000 ( 6486 PWs) bands (ev): -48.9715 -48.9715 -26.6277 -26.6277 -24.5553 -24.5553 -24.5542 -24.5542 -7.1560 -7.1557 -6.4942 -6.4867 -6.4632 -6.4586 -6.3805 -6.3708 0.5716 0.5781 0.6740 0.6779 1.5581 1.5582 1.6791 1.6823 1.9557 1.9705 2.0498 2.0522 2.3406 2.3444 2.4137 2.4389 2.5617 2.5896 2.8370 2.8706 2.9678 2.9867 3.1422 3.1675 3.5247 3.5292 3.7297 3.7347 3.8036 3.8838 3.8939 3.9373 4.0266 4.0352 4.0866 4.1093 4.1992 4.2278 4.3359 4.3653 4.3853 4.4788 4.5323 4.5342 4.7225 4.7225 4.9870 5.0001 5.0247 5.0712 5.4097 5.4186 5.5963 5.6065 7.9240 7.9630 7.9819 7.9947 8.2648 8.2666 8.3959 8.4671 8.5504 8.5525 9.4817 9.4854 11.5921 11.5957 k = 0.2317 0.2317-0.0000 ( 6486 PWs) bands (ev): -48.9715 -48.9715 -26.6276 -26.6276 -24.5551 -24.5551 -24.5542 -24.5542 -7.1745 -7.1743 -6.4855 -6.4781 -6.4547 -6.4503 -6.3778 -6.3685 0.5503 0.5563 0.6450 0.6488 1.5646 1.5664 1.6767 1.6822 1.9537 1.9686 2.0421 2.0443 2.3607 2.3636 2.4305 2.4563 2.5666 2.5946 2.8662 2.8994 2.9804 2.9991 3.1544 3.1791 3.5176 3.5204 3.7100 3.7138 3.8098 3.8883 3.8983 3.9457 4.0290 4.0433 4.0947 4.1121 4.1928 4.2200 4.3427 4.3539 4.3861 4.4915 4.5370 4.5404 4.7240 4.7261 4.9809 5.0153 5.0458 5.0473 5.4270 5.4365 5.6011 5.6112 7.9154 7.9567 7.9782 7.9888 8.2611 8.2620 8.3680 8.4369 8.5205 8.5235 9.4007 9.4044 11.5999 11.6043 k = 0.2195 0.2195-0.0000 ( 6480 PWs) bands (ev): -48.9715 -48.9715 -26.6276 -26.6276 -24.5550 -24.5550 -24.5541 -24.5541 -7.1925 -7.1923 -6.4769 -6.4697 -6.4462 -6.4421 -6.3752 -6.3665 0.5293 0.5349 0.6163 0.6200 1.5607 1.5634 1.6857 1.6927 1.9519 1.9667 2.0344 2.0363 2.3815 2.3835 2.4473 2.4736 2.5716 2.5996 2.8950 2.9275 2.9930 3.0114 3.1654 3.1892 3.5100 3.5108 3.6889 3.6925 3.8185 3.8933 3.9027 3.9556 4.0319 4.0521 4.1030 4.1140 4.1881 4.2123 4.3408 4.3426 4.3949 4.5021 4.5408 4.5500 4.7254 4.7292 4.9553 5.0088 5.0597 5.0753 5.4441 5.4540 5.6061 5.6157 7.9077 7.9507 7.9754 7.9844 8.2554 8.2559 8.3412 8.4069 8.4902 8.4942 9.3194 9.3232 11.6063 11.6114 k = 0.2073 0.2073-0.0000 ( 6488 PWs) bands (ev): -48.9716 -48.9716 -26.6275 -26.6275 -24.5549 -24.5549 -24.5541 -24.5541 -7.2099 -7.2097 -6.4685 -6.4615 -6.4378 -6.4340 -6.3730 -6.3647 0.5088 0.5140 0.5882 0.5918 1.5498 1.5527 1.7027 1.7102 1.9501 1.9647 2.0267 2.0282 2.4028 2.4037 2.4641 2.4907 2.5767 2.6044 2.9231 2.9548 3.0057 3.0237 3.1751 3.1979 3.5006 3.5019 3.6669 3.6709 3.8289 3.8988 3.9070 3.9669 4.0352 4.0616 4.1112 4.1145 4.1853 4.2050 4.3312 4.3334 4.4086 4.5108 4.5455 4.5610 4.7267 4.7318 4.9295 4.9827 5.0931 5.1069 5.4606 5.4711 5.6109 5.6200 7.9012 7.9450 7.9734 7.9813 8.2463 8.2492 8.3163 8.3776 8.4598 8.4649 9.2380 9.2419 11.6121 11.6160 k = 0.1951 0.1951-0.0000 ( 6484 PWs) bands (ev): -48.9715 -48.9715 -26.6275 -26.6275 -24.5548 -24.5548 -24.5540 -24.5540 -7.2267 -7.2265 -6.4602 -6.4534 -6.4295 -6.4260 -6.3709 -6.3632 0.4889 0.4937 0.5607 0.5642 1.5357 1.5382 1.7234 1.7310 1.9485 1.9629 2.0191 2.0203 2.4241 2.4242 2.4808 2.5074 2.5820 2.6092 2.9505 2.9810 3.0185 3.0360 3.1836 3.2053 3.4899 3.4933 3.6443 3.6490 3.8406 3.9048 3.9114 3.9792 4.0389 4.0716 4.1135 4.1194 4.1845 4.1981 4.3200 4.3237 4.4243 4.5182 4.5508 4.5729 4.7280 4.7338 4.9044 4.9556 5.1292 5.1403 5.4765 5.4875 5.6155 5.6238 7.8958 7.9398 7.9722 7.9796 8.2341 8.2407 8.2939 8.3492 8.4296 8.4357 9.1566 9.1607 11.6176 11.6202 k = 0.1829 0.1829-0.0000 ( 6484 PWs) bands (ev): -48.9715 -48.9715 -26.6274 -26.6274 -24.5547 -24.5546 -24.5540 -24.5540 -7.2427 -7.2425 -6.4521 -6.4457 -6.4215 -6.4182 -6.3690 -6.3619 0.4696 0.4741 0.5341 0.5374 1.5203 1.5225 1.7454 1.7529 1.9469 1.9611 2.0117 2.0125 2.4445 2.4454 2.4972 2.5236 2.5874 2.6138 2.9771 3.0062 3.0315 3.0483 3.1909 3.2115 3.4788 3.4843 3.6213 3.6269 3.8531 3.9114 3.9158 3.9924 4.0431 4.0819 4.1112 4.1272 4.1856 4.1915 4.3090 4.3130 4.4407 4.5247 4.5568 4.5852 4.7293 4.7354 4.8802 4.9291 5.1666 5.1749 5.4914 5.5030 5.6197 5.6270 7.8916 7.9354 7.9719 7.9790 8.2186 8.2304 8.2745 8.3220 8.3996 8.4069 9.0755 9.0797 11.6234 11.6246 k = 0.1707 0.1707-0.0000 ( 6473 PWs) bands (ev): -48.9715 -48.9715 -26.6273 -26.6273 -24.5545 -24.5545 -24.5540 -24.5540 -7.2579 -7.2578 -6.4443 -6.4383 -6.4136 -6.4107 -6.3672 -6.3608 0.4512 0.4553 0.5085 0.5117 1.5047 1.5065 1.7675 1.7748 1.9455 1.9593 2.0045 2.0049 2.4646 2.4664 2.5133 2.5392 2.5929 2.6182 3.0027 3.0301 3.0449 3.0609 3.1973 3.2166 3.4673 3.4747 3.5982 3.6047 3.8662 3.9187 3.9202 4.0063 4.0476 4.0923 4.1080 4.1347 4.1855 4.1884 4.2982 4.3019 4.4575 4.5306 4.5633 4.5975 4.7308 4.7365 4.8574 4.9034 5.2049 5.2107 5.5053 5.5173 5.6235 5.6297 7.8889 7.9319 7.9722 7.9794 8.2002 8.2181 8.2578 8.2964 8.3701 8.3787 8.9948 8.9992 11.6296 11.6297 k = 0.1585 0.1585-0.0000 ( 6485 PWs) bands (ev): -48.9716 -48.9716 -26.6273 -26.6273 -24.5544 -24.5544 -24.5539 -24.5539 -7.2723 -7.2722 -6.4369 -6.4313 -6.4061 -6.4034 -6.3656 -6.3599 0.4337 0.4374 0.4839 0.4870 1.4894 1.4909 1.7891 1.7962 1.9440 1.9575 1.9976 1.9977 2.4842 2.4869 2.5291 2.5539 2.5986 2.6225 3.0272 3.0526 3.0585 3.0738 3.2027 3.2207 3.4556 3.4646 3.5750 3.5824 3.8792 3.9246 3.9269 4.0204 4.0524 4.1003 4.1062 4.1415 4.1799 4.1921 4.2876 4.2907 4.4744 4.5361 4.5703 4.6097 4.7322 4.7369 4.8362 4.8787 5.2437 5.2474 5.5180 5.5305 5.6268 5.6318 7.8877 7.9296 7.9733 7.9807 8.1804 8.2038 8.2428 8.2726 8.3414 8.3513 8.9149 8.9195 11.6355 11.6366 k = 0.1463 0.1463-0.0000 ( 6481 PWs) bands (ev): -48.9715 -48.9715 -26.6272 -26.6272 -24.5543 -24.5543 -24.5539 -24.5539 -7.2858 -7.2857 -6.4298 -6.4248 -6.3988 -6.3965 -6.3640 -6.3591 0.4171 0.4205 0.4607 0.4635 1.4748 1.4760 1.8099 1.8166 1.9427 1.9558 1.9907 1.9912 2.5031 2.5065 2.5443 2.5678 2.6043 2.6264 3.0503 3.0728 3.0732 3.0876 3.2074 3.2238 3.4439 3.4542 3.5519 3.5600 3.8917 3.9291 3.9363 4.0346 4.0575 4.0981 4.1142 4.1474 4.1748 4.1967 4.2772 4.2799 4.4910 4.5412 4.5776 4.6215 4.7335 4.7364 4.8173 4.8554 5.2828 5.2846 5.5294 5.5423 5.6298 5.6336 7.8881 7.9286 7.9751 7.9828 8.1603 8.1878 8.2285 8.2508 8.3136 8.3249 8.8360 8.8407 11.6422 11.6443 k = 0.1341 0.1341-0.0000 ( 6483 PWs) bands (ev): -48.9716 -48.9716 -26.6272 -26.6272 -24.5542 -24.5542 -24.5539 -24.5539 -7.2984 -7.2983 -6.4232 -6.4188 -6.3920 -6.3899 -6.3626 -6.3584 0.4016 0.4047 0.4388 0.4414 1.4611 1.4620 1.8295 1.8359 1.9415 1.9541 1.9842 1.9851 2.5211 2.5251 2.5590 2.5806 2.6102 2.6302 3.0717 3.0881 3.0912 3.1029 3.2112 3.2263 3.4321 3.4435 3.5288 3.5377 3.9034 3.9334 3.9467 4.0485 4.0629 4.0939 4.1239 4.1519 4.1706 4.2017 4.2671 4.2696 4.5072 4.5462 4.5853 4.6330 4.7346 4.7346 4.8012 4.8339 5.3218 5.3220 5.5393 5.5525 5.6325 5.6350 7.8903 7.9292 7.9775 7.9856 8.1407 8.1706 8.2144 8.2307 8.2869 8.2996 8.7584 8.7632 11.6498 11.6527 k = 0.1220 0.1220-0.0000 ( 6495 PWs) bands (ev): -48.9716 -48.9716 -26.6272 -26.6272 -24.5541 -24.5541 -24.5538 -24.5538 -7.3100 -7.3099 -6.4171 -6.4133 -6.3856 -6.3838 -6.3612 -6.3578 0.3872 0.3899 0.4183 0.4208 1.4482 1.4489 1.8477 1.8538 1.9403 1.9524 1.9782 1.9795 2.5379 2.5425 2.5731 2.5922 2.6162 2.6338 3.0909 3.1046 3.1065 3.1197 3.2145 3.2281 3.4203 3.4325 3.5061 3.5155 3.9140 3.9377 3.9584 4.0616 4.0687 4.0896 4.1331 4.1546 4.1674 4.2068 4.2572 4.2601 4.5224 4.5508 4.5936 4.6439 4.7309 4.7351 4.7885 4.8145 5.3590 5.3601 5.5477 5.5610 5.6350 5.6363 7.8944 7.9315 7.9805 7.9890 8.1222 8.1529 8.2005 8.2121 8.2615 8.2756 8.6826 8.6874 11.6583 11.6618 k = 0.1098 0.1098-0.0000 ( 6499 PWs) bands (ev): -48.9716 -48.9716 -26.6271 -26.6271 -24.5541 -24.5540 -24.5538 -24.5538 -7.3206 -7.3206 -6.4115 -6.4084 -6.3796 -6.3780 -6.3598 -6.3572 0.3740 0.3764 0.3995 0.4018 1.4364 1.4369 1.8645 1.8701 1.9392 1.9506 1.9729 1.9745 2.5534 2.5583 2.5865 2.6028 2.6224 2.6370 3.1082 3.1207 3.1222 3.1368 3.2173 3.2293 3.4088 3.4213 3.4837 3.4935 3.9234 3.9418 3.9710 4.0717 4.0769 4.0856 4.1417 4.1548 4.1658 4.2119 4.2476 4.2519 4.5359 4.5550 4.6025 4.6541 4.7252 4.7343 4.7799 4.7981 5.3952 5.3973 5.5546 5.5678 5.6375 5.6378 7.9007 7.9357 7.9841 7.9929 8.1051 8.1354 8.1866 8.1944 8.2374 8.2530 8.6089 8.6136 11.6675 11.6715 k = 0.0976 0.0976-0.0000 ( 6495 PWs) bands (ev): -48.9716 -48.9716 -26.6271 -26.6271 -24.5540 -24.5540 -24.5538 -24.5538 -7.3302 -7.3302 -6.4065 -6.4041 -6.3741 -6.3728 -6.3584 -6.3565 0.3620 0.3642 0.3824 0.3845 1.4257 1.4261 1.8797 1.8848 1.9382 1.9488 1.9683 1.9702 2.5674 2.5723 2.5991 2.6123 2.6286 2.6400 3.1243 3.1344 3.1401 3.1531 3.2196 3.2302 3.3975 3.4100 3.4618 3.4718 3.9319 3.9458 3.9842 4.0777 4.0822 4.0878 4.1494 4.1533 4.1649 4.2167 4.2383 4.2452 4.5473 4.5587 4.6124 4.6635 4.7179 4.7316 4.7749 4.7855 5.4299 5.4326 5.5601 5.5728 5.6396 5.6401 7.9092 7.9421 7.9882 7.9974 8.0897 8.1187 8.1729 8.1776 8.2149 8.2319 8.5379 8.5423 11.6773 11.6816 k = 0.0854 0.0854-0.0000 ( 6501 PWs) bands (ev): -48.9717 -48.9717 -26.6271 -26.6271 -24.5539 -24.5539 -24.5537 -24.5537 -7.3388 -7.3387 -6.4022 -6.4004 -6.3692 -6.3681 -6.3571 -6.3559 0.3513 0.3532 0.3671 0.3689 1.4162 1.4164 1.8931 1.8977 1.9372 1.9468 1.9647 1.9665 2.5797 2.5842 2.6109 2.6211 2.6347 2.6428 3.1400 3.1481 3.1573 3.1684 3.2217 3.2307 3.3865 3.3988 3.4404 3.4505 3.9395 3.9496 3.9976 4.0794 4.0826 4.0979 4.1515 4.1560 4.1634 4.2209 4.2294 4.2404 4.5559 4.5619 4.6233 4.6719 4.7103 4.7263 4.7724 4.7774 5.4624 5.4654 5.5643 5.5761 5.6420 5.6428 7.9202 7.9509 7.9929 8.0022 8.0760 8.1033 8.1598 8.1617 8.1942 8.2123 8.4699 8.4739 11.6873 11.6917 k = 0.0732 0.0732-0.0000 ( 6497 PWs) bands (ev): -48.9716 -48.9716 -26.6270 -26.6270 -24.5538 -24.5538 -24.5537 -24.5537 -7.3462 -7.3462 -6.3985 -6.3973 -6.3648 -6.3639 -6.3559 -6.3552 0.3420 0.3436 0.3537 0.3553 1.4078 1.4080 1.9048 1.9087 1.9362 1.9447 1.9620 1.9637 2.5902 2.5939 2.6216 2.6292 2.6403 2.6455 3.1553 3.1616 3.1736 3.1825 3.2236 3.2310 3.3762 3.3877 3.4199 3.4297 3.9462 3.9531 4.0110 4.0775 4.0865 4.1061 4.1503 4.1614 4.1616 4.2191 4.2263 4.2374 4.5618 4.5644 4.6349 4.6791 4.7034 4.7191 4.7716 4.7734 5.4919 5.4950 5.5674 5.5780 5.6449 5.6459 7.9339 7.9623 7.9980 8.0073 8.0641 8.0895 8.1467 8.1472 8.1754 8.1945 8.4055 8.4089 11.6972 11.7016 k = 0.0610 0.0610-0.0000 ( 6499 PWs) bands (ev): -48.9717 -48.9717 -26.6270 -26.6270 -24.5538 -24.5538 -24.5537 -24.5537 -7.3525 -7.3525 -6.3954 -6.3947 -6.3611 -6.3604 -6.3548 -6.3546 0.3341 0.3354 0.3423 0.3436 1.4007 1.4008 1.9144 1.9177 1.9354 1.9424 1.9604 1.9617 2.5989 2.6015 2.6312 2.6367 2.6453 2.6479 3.1701 3.1748 3.1888 3.1953 3.2254 3.2313 3.3665 3.3769 3.4004 3.4096 3.9520 3.9563 4.0242 4.0764 4.0893 4.1113 4.1498 4.1599 4.1660 4.2107 4.2295 4.2359 4.5653 4.5661 4.6466 4.6850 4.6977 4.7113 4.7715 4.7721 5.5176 5.5204 5.5697 5.5787 5.6486 5.6495 7.9502 7.9764 8.0036 8.0127 8.0542 8.0776 8.1329 8.1355 8.1590 8.1783 8.3450 8.3476 11.7067 11.7109 k = 0.0488 0.0488-0.0000 ( 6505 PWs) bands (ev): -48.9717 -48.9717 -26.6270 -26.6270 -24.5537 -24.5537 -24.5537 -24.5537 -7.3578 -7.3578 -6.3930 -6.3926 -6.3580 -6.3574 -6.3539 -6.3539 0.3275 0.3286 0.3328 0.3339 1.3948 1.3949 1.9221 1.9246 1.9347 1.9402 1.9598 1.9606 2.6058 2.6073 2.6394 2.6434 2.6493 2.6501 3.1840 3.1871 3.2026 3.2068 3.2274 3.2316 3.3577 3.3668 3.3822 3.3907 3.9568 3.9591 4.0370 4.0762 4.0905 4.1124 4.1506 4.1601 4.1693 4.2022 4.2323 4.2356 4.5670 4.5672 4.6578 4.6893 4.6934 4.7041 4.7720 4.7720 5.5387 5.5411 5.5712 5.5786 5.6528 5.6535 7.9692 7.9934 8.0094 8.0182 8.0462 8.0679 8.1207 8.1246 8.1457 8.1640 8.2888 8.2904 11.7154 11.7191 k = 0.0366 0.0366-0.0000 ( 6505 PWs) bands (ev): -48.9717 -48.9717 -26.6270 -26.6270 -24.5537 -24.5537 -24.5537 -24.5537 -7.3618 -7.3618 -6.3912 -6.3911 -6.3555 -6.3551 -6.3533 -6.3531 0.3225 0.3232 0.3255 0.3263 1.3902 1.3903 1.9277 1.9295 1.9341 1.9383 1.9599 1.9603 2.6109 2.6116 2.6461 2.6489 2.6522 2.6524 3.1959 3.1977 3.2150 3.2171 3.2297 3.2322 3.3504 3.3577 3.3660 3.3732 3.9604 3.9615 4.0494 4.0770 4.0903 4.1091 4.1533 4.1622 4.1713 4.1938 4.2345 4.2359 4.5676 4.5676 4.6680 4.6905 4.6919 4.6983 4.7725 4.7726 5.5550 5.5568 5.5724 5.5780 5.6573 5.6577 7.9902 8.0126 8.0153 8.0244 8.0401 8.0612 8.1106 8.1145 8.1360 8.1518 8.2374 8.2380 11.7229 11.7258 k = 0.0244 0.0244-0.0000 ( 6501 PWs) bands (ev): -48.9717 -48.9717 -26.6269 -26.6269 -24.5537 -24.5537 -24.5537 -24.5537 -7.3648 -7.3648 -6.3900 -6.3899 -6.3537 -6.3535 -6.3527 -6.3526 0.3189 0.3194 0.3202 0.3208 1.3870 1.3870 1.9314 1.9325 1.9339 1.9366 1.9604 1.9605 2.6143 2.6146 2.6510 2.6528 2.6539 2.6545 3.2048 3.2055 3.2254 3.2260 3.2323 3.2334 3.3448 3.3500 3.3529 3.3583 3.9630 3.9634 4.0614 4.0787 4.0889 4.1025 4.1578 4.1652 4.1722 4.1857 4.2360 4.2364 4.5676 4.5677 4.6767 4.6888 4.6924 4.6942 4.7732 4.7732 5.5662 5.5674 5.5734 5.5771 5.6614 5.6616 8.0111 8.0209 8.0247 8.0355 8.0399 8.0594 8.1031 8.1059 8.1302 8.1417 8.1908 8.1913 11.7287 11.7308 k = 0.0122 0.0122-0.0000 ( 6477 PWs) bands (ev): -48.9716 -48.9716 -26.6269 -26.6269 -24.5537 -24.5537 -24.5537 -24.5537 -7.3665 -7.3665 -6.3893 -6.3893 -6.3526 -6.3525 -6.3524 -6.3523 0.3168 0.3170 0.3171 0.3174 1.3850 1.3850 1.9335 1.9340 1.9341 1.9353 1.9609 1.9609 2.6163 2.6163 2.6543 2.6551 2.6551 2.6556 3.2099 3.2100 3.2327 3.2328 3.2345 3.2348 3.3418 3.3443 3.3445 3.3473 3.9646 3.9646 4.0729 4.0811 4.0866 4.0938 4.1637 4.1682 4.1719 4.1779 4.2370 4.2370 4.5675 4.5676 4.6837 4.6883 4.6905 4.6920 4.7737 4.7737 5.5728 5.5734 5.5743 5.5761 5.6644 5.6644 8.0253 8.0257 8.0284 8.0323 8.0633 8.0671 8.0998 8.1007 8.1282 8.1343 8.1509 8.1520 11.7328 11.7347 k = 0.0000 0.0000 0.0000 ( 6451 PWs) bands (ev): -48.9714 -48.9714 -26.6269 -26.6269 -24.5536 -24.5536 -24.5536 -24.5536 -7.3671 -7.3671 -6.3891 -6.3891 -6.3522 -6.3522 -6.3522 -6.3522 0.3162 0.3162 0.3162 0.3162 1.3844 1.3844 1.9344 1.9344 1.9344 1.9344 1.9611 1.9611 2.6170 2.6170 2.6557 2.6557 2.6557 2.6557 3.2115 3.2115 3.2354 3.2354 3.2354 3.2354 3.3420 3.3420 3.3420 3.3420 3.9651 3.9651 4.0838 4.0838 4.0838 4.0838 4.1706 4.1706 4.1706 4.1706 4.2373 4.2373 4.5675 4.5675 4.6889 4.6889 4.6889 4.6889 4.7739 4.7739 5.5752 5.5752 5.5752 5.5752 5.6654 5.6654 8.0293 8.0293 8.0293 8.0293 8.0762 8.0762 8.1019 8.1019 8.1297 8.1297 8.1297 8.1297 11.7344 11.7344 k = 0.0000 0.0000 0.0000 ( 6451 PWs) bands (ev): -48.9714 -48.9714 -26.6269 -26.6269 -24.5536 -24.5536 -24.5536 -24.5536 -7.3671 -7.3671 -6.3891 -6.3891 -6.3522 -6.3522 -6.3522 -6.3522 0.3162 0.3162 0.3162 0.3162 1.3844 1.3844 1.9344 1.9344 1.9344 1.9344 1.9611 1.9611 2.6170 2.6170 2.6557 2.6557 2.6557 2.6557 3.2115 3.2115 3.2354 3.2354 3.2354 3.2354 3.3420 3.3420 3.3420 3.3420 3.9651 3.9651 4.0838 4.0838 4.0838 4.0838 4.1706 4.1706 4.1706 4.1706 4.2373 4.2373 4.5675 4.5675 4.6889 4.6889 4.6889 4.6889 4.7739 4.7739 5.5752 5.5752 5.5752 5.5752 5.6654 5.6654 8.0293 8.0293 8.0293 8.0293 8.0762 8.0762 8.1019 8.1019 8.1297 8.1297 8.1297 8.1297 11.7344 11.7344 k = 0.0100 0.0100 0.0100 ( 6472 PWs) bands (ev): -48.9715 -48.9715 -26.6269 -26.6269 -24.5537 -24.5537 -24.5537 -24.5537 -7.3665 -7.3665 -6.3893 -6.3893 -6.3526 -6.3524 -6.3524 -6.3524 0.3169 0.3171 0.3171 0.3173 1.3850 1.3850 1.9338 1.9339 1.9339 1.9353 1.9609 1.9609 2.6163 2.6163 2.6543 2.6552 2.6552 2.6554 3.2100 3.2100 3.2331 3.2333 3.2341 3.2341 3.3423 3.3444 3.3444 3.3470 3.9646 3.9646 4.0725 4.0839 4.0839 4.0941 4.1635 4.1700 4.1700 4.1782 4.2370 4.2370 4.5676 4.5676 4.6835 4.6895 4.6895 4.6920 4.7737 4.7737 5.5730 5.5730 5.5742 5.5763 5.6644 5.6644 8.0259 8.0269 8.0269 8.0323 8.0647 8.0647 8.1004 8.1004 8.1281 8.1347 8.1515 8.1515 11.7335 11.7344 k = 0.0200 0.0200 0.0200 ( 6499 PWs) bands (ev): -48.9717 -48.9717 -26.6269 -26.6269 -24.5537 -24.5537 -24.5537 -24.5537 -7.3647 -7.3647 -6.3900 -6.3900 -6.3534 -6.3531 -6.3531 -6.3530 0.3194 0.3198 0.3198 0.3203 1.3870 1.3870 1.9322 1.9322 1.9335 1.9365 1.9604 1.9604 2.6144 2.6144 2.6513 2.6534 2.6537 2.6537 3.2057 3.2057 3.2271 3.2272 3.2305 3.2305 3.3479 3.3512 3.3512 3.3566 3.9632 3.9632 4.0606 4.0839 4.0839 4.1029 4.1580 4.1683 4.1683 4.1863 4.2362 4.2362 4.5676 4.5676 4.6759 4.6915 4.6915 4.6931 4.7732 4.7732 5.5664 5.5664 5.5735 5.5775 5.6615 5.6615 8.0181 8.0181 8.0224 8.0344 8.0475 8.0475 8.1058 8.1058 8.1304 8.1429 8.1912 8.1912 11.7318 11.7337 k = 0.0300 0.0300 0.0300 ( 6511 PWs) bands (ev): -48.9717 -48.9717 -26.6270 -26.6270 -24.5537 -24.5537 -24.5537 -24.5537 -7.3618 -7.3618 -6.3911 -6.3911 -6.3547 -6.3542 -6.3542 -6.3541 0.3238 0.3244 0.3244 0.3251 1.3903 1.3903 1.9292 1.9292 1.9335 1.9380 1.9599 1.9599 2.6113 2.6113 2.6466 2.6497 2.6513 2.6513 3.1988 3.1988 3.2178 3.2191 3.2252 3.2252 3.3577 3.3614 3.3614 3.3694 3.9610 3.9610 4.0482 4.0840 4.0840 4.1089 4.1551 4.1657 4.1657 4.1947 4.2351 4.2351 4.5675 4.5675 4.6664 4.6921 4.6951 4.6951 4.7726 4.7726 5.5547 5.5547 5.5729 5.5789 5.6577 5.6577 8.0027 8.0027 8.0191 8.0356 8.0376 8.0376 8.1158 8.1158 8.1365 8.1538 8.2380 8.2380 11.7301 11.7331 k = 0.0400 0.0400 0.0400 ( 6511 PWs) bands (ev): -48.9717 -48.9717 -26.6270 -26.6270 -24.5537 -24.5537 -24.5537 -24.5537 -7.3577 -7.3577 -6.3927 -6.3927 -6.3566 -6.3557 -6.3557 -6.3557 0.3300 0.3308 0.3308 0.3318 1.3949 1.3949 1.9245 1.9245 1.9338 1.9399 1.9596 1.9596 2.6069 2.6069 2.6404 2.6443 2.6480 2.6480 3.1900 3.1900 3.2069 3.2098 3.2188 3.2188 3.3703 3.3740 3.3740 3.3844 3.9580 3.9580 4.0354 4.0840 4.0840 4.1107 4.1563 4.1623 4.1623 4.2032 4.2337 4.2337 4.5670 4.5670 4.6551 4.6892 4.7003 4.7003 4.7722 4.7722 5.5374 5.5374 5.5723 5.5804 5.6537 5.6537 7.9860 7.9860 8.0162 8.0324 8.0324 8.0360 8.1289 8.1289 8.1463 8.1672 8.2902 8.2902 11.7276 11.7320 k = 0.0500 0.0500 0.0500 ( 6499 PWs) bands (ev): -48.9717 -48.9717 -26.6270 -26.6270 -24.5537 -24.5537 -24.5537 -24.5537 -7.3524 -7.3524 -6.3947 -6.3947 -6.3588 -6.3578 -6.3576 -6.3576 0.3380 0.3389 0.3389 0.3402 1.4008 1.4008 1.9180 1.9180 1.9345 1.9420 1.9597 1.9597 2.6012 2.6012 2.6326 2.6374 2.6440 2.6440 3.1799 3.1799 3.1951 3.2000 3.2111 3.2111 3.3850 3.3883 3.3883 3.4007 3.9543 3.9543 4.0223 4.0838 4.0838 4.1083 4.1580 4.1580 4.1616 4.2119 4.2321 4.2321 4.5656 4.5656 4.6422 4.6847 4.7070 4.7070 4.7725 4.7725 5.5145 5.5145 5.5717 5.5818 5.6501 5.6501 7.9716 7.9716 8.0139 8.0289 8.0289 8.0359 8.1445 8.1445 8.1593 8.1827 8.3469 8.3469 11.7250 11.7306 k = 0.0600 0.0600 0.0600 ( 6502 PWs) bands (ev): -48.9717 -48.9717 -26.6270 -26.6270 -24.5538 -24.5538 -24.5538 -24.5538 -7.3460 -7.3460 -6.3972 -6.3972 -6.3616 -6.3603 -6.3599 -6.3599 0.3478 0.3488 0.3488 0.3504 1.4080 1.4080 1.9095 1.9095 1.9354 1.9444 1.9604 1.9604 2.5942 2.5942 2.6234 2.6288 2.6392 2.6392 3.1690 3.1690 3.1829 3.1899 3.2021 3.2021 3.4011 3.4037 3.4037 3.4179 3.9499 3.9499 4.0088 4.0832 4.0832 4.1032 4.1531 4.1531 4.1694 4.2205 4.2304 4.2304 4.5632 4.5632 4.6281 4.6788 4.7146 4.7146 4.7742 4.7742 5.4861 5.4861 5.5710 5.5831 5.6470 5.6470 7.9603 7.9603 8.0121 8.0266 8.0266 8.0356 8.1623 8.1623 8.1751 8.2002 8.4078 8.4078 11.7220 11.7293 k = 0.0700 0.0700 0.0700 ( 6499 PWs) bands (ev): -48.9717 -48.9717 -26.6271 -26.6271 -24.5538 -24.5538 -24.5538 -24.5538 -7.3385 -7.3385 -6.4000 -6.4000 -6.3647 -6.3633 -6.3627 -6.3627 0.3592 0.3603 0.3603 0.3622 1.4164 1.4164 1.8991 1.8991 1.9367 1.9471 1.9616 1.9616 2.5858 2.5858 2.6129 2.6186 2.6338 2.6338 3.1577 3.1577 3.1707 3.1798 3.1917 3.1917 3.4182 3.4198 3.4198 3.4356 3.9450 3.9450 3.9951 4.0820 4.0820 4.0968 4.1477 4.1477 4.1783 4.2287 4.2287 4.2290 4.5597 4.5597 4.6131 4.6719 4.7220 4.7220 4.7786 4.7786 5.4531 5.4531 5.5700 5.5841 5.6444 5.6444 7.9522 7.9522 8.0109 8.0251 8.0251 8.0353 8.1820 8.1820 8.1932 8.2196 8.4721 8.4721 11.7187 11.7270 k = 0.0800 0.0800 0.0800 ( 6502 PWs) bands (ev): -48.9717 -48.9717 -26.6271 -26.6271 -24.5539 -24.5539 -24.5539 -24.5539 -7.3298 -7.3298 -6.4033 -6.4033 -6.3684 -6.3667 -6.3657 -6.3657 0.3722 0.3734 0.3734 0.3757 1.4259 1.4259 1.8871 1.8871 1.9383 1.9500 1.9632 1.9632 2.5760 2.5760 2.6010 2.6070 2.6279 2.6279 3.1462 3.1462 3.1586 3.1698 3.1799 3.1799 3.4362 3.4364 3.4364 3.4537 3.9396 3.9396 3.9812 4.0800 4.0800 4.0898 4.1420 4.1420 4.1877 4.2270 4.2270 4.2373 4.5553 4.5553 4.5974 4.6642 4.7277 4.7277 4.7872 4.7872 5.4162 5.4162 5.5687 5.5847 5.6418 5.6418 7.9472 7.9472 8.0102 8.0243 8.0243 8.0351 8.2034 8.2034 8.2133 8.2406 8.5393 8.5393 11.7149 11.7242 k = 0.0900 0.0900 0.0900 ( 6487 PWs) bands (ev): -48.9716 -48.9716 -26.6271 -26.6271 -24.5539 -24.5539 -24.5539 -24.5539 -7.3201 -7.3201 -6.4070 -6.4070 -6.3724 -6.3706 -6.3692 -6.3692 0.3868 0.3881 0.3881 0.3908 1.4365 1.4365 1.8732 1.8732 1.9402 1.9533 1.9653 1.9653 2.5650 2.5650 2.5880 2.5941 2.6216 2.6216 3.1345 3.1345 3.1467 3.1599 3.1667 3.1667 3.4533 3.4533 3.4549 3.4721 3.9339 3.9339 3.9671 4.0771 4.0771 4.0826 4.1365 4.1365 4.1972 4.2255 4.2255 4.2455 4.5502 4.5502 4.5817 4.6561 4.7308 4.7308 4.8007 4.8007 5.3760 5.3760 5.5670 5.5849 5.6394 5.6394 7.9452 7.9452 8.0099 8.0242 8.0242 8.0352 8.2263 8.2263 8.2352 8.2632 8.6088 8.6088 11.7105 11.7205 k = 0.1000 0.1000 0.1000 ( 6493 PWs) bands (ev): -48.9716 -48.9716 -26.6272 -26.6272 -24.5540 -24.5540 -24.5540 -24.5540 -7.3094 -7.3094 -6.4110 -6.4110 -6.3768 -6.3748 -6.3730 -6.3730 0.4029 0.4042 0.4042 0.4073 1.4482 1.4482 1.8577 1.8577 1.9424 1.9567 1.9676 1.9676 2.5528 2.5528 2.5740 2.5799 2.6148 2.6148 3.1224 3.1224 3.1351 3.1502 3.1523 3.1523 3.4702 3.4702 3.4741 3.4904 3.9278 3.9278 3.9529 4.0730 4.0730 4.0752 4.1311 4.1311 4.2063 4.2242 4.2242 4.2533 4.5447 4.5447 4.5661 4.6479 4.7317 4.7317 4.8187 4.8187 5.3334 5.3334 5.5648 5.5845 5.6367 5.6367 7.9459 7.9459 8.0099 8.0247 8.0247 8.0354 8.2507 8.2507 8.2586 8.2870 8.6799 8.6799 11.7050 11.7156 k = 0.1100 0.1100 0.1100 ( 6493 PWs) bands (ev): -48.9716 -48.9716 -26.6272 -26.6272 -24.5541 -24.5541 -24.5541 -24.5540 -7.2976 -7.2976 -6.4154 -6.4154 -6.3816 -6.3794 -6.3771 -6.3771 0.4204 0.4217 0.4217 0.4252 1.4608 1.4608 1.8407 1.8407 1.9449 1.9604 1.9703 1.9703 2.5395 2.5395 2.5589 2.5646 2.6077 2.6077 3.1099 3.1099 3.1236 3.1369 3.1369 3.1405 3.4871 3.4871 3.4937 3.5086 3.9217 3.9217 3.9386 4.0678 4.0678 4.0679 4.1263 4.1263 4.2151 4.2232 4.2232 4.2607 4.5389 4.5389 4.5512 4.6399 4.7310 4.7310 4.8402 4.8402 5.2889 5.2889 5.5622 5.5836 5.6337 5.6337 7.9492 7.9492 8.0102 8.0259 8.0259 8.0359 8.2762 8.2762 8.2832 8.3121 8.7520 8.7520 11.6987 11.7081 k = 0.1200 0.1200 0.1200 ( 6499 PWs) bands (ev): -48.9716 -48.9716 -26.6273 -26.6273 -24.5541 -24.5541 -24.5541 -24.5541 -7.2848 -7.2848 -6.4202 -6.4202 -6.3867 -6.3844 -6.3815 -6.3815 0.4392 0.4404 0.4404 0.4445 1.4742 1.4742 1.8222 1.8222 1.9477 1.9644 1.9732 1.9732 2.5253 2.5253 2.5430 2.5483 2.6003 2.6003 3.0962 3.0962 3.1124 3.1211 3.1211 3.1308 3.5038 3.5038 3.5135 3.5266 3.9154 3.9154 3.9245 4.0608 4.0614 4.0614 4.1220 4.1220 4.2223 4.2223 4.2231 4.2676 4.5333 4.5333 4.5372 4.6324 4.7292 4.7292 4.8645 4.8645 5.2431 5.2431 5.5589 5.5820 5.6304 5.6304 7.9549 7.9549 8.0107 8.0279 8.0279 8.0365 8.3028 8.3028 8.3088 8.3383 8.8245 8.8245 11.6910 11.6999 k = 0.1300 0.1300 0.1300 ( 6496 PWs) bands (ev): -48.9716 -48.9716 -26.6273 -26.6273 -24.5542 -24.5542 -24.5542 -24.5542 -7.2711 -7.2711 -6.4252 -6.4252 -6.3921 -6.3897 -6.3861 -6.3861 0.4591 0.4604 0.4604 0.4649 1.4884 1.4884 1.8025 1.8025 1.9507 1.9685 1.9764 1.9764 2.5102 2.5102 2.5265 2.5312 2.5925 2.5925 3.0805 3.0805 3.1014 3.1059 3.1059 3.1212 3.5202 3.5202 3.5336 3.5442 3.9093 3.9093 3.9106 4.0540 4.0542 4.0542 4.1181 4.1181 4.2217 4.2217 4.2304 4.2740 4.5247 4.5280 4.5280 4.6256 4.7267 4.7267 4.8910 4.8910 5.1964 5.1964 5.5552 5.5797 5.6267 5.6267 7.9624 7.9624 8.0113 8.0309 8.0309 8.0373 8.3304 8.3304 8.3354 8.3653 8.8966 8.8966 11.6818 11.6895 k = 0.1400 0.1400 0.1400 ( 6487 PWs) bands (ev): -48.9716 -48.9716 -26.6274 -26.6274 -24.5543 -24.5543 -24.5543 -24.5543 -7.2564 -7.2564 -6.4306 -6.4306 -6.3978 -6.3953 -6.3911 -6.3911 0.4801 0.4813 0.4813 0.4864 1.5030 1.5030 1.7817 1.7817 1.9540 1.9728 1.9799 1.9799 2.4945 2.4945 2.5094 2.5135 2.5845 2.5845 3.0620 3.0620 3.0904 3.0920 3.0920 3.1115 3.5361 3.5361 3.5537 3.5614 3.8970 3.9033 3.9033 4.0465 4.0465 4.0477 4.1147 4.1147 4.2214 4.2214 4.2367 4.2797 4.5138 4.5232 4.5232 4.6198 4.7235 4.7235 4.9195 4.9195 5.1495 5.1495 5.5510 5.5769 5.6226 5.6226 7.9713 7.9713 8.0120 8.0352 8.0352 8.0382 8.3587 8.3587 8.3627 8.3931 8.9679 8.9679 11.6709 11.6773 k = 0.1500 0.1500 0.1500 ( 6487 PWs) bands (ev): -48.9716 -48.9716 -26.6274 -26.6274 -24.5544 -24.5544 -24.5544 -24.5544 -7.2409 -7.2409 -6.4362 -6.4362 -6.4038 -6.4011 -6.3962 -6.3962 0.5021 0.5032 0.5032 0.5089 1.5178 1.5178 1.7599 1.7599 1.9576 1.9773 1.9835 1.9835 2.4783 2.4783 2.4919 2.4952 2.5763 2.5763 3.0409 3.0409 3.0793 3.0793 3.0796 3.1017 3.5514 3.5514 3.5736 3.5781 3.8840 3.8976 3.8976 4.0384 4.0384 4.0419 4.1117 4.1117 4.2212 4.2212 4.2417 4.2847 4.5050 4.5190 4.5190 4.6151 4.7196 4.7196 4.9496 4.9496 5.1024 5.1024 5.5463 5.5734 5.6182 5.6182 7.9807 7.9807 8.0128 8.0392 8.0418 8.0418 8.3877 8.3877 8.3906 8.4215 9.0376 9.0376 11.6579 11.6629 k = 0.1600 0.1600 0.1600 ( 6490 PWs) bands (ev): -48.9716 -48.9716 -26.6275 -26.6275 -24.5545 -24.5544 -24.5544 -24.5544 -7.2246 -7.2246 -6.4421 -6.4421 -6.4101 -6.4073 -6.4015 -6.4015 0.5249 0.5259 0.5259 0.5322 1.5323 1.5323 1.7379 1.7379 1.9614 1.9818 1.9873 1.9873 2.4617 2.4617 2.4742 2.4766 2.5679 2.5679 3.0176 3.0176 3.0674 3.0674 3.0687 3.0918 3.5659 3.5659 3.5934 3.5941 3.8717 3.8923 3.8923 4.0303 4.0303 4.0368 4.1088 4.1088 4.2212 4.2212 4.2453 4.2889 4.4983 4.5154 4.5154 4.6115 4.7151 4.7151 4.9808 4.9808 5.0561 5.0561 5.5414 5.5695 5.6135 5.6135 7.9896 7.9896 8.0134 8.0401 8.0514 8.0514 8.4171 8.4171 8.4190 8.4504 9.1052 9.1052 11.6426 11.6461 k = 0.1700 0.1700 0.1700 ( 6490 PWs) bands (ev): -48.9716 -48.9716 -26.6275 -26.6275 -24.5545 -24.5545 -24.5545 -24.5545 -7.2075 -7.2075 -6.4482 -6.4482 -6.4165 -6.4136 -6.4070 -6.4070 0.5483 0.5492 0.5492 0.5561 1.5457 1.5457 1.7163 1.7163 1.9654 1.9865 1.9912 1.9912 2.4450 2.4450 2.4563 2.4579 2.5594 2.5594 2.9927 2.9927 3.0559 3.0559 3.0577 3.0816 3.5795 3.5795 3.6094 3.6127 3.8603 3.8874 3.8874 4.0223 4.0223 4.0324 4.1062 4.1062 4.2213 4.2213 4.2473 4.2923 4.4940 4.5125 4.5125 4.6092 4.7099 4.7099 5.0036 5.0036 5.0201 5.0201 5.5363 5.5653 5.6086 5.6086 7.9969 7.9969 8.0139 8.0410 8.0648 8.0648 8.4470 8.4470 8.4477 8.4798 9.1702 9.1702 11.6247 11.6267 k = 0.1800 0.1800 0.1800 ( 6487 PWs) bands (ev): -48.9715 -48.9715 -26.6276 -26.6276 -24.5546 -24.5546 -24.5546 -24.5546 -7.1897 -7.1897 -6.4545 -6.4545 -6.4231 -6.4201 -6.4127 -6.4127 0.5723 0.5730 0.5730 0.5806 1.5565 1.5565 1.6965 1.6965 1.9696 1.9913 1.9952 1.9952 2.4284 2.4284 2.4386 2.4393 2.5508 2.5508 2.9666 2.9666 3.0447 3.0447 3.0467 3.0712 3.5922 3.5922 3.6240 3.6314 3.8501 3.8831 3.8831 4.0148 4.0148 4.0288 4.1037 4.1037 4.2216 4.2216 4.2479 4.2948 4.4919 4.5102 4.5102 4.6082 4.7039 4.7039 4.9632 4.9632 5.0494 5.0494 5.5311 5.5607 5.6037 5.6037 8.0024 8.0024 8.0144 8.0418 8.0824 8.0824 8.4767 8.4772 8.4772 8.5094 9.2321 9.2321 11.6040 11.6043 k = 0.1900 0.1900 0.1900 ( 6481 PWs) bands (ev): -48.9715 -48.9715 -26.6277 -26.6277 -24.5547 -24.5547 -24.5547 -24.5547 -7.1712 -7.1712 -6.4609 -6.4609 -6.4299 -6.4268 -6.4185 -6.4185 0.5966 0.5971 0.5971 0.6055 1.5620 1.5620 1.6814 1.6814 1.9740 1.9961 1.9993 1.9993 2.4120 2.4120 2.4210 2.4212 2.5421 2.5421 2.9395 2.9395 3.0335 3.0335 3.0355 3.0606 3.6039 3.6039 3.6378 3.6492 3.8414 3.8794 3.8794 4.0079 4.0079 4.0263 4.1014 4.1014 4.2219 4.2219 4.2469 4.2965 4.4921 4.5084 4.5084 4.6084 4.6970 4.6970 4.9196 4.9196 5.0841 5.0841 5.5260 5.5561 5.5989 5.5989 8.0064 8.0064 8.0146 8.0425 8.1036 8.1036 8.5059 8.5076 8.5076 8.5392 9.2907 9.2907 11.5788 11.5800 k = 0.2000 0.2000 0.2000 ( 6487 PWs) bands (ev): -48.9715 -48.9715 -26.6278 -26.6278 -24.5548 -24.5548 -24.5548 -24.5548 -7.1521 -7.1521 -6.4675 -6.4675 -6.4368 -6.4337 -6.4244 -6.4244 0.6211 0.6214 0.6214 0.6306 1.5586 1.5586 1.6743 1.6743 1.9785 2.0009 2.0034 2.0034 2.3961 2.3961 2.4032 2.4042 2.5333 2.5333 2.9117 2.9117 3.0222 3.0222 3.0242 3.0497 3.6144 3.6144 3.6508 3.6657 3.8345 3.8764 3.8764 4.0016 4.0016 4.0247 4.0991 4.0991 4.2223 4.2223 4.2446 4.2974 4.4941 4.5068 4.5068 4.6095 4.6892 4.6892 4.8774 4.8774 5.1199 5.1199 5.5213 5.5516 5.5944 5.5944 8.0092 8.0092 8.0147 8.0431 8.1280 8.1280 8.5353 8.5381 8.5381 8.5691 9.3456 9.3456 11.5499 11.5527 k = 0.2100 0.2100 0.2100 ( 6481 PWs) bands (ev): -48.9715 -48.9715 -26.6278 -26.6278 -24.5549 -24.5549 -24.5549 -24.5549 -7.1325 -7.1325 -6.4742 -6.4742 -6.4438 -6.4406 -6.4304 -6.4304 0.6456 0.6456 0.6457 0.6557 1.5450 1.5450 1.6765 1.6765 1.9830 2.0056 2.0075 2.0075 2.3809 2.3809 2.3861 2.3878 2.5246 2.5246 2.8835 2.8835 3.0110 3.0110 3.0126 3.0384 3.6239 3.6239 3.6631 3.6806 3.8299 3.8740 3.8740 3.9961 3.9961 4.0242 4.0970 4.0970 4.2229 4.2229 4.2412 4.2975 4.4976 4.5052 4.5052 4.6116 4.6803 4.6803 4.8373 4.8373 5.1565 5.1565 5.5171 5.5474 5.5904 5.5904 8.0112 8.0112 8.0146 8.0434 8.1549 8.1549 8.5646 8.5685 8.5685 8.5990 9.3968 9.3968 11.5173 11.5215 k = 0.2200 0.2200 0.2200 ( 6487 PWs) bands (ev): -48.9715 -48.9715 -26.6279 -26.6279 -24.5550 -24.5550 -24.5550 -24.5550 -7.1124 -7.1124 -6.4810 -6.4810 -6.4508 -6.4476 -6.4364 -6.4364 0.6697 0.6697 0.6701 0.6807 1.5239 1.5239 1.6853 1.6853 1.9877 2.0102 2.0115 2.0115 2.3666 2.3666 2.3698 2.3723 2.5159 2.5159 2.8553 2.8553 2.9995 2.9995 3.0009 3.0269 3.6324 3.6324 3.6746 3.6934 3.8279 3.8722 3.8722 3.9914 3.9914 4.0245 4.0950 4.0950 4.2234 4.2234 4.2367 4.2969 4.5022 4.5032 4.5032 4.6144 4.6699 4.6699 4.7996 4.7996 5.1937 5.1937 5.5138 5.5437 5.5870 5.5870 8.0127 8.0127 8.0143 8.0436 8.1841 8.1841 8.5938 8.5989 8.5989 8.6289 9.4441 9.4441 11.4807 11.4863 k = 0.2300 0.2300 0.2300 ( 6481 PWs) bands (ev): -48.9715 -48.9715 -26.6280 -26.6280 -24.5551 -24.5551 -24.5551 -24.5551 -7.0918 -7.0918 -6.4879 -6.4879 -6.4579 -6.4547 -6.4425 -6.4425 0.6934 0.6934 0.6942 0.7053 1.4983 1.4983 1.6975 1.6975 1.9924 2.0147 2.0155 2.0155 2.3533 2.3533 2.3548 2.3578 2.5072 2.5072 2.8273 2.8273 2.9880 2.9880 2.9890 3.0151 3.6399 3.6399 3.6855 3.7038 3.8291 3.8710 3.8710 3.9874 3.9874 4.0259 4.0931 4.0931 4.2238 4.2238 4.2315 4.2955 4.5003 4.5003 4.5076 4.6176 4.6582 4.6582 4.7653 4.7653 5.2314 5.2314 5.5115 5.5408 5.5846 5.5846 8.0137 8.0137 8.0138 8.0435 8.2152 8.2152 8.6230 8.6290 8.6290 8.6585 9.4876 9.4876 11.4400 11.4468 k = 0.2400 0.2400 0.2400 ( 6481 PWs) bands (ev): -48.9715 -48.9715 -26.6280 -26.6280 -24.5552 -24.5552 -24.5552 -24.5552 -7.0710 -7.0710 -6.4947 -6.4947 -6.4650 -6.4618 -6.4486 -6.4486 0.7165 0.7165 0.7179 0.7295 1.4702 1.4702 1.7112 1.7112 1.9971 2.0190 2.0193 2.0193 2.3411 2.3414 2.3414 2.3445 2.4986 2.4986 2.8000 2.8000 2.9764 2.9764 2.9768 3.0030 3.6466 3.6466 3.6959 3.7117 3.8333 3.8703 3.8703 3.9842 3.9842 4.0281 4.0913 4.0913 4.2243 4.2243 4.2257 4.2936 4.4957 4.4957 4.5131 4.6209 4.6448 4.6448 4.7348 4.7348 5.2694 5.2694 5.5105 5.5390 5.5833 5.5833 8.0131 8.0144 8.0144 8.0433 8.2479 8.2479 8.6518 8.6589 8.6589 8.6878 9.5276 9.5276 11.3950 11.4028 k = 0.2500 0.2500 0.2500 ( 6493 PWs) bands (ev): -48.9715 -48.9715 -26.6281 -26.6281 -24.5554 -24.5554 -24.5554 -24.5553 -7.0498 -7.0498 -6.5016 -6.5016 -6.4721 -6.4688 -6.4547 -6.4547 0.7390 0.7390 0.7408 0.7529 1.4407 1.4407 1.7250 1.7250 2.0018 2.0230 2.0230 2.0231 2.3288 2.3308 2.3308 2.3325 2.4902 2.4902 2.7736 2.7736 2.9645 2.9646 2.9646 2.9906 3.6525 3.6525 3.7060 3.7173 3.8403 3.8701 3.8701 3.9815 3.9815 4.0310 4.0896 4.0896 4.2195 4.2246 4.2246 4.2912 4.4886 4.4886 4.5185 4.6240 4.6301 4.6301 4.7086 4.7086 5.3077 5.3077 5.5111 5.5386 5.5835 5.5835 8.0123 8.0148 8.0148 8.0428 8.2820 8.2820 8.6803 8.6883 8.6883 8.7167 9.5642 9.5642 11.3455 11.3542 k = 0.2600 0.2600 0.2600 ( 6481 PWs) bands (ev): -48.9715 -48.9715 -26.6282 -26.6282 -24.5555 -24.5555 -24.5555 -24.5555 -7.0284 -7.0284 -6.5085 -6.5085 -6.4791 -6.4759 -6.4608 -6.4608 0.7605 0.7605 0.7630 0.7756 1.4104 1.4104 1.7382 1.7382 2.0066 2.0266 2.0266 2.0270 2.3183 2.3218 2.3218 2.3220 2.4819 2.4819 2.7486 2.7486 2.9521 2.9528 2.9528 2.9781 3.6579 3.6579 3.7158 3.7213 3.8495 3.8703 3.8703 3.9796 3.9796 4.0346 4.0881 4.0881 4.2129 4.2249 4.2249 4.2883 4.4781 4.4781 4.5233 4.6152 4.6152 4.6266 4.6865 4.6865 5.3460 5.3460 5.5136 5.5398 5.5854 5.5854 8.0115 8.0150 8.0150 8.0422 8.3170 8.3170 8.7084 8.7171 8.7171 8.7451 9.5979 9.5979 11.2917 11.3010 k = 0.2700 0.2700 0.2700 ( 6472 PWs) bands (ev): -48.9714 -48.9714 -26.6283 -26.6283 -24.5556 -24.5556 -24.5556 -24.5556 -7.0069 -7.0069 -6.5153 -6.5153 -6.4860 -6.4828 -6.4669 -6.4669 0.7810 0.7810 0.7842 0.7972 1.3796 1.3796 1.7504 1.7504 2.0113 2.0302 2.0302 2.0308 2.3094 2.3131 2.3145 2.3145 2.4739 2.4739 2.7253 2.7253 2.9395 2.9408 2.9408 2.9653 3.6628 3.6628 3.7243 3.7255 3.8603 3.8708 3.8708 3.9781 3.9781 4.0386 4.0866 4.0866 4.2061 4.2249 4.2249 4.2850 4.4638 4.4638 4.5273 4.6012 4.6012 4.6284 4.6677 4.6677 5.3843 5.3843 5.5182 5.5430 5.5893 5.5893 8.0105 8.0152 8.0152 8.0415 8.3529 8.3529 8.7358 8.7452 8.7452 8.7727 9.6291 9.6291 11.2336 11.2433 k = 0.2800 0.2800 0.2800 ( 6469 PWs) bands (ev): -48.9714 -48.9714 -26.6283 -26.6283 -24.5557 -24.5557 -24.5557 -24.5557 -6.9854 -6.9854 -6.5220 -6.5220 -6.4928 -6.4897 -6.4729 -6.4729 0.8003 0.8003 0.8042 0.8176 1.3488 1.3488 1.7609 1.7609 2.0160 2.0336 2.0336 2.0344 2.3024 2.3059 2.3089 2.3089 2.4660 2.4660 2.7041 2.7041 2.9269 2.9288 2.9288 2.9524 3.6674 3.6674 3.7269 3.7352 3.8716 3.8716 3.8719 3.9769 3.9769 4.0430 4.0852 4.0852 4.1991 4.2247 4.2247 4.2813 4.4458 4.4458 4.5300 4.5889 4.5889 4.6291 4.6513 4.6513 5.4222 5.4222 5.5252 5.5483 5.5953 5.5953 8.0096 8.0152 8.0152 8.0407 8.3892 8.3892 8.7624 8.7723 8.7723 8.7994 9.6581 9.6581 11.1715 11.1815 k = 0.2900 0.2900 0.2900 ( 6469 PWs) bands (ev): -48.9714 -48.9714 -26.6284 -26.6284 -24.5558 -24.5558 -24.5558 -24.5558 -6.9639 -6.9639 -6.5286 -6.5286 -6.4995 -6.4964 -6.4789 -6.4789 0.8183 0.8183 0.8230 0.8367 1.3181 1.3181 1.7695 1.7695 2.0207 2.0371 2.0371 2.0379 2.2972 2.3003 2.3051 2.3051 2.4584 2.4584 2.6855 2.6855 2.9142 2.9167 2.9167 2.9394 3.6717 3.6717 3.7295 3.7450 3.8727 3.8727 3.8840 3.9761 3.9761 4.0476 4.0837 4.0837 4.1919 4.2242 4.2242 4.2773 4.4250 4.4250 4.5313 4.5779 4.5779 4.6285 4.6363 4.6363 5.4598 5.4598 5.5346 5.5559 5.6038 5.6038 8.0087 8.0153 8.0153 8.0398 8.4257 8.4257 8.7880 8.7984 8.7984 8.8250 9.6853 9.6853 11.1059 11.1159 k = 0.3000 0.3000 0.3000 ( 6475 PWs) bands (ev): -48.9714 -48.9714 -26.6285 -26.6285 -24.5559 -24.5559 -24.5559 -24.5559 -6.9425 -6.9425 -6.5350 -6.5350 -6.5061 -6.5030 -6.4848 -6.4848 0.8349 0.8349 0.8404 0.8543 1.2877 1.2877 1.7759 1.7759 2.0255 2.0407 2.0407 2.0414 2.2937 2.2965 2.3028 2.3028 2.4510 2.4510 2.6696 2.6696 2.9015 2.9047 2.9047 2.9263 3.6760 3.6760 3.7326 3.7550 3.8740 3.8740 3.8961 3.9754 3.9754 4.0523 4.0823 4.0823 4.1846 4.2234 4.2234 4.2730 4.4026 4.4026 4.5309 4.5678 4.5678 4.6223 4.6223 4.6262 5.4966 5.4966 5.5466 5.5661 5.6149 5.6149 8.0079 8.0154 8.0154 8.0389 8.4621 8.4621 8.8125 8.8232 8.8232 8.8494 9.7113 9.7113 11.0373 11.0472 k = 0.3100 0.3100 0.3100 ( 6469 PWs) bands (ev): -48.9714 -48.9714 -26.6285 -26.6285 -24.5560 -24.5560 -24.5560 -24.5560 -6.9212 -6.9212 -6.5413 -6.5413 -6.5125 -6.5095 -6.4906 -6.4906 0.8499 0.8499 0.8564 0.8705 1.2578 1.2578 1.7798 1.7798 2.0305 2.0445 2.0445 2.0451 2.2920 2.2942 2.3021 2.3021 2.4441 2.4441 2.6568 2.6568 2.8889 2.8927 2.8927 2.9133 3.6801 3.6801 3.7362 3.7654 3.8755 3.8755 3.9081 3.9748 3.9748 4.0570 4.0809 4.0809 4.1774 4.2221 4.2221 4.2684 4.3798 4.3798 4.5288 4.5577 4.5577 4.6090 4.6090 4.6222 5.5326 5.5326 5.5612 5.5788 5.6288 5.6288 8.0073 8.0156 8.0156 8.0382 8.4981 8.4981 8.8356 8.8465 8.8465 8.8722 9.7363 9.7363 10.9664 10.9759 k = 0.3200 0.3200 0.3200 ( 6454 PWs) bands (ev): -48.9713 -48.9713 -26.6286 -26.6286 -24.5561 -24.5561 -24.5561 -24.5561 -6.9002 -6.9002 -6.5475 -6.5475 -6.5186 -6.5158 -6.4964 -6.4964 0.8634 0.8634 0.8709 0.8851 1.2287 1.2287 1.7811 1.7811 2.0356 2.0485 2.0485 2.0490 2.2917 2.2935 2.3029 2.3029 2.4374 2.4374 2.6471 2.6471 2.8764 2.8808 2.8808 2.9003 3.6842 3.6842 3.7406 3.7762 3.8773 3.8773 3.9198 3.9743 3.9743 4.0616 4.0794 4.0794 4.1701 4.2203 4.2203 4.2638 4.3575 4.3575 4.5249 4.5471 4.5471 4.5962 4.5962 4.6164 5.5673 5.5673 5.5784 5.5940 5.6456 5.6456 8.0070 8.0160 8.0160 8.0376 8.5335 8.5335 8.8571 8.8680 8.8680 8.8932 9.7608 9.7608 10.8938 10.9030 k = 0.3300 0.3300 0.3300 ( 6455 PWs) bands (ev): -48.9713 -48.9713 -26.6287 -26.6287 -24.5562 -24.5562 -24.5561 -24.5561 -6.8796 -6.8796 -6.5534 -6.5534 -6.5246 -6.5218 -6.5020 -6.5020 0.8754 0.8754 0.8840 0.8980 1.2003 1.2003 1.7799 1.7799 2.0410 2.0529 2.0529 2.0533 2.2928 2.2942 2.3049 2.3049 2.4311 2.4311 2.6408 2.6408 2.8641 2.8689 2.8689 2.8874 3.6882 3.6882 3.7457 3.7873 3.8793 3.8793 3.9311 3.9737 3.9737 4.0660 4.0777 4.0777 4.1629 4.2179 4.2179 4.2589 4.3365 4.3365 4.5192 4.5356 4.5356 4.5837 4.5837 4.6086 5.5979 5.6005 5.6005 5.6117 5.6655 5.6655 8.0071 8.0167 8.0167 8.0372 8.5679 8.5679 8.8766 8.8874 8.8874 8.9122 9.7851 9.7851 10.8205 10.8292 k = 0.3400 0.3400 0.3400 ( 6446 PWs) bands (ev): -48.9712 -48.9712 -26.6287 -26.6287 -24.5563 -24.5562 -24.5562 -24.5562 -6.8593 -6.8593 -6.5592 -6.5592 -6.5303 -6.5276 -6.5076 -6.5076 0.8858 0.8858 0.8955 0.9093 1.1729 1.1729 1.7762 1.7762 2.0466 2.0578 2.0578 2.0579 2.2950 2.2961 2.3080 2.3080 2.4252 2.4252 2.6376 2.6376 2.8520 2.8572 2.8572 2.8747 3.6921 3.6921 3.7516 3.7989 3.8815 3.8815 3.9418 3.9731 3.9731 4.0700 4.0758 4.0758 4.1559 4.2148 4.2148 4.2539 4.3175 4.3175 4.5118 4.5233 4.5233 4.5712 4.5712 4.5990 5.6197 5.6318 5.6320 5.6320 5.6883 5.6883 8.0075 8.0177 8.0177 8.0371 8.6011 8.6011 8.8940 8.9046 8.9046 8.9288 9.8094 9.8094 10.7473 10.7555 k = 0.3500 0.3500 0.3500 ( 6458 PWs) bands (ev): -48.9713 -48.9713 -26.6288 -26.6288 -24.5563 -24.5563 -24.5563 -24.5563 -6.8396 -6.8396 -6.5647 -6.5647 -6.5357 -6.5332 -6.5132 -6.5132 0.8946 0.8946 0.9055 0.9191 1.1467 1.1467 1.7701 1.7701 2.0526 2.0630 2.0630 2.0630 2.2981 2.2990 2.3120 2.3120 2.4197 2.4197 2.6374 2.6374 2.8402 2.8458 2.8458 2.8622 3.6959 3.6959 3.7584 3.8108 3.8840 3.8840 3.9521 3.9723 3.9723 4.0734 4.0735 4.0735 4.1493 4.2108 4.2108 4.2488 4.3008 4.3008 4.5028 4.5103 4.5103 4.5585 4.5585 4.5876 5.6434 5.6538 5.6619 5.6619 5.7135 5.7135 8.0085 8.0191 8.0191 8.0374 8.6329 8.6329 8.9089 8.9191 8.9191 8.9428 9.8338 9.8338 10.6750 10.6827 k = 0.3600 0.3600 0.3600 ( 6470 PWs) bands (ev): -48.9714 -48.9714 -26.6289 -26.6289 -24.5564 -24.5564 -24.5564 -24.5564 -6.8203 -6.8203 -6.5699 -6.5699 -6.5409 -6.5385 -6.5186 -6.5186 0.9021 0.9021 0.9142 0.9274 1.1217 1.1217 1.7620 1.7620 2.0589 2.0686 2.0686 2.0686 2.3021 2.3028 2.3166 2.3166 2.4146 2.4146 2.6399 2.6399 2.8288 2.8345 2.8345 2.8499 3.6995 3.6995 3.7661 3.8232 3.8867 3.8867 3.9618 3.9713 3.9713 4.0709 4.0709 4.0760 4.1432 4.2059 4.2059 4.2436 4.2870 4.2870 4.4924 4.4967 4.4967 4.5454 4.5454 4.5745 5.6687 5.6776 5.6904 5.6904 5.7404 5.7404 8.0100 8.0209 8.0209 8.0381 8.6630 8.6630 8.9210 8.9309 8.9309 8.9539 9.8585 9.8585 10.6047 10.6118 k = 0.3700 0.3700 0.3700 ( 6458 PWs) bands (ev): -48.9713 -48.9713 -26.6289 -26.6289 -24.5565 -24.5565 -24.5565 -24.5565 -6.8017 -6.8017 -6.5749 -6.5749 -6.5458 -6.5435 -6.5240 -6.5240 0.9081 0.9081 0.9215 0.9342 1.0980 1.0980 1.7523 1.7523 2.0655 2.0746 2.0746 2.0746 2.3066 2.3072 2.3217 2.3217 2.4101 2.4101 2.6449 2.6449 2.8178 2.8236 2.8236 2.8380 3.7028 3.7028 3.7746 3.8360 3.8898 3.8898 3.9701 3.9701 3.9709 4.0678 4.0678 4.0775 4.1382 4.2004 4.2004 4.2385 4.2760 4.2760 4.4809 4.4829 4.4829 4.5318 4.5318 4.5600 5.6952 5.7027 5.7182 5.7182 5.7681 5.7681 8.0122 8.0232 8.0232 8.0393 8.6914 8.6914 8.9303 8.9395 8.9395 8.9619 9.8835 9.8835 10.5371 10.5436 k = 0.3800 0.3800 0.3800 ( 6458 PWs) bands (ev): -48.9713 -48.9713 -26.6290 -26.6290 -24.5566 -24.5566 -24.5566 -24.5566 -6.7838 -6.7838 -6.5796 -6.5796 -6.5504 -6.5482 -6.5293 -6.5293 0.9129 0.9129 0.9276 0.9397 1.0758 1.0758 1.7413 1.7413 2.0724 2.0808 2.0808 2.0810 2.3114 2.3121 2.3269 2.3269 2.4062 2.4062 2.6518 2.6518 2.8074 2.8131 2.8131 2.8266 3.7058 3.7058 3.7840 3.8491 3.8932 3.8932 3.9687 3.9687 3.9795 4.0643 4.0643 4.0775 4.1344 4.1947 4.1947 4.2334 4.2676 4.2676 4.4686 4.4690 4.4690 4.5178 4.5178 4.5442 5.7225 5.7288 5.7454 5.7454 5.7958 5.7958 8.0151 8.0261 8.0261 8.0410 8.7178 8.7178 8.9363 8.9449 8.9449 8.9665 9.9087 9.9087 10.4730 10.4791 k = 0.3900 0.3900 0.3900 ( 6458 PWs) bands (ev): -48.9713 -48.9713 -26.6290 -26.6290 -24.5566 -24.5566 -24.5566 -24.5566 -6.7666 -6.7666 -6.5840 -6.5840 -6.5546 -6.5526 -6.5345 -6.5345 0.9166 0.9166 0.9327 0.9441 1.0552 1.0552 1.7295 1.7295 2.0795 2.0873 2.0873 2.0876 2.3165 2.3173 2.3322 2.3322 2.4030 2.4030 2.6603 2.6603 2.7975 2.8030 2.8030 2.8156 3.7083 3.7083 3.7941 3.8623 3.8968 3.8968 3.9671 3.9671 3.9874 4.0603 4.0603 4.0755 4.1324 4.1892 4.1892 4.2283 4.2615 4.2615 4.4552 4.4552 4.4556 4.5034 4.5034 4.5274 5.7501 5.7553 5.7720 5.7720 5.8227 5.8227 8.0186 8.0296 8.0296 8.0433 8.7421 8.7421 8.9391 8.9469 8.9469 8.9677 9.9341 9.9341 10.4133 10.4189 k = 0.4000 0.4000 0.4000 ( 6479 PWs) bands (ev): -48.9714 -48.9714 -26.6291 -26.6291 -24.5567 -24.5567 -24.5567 -24.5567 -6.7502 -6.7502 -6.5882 -6.5882 -6.5586 -6.5567 -6.5397 -6.5397 0.9192 0.9192 0.9368 0.9473 1.0362 1.0362 1.7172 1.7172 2.0866 2.0938 2.0938 2.0943 2.3216 2.3225 2.3372 2.3372 2.4004 2.4004 2.6699 2.6699 2.7882 2.7934 2.7934 2.8051 3.7104 3.7104 3.8050 3.8756 3.9007 3.9007 3.9653 3.9653 3.9946 4.0559 4.0559 4.0717 4.1321 4.1844 4.1844 4.2233 4.2572 4.2572 4.4418 4.4418 4.4423 4.4886 4.4886 4.5099 5.7775 5.7818 5.7979 5.7979 5.8486 5.8486 8.0229 8.0335 8.0335 8.0462 8.7644 8.7644 8.9387 8.9457 8.9457 8.9655 9.9592 9.9592 10.3584 10.3636 k = 0.4100 0.4100 0.4100 ( 6485 PWs) bands (ev): -48.9714 -48.9714 -26.6291 -26.6291 -24.5568 -24.5568 -24.5568 -24.5568 -6.7346 -6.7346 -6.5921 -6.5921 -6.5621 -6.5605 -6.5447 -6.5447 0.9209 0.9209 0.9400 0.9497 1.0190 1.0190 1.7049 1.7049 2.0937 2.1003 2.1003 2.1010 2.3267 2.3277 2.3417 2.3417 2.3987 2.3987 2.6801 2.6801 2.7797 2.7844 2.7844 2.7953 3.7119 3.7119 3.8165 3.8888 3.9048 3.9048 3.9634 3.9634 4.0012 4.0514 4.0514 4.0662 4.1334 4.1806 4.1806 4.2183 4.2542 4.2542 4.4289 4.4289 4.4290 4.4737 4.4737 4.4919 5.8043 5.8078 5.8228 5.8228 5.8731 5.8731 8.0278 8.0380 8.0380 8.0496 8.7844 8.7844 8.9352 8.9413 8.9413 8.9600 9.9840 9.9840 10.3090 10.3137 k = 0.4200 0.4200 0.4200 ( 6479 PWs) bands (ev): -48.9714 -48.9714 -26.6292 -26.6292 -24.5568 -24.5568 -24.5568 -24.5568 -6.7199 -6.7199 -6.5957 -6.5957 -6.5653 -6.5638 -6.5498 -6.5498 0.9219 0.9219 0.9426 0.9514 1.0036 1.0036 1.6929 1.6929 2.1006 2.1066 2.1066 2.1075 2.3315 2.3327 2.3454 2.3454 2.3978 2.3978 2.6906 2.6906 2.7719 2.7761 2.7761 2.7861 3.7130 3.7130 3.8286 3.9015 3.9091 3.9091 3.9616 3.9616 4.0072 4.0469 4.0469 4.0597 4.1358 4.1778 4.1778 4.2136 4.2522 4.2522 4.4161 4.4169 4.4169 4.4589 4.4589 4.4737 5.8300 5.8328 5.8462 5.8462 5.8960 5.8960 8.0333 8.0429 8.0429 8.0534 8.8022 8.8022 8.9290 8.9341 8.9341 8.9516 10.0080 10.0080 10.2652 10.2695 k = 0.4300 0.4300 0.4300 ( 6482 PWs) bands (ev): -48.9714 -48.9714 -26.6292 -26.6292 -24.5569 -24.5569 -24.5569 -24.5569 -6.7062 -6.7062 -6.5990 -6.5990 -6.5682 -6.5669 -6.5547 -6.5547 0.9220 0.9220 0.9446 0.9524 0.9902 0.9902 1.6816 1.6816 2.1073 2.1126 2.1126 2.1137 2.3361 2.3373 2.3484 2.3484 2.3979 2.3979 2.7009 2.7009 2.7650 2.7685 2.7685 2.7778 3.7135 3.7135 3.8412 3.9133 3.9133 3.9135 3.9598 3.9598 4.0123 4.0426 4.0426 4.0525 4.1392 4.1760 4.1760 4.2088 4.2512 4.2512 4.4039 4.4058 4.4058 4.4445 4.4445 4.4558 5.8541 5.8563 5.8678 5.8678 5.9171 5.9171 8.0393 8.0482 8.0482 8.0575 8.8178 8.8178 8.9206 8.9248 8.9248 8.9409 10.0307 10.0307 10.2273 10.2312 k = 0.4400 0.4400 0.4400 ( 6494 PWs) bands (ev): -48.9715 -48.9715 -26.6292 -26.6292 -24.5569 -24.5569 -24.5569 -24.5569 -6.6935 -6.6935 -6.6022 -6.6022 -6.5707 -6.5695 -6.5595 -6.5595 0.9216 0.9216 0.9462 0.9529 0.9788 0.9788 1.6712 1.6712 2.1136 2.1181 2.1181 2.1194 2.3402 2.3415 2.3504 2.3504 2.3987 2.3987 2.7106 2.7106 2.7591 2.7617 2.7617 2.7702 3.7136 3.7136 3.8541 3.9173 3.9173 3.9242 3.9584 3.9584 4.0166 4.0384 4.0384 4.0451 4.1432 4.1749 4.1749 4.2042 4.2508 4.2508 4.3928 4.3958 4.3958 4.4305 4.4305 4.4383 5.8761 5.8778 5.8871 5.8871 5.9361 5.9361 8.0456 8.0536 8.0536 8.0617 8.8312 8.8312 8.9108 8.9139 8.9139 8.9286 10.0517 10.0517 10.1952 10.1987 k = 0.4500 0.4500 0.4500 ( 6476 PWs) bands (ev): -48.9714 -48.9714 -26.6292 -26.6292 -24.5570 -24.5570 -24.5570 -24.5570 -6.6818 -6.6818 -6.6051 -6.6051 -6.5727 -6.5718 -6.5640 -6.5640 0.9206 0.9206 0.9474 0.9530 0.9696 0.9696 1.6619 1.6619 2.1192 2.1230 2.1230 2.1243 2.3439 2.3451 2.3517 2.3517 2.4000 2.4000 2.7194 2.7194 2.7541 2.7559 2.7559 2.7635 3.7134 3.7134 3.8673 3.9209 3.9209 3.9332 3.9576 3.9576 4.0202 4.0348 4.0348 4.0381 4.1478 4.1745 4.1745 4.1996 4.2511 4.2511 4.3831 4.3872 4.3872 4.4176 4.4176 4.4219 5.8956 5.8968 5.9039 5.9039 5.9529 5.9529 8.0519 8.0588 8.0588 8.0658 8.8425 8.8425 8.9004 8.9025 8.9025 8.9156 10.0706 10.0706 10.1689 10.1718 k = 0.4600 0.4600 0.4600 ( 6488 PWs) bands (ev): -48.9714 -48.9714 -26.6293 -26.6293 -24.5570 -24.5570 -24.5570 -24.5570 -6.6714 -6.6714 -6.6079 -6.6079 -6.5744 -6.5737 -6.5682 -6.5682 0.9192 0.9192 0.9483 0.9529 0.9624 0.9624 1.6541 1.6541 2.1242 2.1271 2.1271 2.1285 2.3470 2.3481 2.3525 2.3525 2.4016 2.4016 2.7270 2.7270 2.7501 2.7510 2.7510 2.7578 3.7130 3.7130 3.8804 3.9237 3.9237 3.9394 3.9574 3.9574 4.0227 4.0314 4.0314 4.0319 4.1529 4.1744 4.1744 4.1950 4.2518 4.2518 4.3752 4.3801 4.3801 4.4058 4.4058 4.4069 5.9121 5.9130 5.9179 5.9179 5.9671 5.9671 8.0580 8.0637 8.0637 8.0694 8.8515 8.8515 8.8904 8.8915 8.8915 8.9028 10.0866 10.0866 10.1479 10.1503 k = 0.4700 0.4700 0.4700 ( 6476 PWs) bands (ev): -48.9714 -48.9714 -26.6293 -26.6293 -24.5570 -24.5570 -24.5570 -24.5570 -6.6623 -6.6623 -6.6106 -6.6106 -6.5757 -6.5752 -6.5719 -6.5719 0.9177 0.9177 0.9491 0.9526 0.9571 0.9571 1.6479 1.6479 2.1284 2.1305 2.1305 2.1317 2.3495 2.3504 2.3529 2.3529 2.4031 2.4031 2.7329 2.7329 2.7473 2.7474 2.7474 2.7530 3.7125 3.7125 3.8934 3.9257 3.9257 3.9421 3.9577 3.9577 4.0244 4.0275 4.0286 4.0286 4.1582 4.1745 4.1745 4.1903 4.2528 4.2528 4.3696 4.3747 4.3747 4.3936 4.3957 4.3957 5.9254 5.9261 5.9289 5.9289 5.9786 5.9786 8.0636 8.0680 8.0680 8.0723 8.8583 8.8583 8.8817 8.8819 8.8819 8.8912 10.0994 10.0994 10.1321 10.1340 k = 0.4800 0.4800 0.4800 ( 6488 PWs) bands (ev): -48.9714 -48.9714 -26.6293 -26.6293 -24.5570 -24.5570 -24.5570 -24.5570 -6.6549 -6.6549 -6.6132 -6.6132 -6.5766 -6.5763 -6.5748 -6.5748 0.9163 0.9163 0.9498 0.9521 0.9537 0.9537 1.6433 1.6433 2.1316 2.1330 2.1330 2.1339 2.3513 2.3520 2.3530 2.3530 2.4044 2.4044 2.7368 2.7368 2.7453 2.7453 2.7454 2.7493 3.7120 3.7120 3.9059 3.9269 3.9269 3.9409 3.9584 3.9584 4.0250 4.0251 4.0265 4.0265 4.1637 4.1747 4.1747 4.1854 4.2538 4.2538 4.3664 4.3711 4.3711 4.3826 4.3877 4.3877 5.9351 5.9355 5.9368 5.9368 5.9870 5.9870 8.0683 8.0713 8.0713 8.0742 8.8625 8.8625 8.8749 8.8749 8.8753 8.8817 10.1080 10.1080 10.1211 10.1224 k = 0.4900 0.4900 0.4900 ( 6488 PWs) bands (ev): -48.9714 -48.9714 -26.6293 -26.6293 -24.5570 -24.5570 -24.5570 -24.5570 -6.6499 -6.6499 -6.6152 -6.6152 -6.5772 -6.5770 -6.5766 -6.5766 0.9153 0.9153 0.9504 0.9516 0.9517 0.9517 1.6405 1.6405 2.1339 2.1345 2.1345 2.1350 2.3525 2.3529 2.3531 2.3531 2.4052 2.4052 2.7382 2.7382 2.7447 2.7450 2.7450 2.7467 3.7117 3.7117 3.9175 3.9276 3.9276 3.9358 3.9591 3.9591 4.0244 4.0251 4.0251 4.0251 4.1693 4.1748 4.1748 4.1802 4.2545 4.2545 4.3660 4.3691 4.3691 4.3742 4.3824 4.3824 5.9411 5.9413 5.9416 5.9416 5.9921 5.9921 8.0718 8.0733 8.0733 8.0748 8.8635 8.8635 8.8718 8.8720 8.8720 8.8750 10.1121 10.1121 10.1148 10.1154 k = 0.5000 0.5000 0.5000 ( 6488 PWs) bands (ev): -48.9714 -48.9714 -26.6293 -26.6293 -24.5570 -24.5570 -24.5570 -24.5570 -6.6480 -6.6480 -6.6160 -6.6160 -6.5773 -6.5773 -6.5773 -6.5773 0.9150 0.9150 0.9510 0.9510 0.9510 0.9510 1.6396 1.6396 2.1350 2.1350 2.1350 2.1350 2.3531 2.3531 2.3531 2.3531 2.4055 2.4055 2.7384 2.7384 2.7452 2.7452 2.7452 2.7452 3.7115 3.7115 3.9278 3.9278 3.9278 3.9278 3.9593 3.9593 4.0246 4.0246 4.0246 4.0246 4.1749 4.1749 4.1749 4.1749 4.2548 4.2548 4.3686 4.3686 4.3686 4.3686 4.3805 4.3805 5.9431 5.9431 5.9431 5.9431 5.9938 5.9938 8.0741 8.0741 8.0741 8.0741 8.8631 8.8631 8.8717 8.8717 8.8717 8.8717 10.1129 10.1129 10.1129 10.1129 k = 0.5000 0.5000 0.5000 ( 6488 PWs) bands (ev): -48.9714 -48.9714 -26.6293 -26.6293 -24.5570 -24.5570 -24.5570 -24.5570 -6.6480 -6.6480 -6.6160 -6.6160 -6.5773 -6.5773 -6.5773 -6.5773 0.9150 0.9150 0.9510 0.9510 0.9510 0.9510 1.6396 1.6396 2.1350 2.1350 2.1350 2.1350 2.3531 2.3531 2.3531 2.3531 2.4055 2.4055 2.7384 2.7384 2.7452 2.7452 2.7452 2.7452 3.7115 3.7115 3.9278 3.9278 3.9278 3.9278 3.9593 3.9593 4.0246 4.0246 4.0246 4.0246 4.1749 4.1749 4.1749 4.1749 4.2548 4.2548 4.3686 4.3686 4.3686 4.3686 4.3805 4.3805 5.9431 5.9431 5.9431 5.9431 5.9938 5.9938 8.0741 8.0741 8.0741 8.0741 8.8631 8.8631 8.8717 8.8717 8.8717 8.8717 10.1129 10.1129 10.1129 10.1129 k = 0.4878 0.5000 0.4878 ( 6488 PWs) bands (ev): -48.9714 -48.9714 -26.6293 -26.6293 -24.5570 -24.5570 -24.5570 -24.5570 -6.6499 -6.6498 -6.6152 -6.6151 -6.5772 -6.5770 -6.5766 -6.5765 0.9153 0.9153 0.9505 0.9515 0.9516 0.9518 1.6405 1.6405 2.1339 2.1343 2.1346 2.1350 2.3525 2.3528 2.3531 2.3532 2.4052 2.4052 2.7381 2.7384 2.7445 2.7449 2.7454 2.7466 3.7116 3.7117 3.9179 3.9252 3.9298 3.9356 3.9590 3.9591 4.0242 4.0248 4.0252 4.0255 4.1695 4.1735 4.1762 4.1800 4.2545 4.2545 4.3658 4.3683 4.3703 4.3741 4.3822 4.3825 5.9409 5.9411 5.9417 5.9418 5.9921 5.9921 8.0717 8.0732 8.0736 8.0750 8.8633 8.8638 8.8717 8.8719 8.8721 8.8749 10.1123 10.1125 10.1145 10.1152 k = 0.4756 0.5000 0.4756 ( 6488 PWs) bands (ev): -48.9714 -48.9714 -26.6293 -26.6293 -24.5570 -24.5570 -24.5570 -24.5570 -6.6549 -6.6547 -6.6134 -6.6131 -6.5769 -6.5765 -6.5746 -6.5743 0.9163 0.9163 0.9501 0.9523 0.9530 0.9538 1.6433 1.6433 2.1316 2.1328 2.1332 2.1340 2.3510 2.3516 2.3532 2.3535 2.4044 2.4044 2.7362 2.7384 2.7429 2.7458 2.7466 2.7490 3.7120 3.7120 3.9066 3.9223 3.9310 3.9410 3.9584 3.9584 4.0237 4.0245 4.0272 4.0276 4.1641 4.1721 4.1772 4.1849 4.2538 4.2540 4.3642 4.3704 4.3739 4.3826 4.3866 4.3882 5.9344 5.9348 5.9375 5.9377 5.9870 5.9871 8.0673 8.0710 8.0716 8.0752 8.8618 8.8656 8.8724 8.8742 8.8759 8.8818 10.1100 10.1101 10.1191 10.1203 k = 0.4634 0.5000 0.4634 ( 6478 PWs) bands (ev): -48.9714 -48.9714 -26.6293 -26.6293 -24.5570 -24.5570 -24.5570 -24.5570 -6.6621 -6.6618 -6.6114 -6.6104 -6.5764 -6.5757 -6.5716 -6.5710 0.9177 0.9179 0.9499 0.9531 0.9558 0.9570 1.6478 1.6479 2.1283 2.1303 2.1306 2.1321 2.3487 2.3495 2.3534 2.3538 2.4033 2.4033 2.7322 2.7372 2.7414 2.7483 2.7492 2.7525 3.7124 3.7125 3.8944 3.9192 3.9304 3.9434 3.9577 3.9580 4.0236 4.0236 4.0294 4.0319 4.1586 4.1712 4.1777 4.1896 4.2531 4.2537 4.3631 4.3755 4.3800 4.3919 4.3950 4.3970 5.9237 5.9243 5.9304 5.9307 5.9788 5.9791 8.0610 8.0664 8.0696 8.0750 8.8579 8.8663 8.8741 8.8787 8.8842 8.8920 10.1050 10.1050 10.1251 10.1267 k = 0.4512 0.5000 0.4512 ( 6488 PWs) bands (ev): -48.9714 -48.9714 -26.6293 -26.6293 -24.5570 -24.5570 -24.5570 -24.5570 -6.6709 -6.6703 -6.6097 -6.6077 -6.5757 -6.5744 -6.5678 -6.5666 0.9191 0.9195 0.9503 0.9542 0.9596 0.9616 1.6540 1.6542 2.1240 2.1271 2.1271 2.1293 2.3454 2.3465 2.3534 2.3540 2.4020 2.4021 2.7262 2.7331 2.7418 2.7523 2.7527 2.7573 3.7128 3.7131 3.8817 3.9160 3.9275 3.9426 3.9568 3.9590 4.0220 4.0240 4.0318 4.0379 4.1532 4.1708 4.1775 4.1939 4.2530 4.2541 4.3628 4.3832 4.3884 4.3998 4.4079 4.4086 5.9089 5.9098 5.9205 5.9210 5.9678 5.9683 8.0534 8.0604 8.0671 8.0742 8.8519 8.8639 8.8785 8.8847 8.8953 8.9048 10.0973 10.0975 10.1325 10.1343 k = 0.4390 0.5000 0.4390 ( 6484 PWs) bands (ev): -48.9714 -48.9714 -26.6293 -26.6293 -24.5570 -24.5570 -24.5569 -24.5569 -6.6808 -6.6801 -6.6082 -6.6050 -6.5746 -6.5727 -6.5633 -6.5616 0.9204 0.9207 0.9517 0.9559 0.9645 0.9675 1.6618 1.6621 2.1188 2.1225 2.1233 2.1258 2.3412 2.3426 2.3531 2.3538 2.4010 2.4010 2.7186 2.7269 2.7433 2.7569 2.7577 2.7634 3.7131 3.7137 3.8689 3.9127 3.9220 3.9395 3.9562 3.9616 4.0200 4.0252 4.0343 4.0449 4.1478 4.1713 4.1767 4.1980 4.2537 4.2555 4.3634 4.3930 4.3982 4.4097 4.4203 4.4241 5.8903 5.8915 5.9079 5.9085 5.9544 5.9552 8.0448 8.0534 8.0642 8.0729 8.8442 8.8592 8.8845 8.8918 8.9078 8.9190 10.0879 10.0885 10.1419 10.1439 k = 0.4268 0.5000 0.4268 ( 6488 PWs) bands (ev): -48.9714 -48.9714 -26.6292 -26.6292 -24.5570 -24.5570 -24.5569 -24.5569 -6.6917 -6.6907 -6.6072 -6.6026 -6.5732 -6.5704 -6.5584 -6.5561 0.9209 0.9209 0.9543 0.9582 0.9707 0.9747 1.6710 1.6716 2.1128 2.1171 2.1189 2.1217 2.3360 2.3377 2.3522 2.3532 2.4004 2.4006 2.7096 2.7191 2.7456 2.7617 2.7644 2.7706 3.7131 3.7139 3.8563 3.9092 3.9143 3.9349 3.9557 3.9651 4.0174 4.0272 4.0368 4.0523 4.1426 4.1728 4.1753 4.2020 4.2556 4.2579 4.3651 4.4043 4.4082 4.4224 4.4339 4.4406 5.8681 5.8698 5.8925 5.8932 5.9389 5.9400 8.0359 8.0460 8.0609 8.0711 8.8345 8.8523 8.8910 8.8993 8.9207 8.9336 10.0776 10.0788 10.1539 10.1562 k = 0.4146 0.5000 0.4146 ( 6478 PWs) bands (ev): -48.9714 -48.9714 -26.6292 -26.6292 -24.5570 -24.5570 -24.5568 -24.5568 -6.7033 -6.7022 -6.6065 -6.6004 -6.5713 -6.5676 -6.5531 -6.5503 0.9197 0.9206 0.9584 0.9615 0.9780 0.9833 1.6815 1.6825 2.1061 2.1109 2.1141 2.1172 2.3298 2.3320 2.3507 2.3521 2.4006 2.4011 2.6993 2.7100 2.7488 2.7672 2.7721 2.7788 3.7127 3.7135 3.8444 3.9054 3.9058 3.9295 3.9555 3.9690 4.0146 4.0298 4.0393 4.0595 4.1377 4.1735 4.1755 4.2062 4.2584 4.2615 4.3681 4.4169 4.4182 4.4381 4.4482 4.4577 5.8430 5.8450 5.8746 5.8754 5.9215 5.9230 8.0271 8.0386 8.0572 8.0688 8.8227 8.8431 8.8974 8.9068 8.9330 8.9475 10.0673 10.0690 10.1689 10.1714 k = 0.4024 0.5000 0.4024 ( 6478 PWs) bands (ev): -48.9714 -48.9714 -26.6292 -26.6292 -24.5569 -24.5569 -24.5567 -24.5567 -6.7156 -6.7143 -6.6063 -6.5988 -6.5688 -6.5641 -6.5476 -6.5442 0.9173 0.9190 0.9637 0.9657 0.9865 0.9930 1.6931 1.6945 2.0990 2.1042 2.1091 2.1123 2.3228 2.3254 2.3485 2.3505 2.4016 2.4026 2.6877 2.6996 2.7529 2.7735 2.7809 2.7879 3.7115 3.7121 3.8336 3.8958 3.9023 3.9238 3.9554 3.9730 4.0117 4.0331 4.0416 4.0664 4.1330 4.1715 4.1793 4.2106 4.2620 4.2660 4.3723 4.4281 4.4301 4.4560 4.4629 4.4750 5.8154 5.8178 5.8545 5.8552 5.9025 5.9041 8.0189 8.0318 8.0531 8.0660 8.8086 8.8313 8.9032 8.9135 8.9437 8.9597 10.0575 10.0599 10.1874 10.1900 k = 0.3902 0.5000 0.3902 ( 6482 PWs) bands (ev): -48.9714 -48.9714 -26.6291 -26.6291 -24.5569 -24.5569 -24.5567 -24.5567 -6.7284 -6.7271 -6.6066 -6.5979 -6.5656 -6.5601 -6.5418 -6.5379 0.9135 0.9163 0.9698 0.9708 0.9963 1.0039 1.7055 1.7075 2.0914 2.0972 2.1039 2.1072 2.3149 2.3180 2.3460 2.3486 2.4034 2.4052 2.6749 2.6880 2.7580 2.7805 2.7906 2.7978 3.7093 3.7094 3.8244 3.8864 3.8988 3.9178 3.9554 3.9769 4.0087 4.0368 4.0437 4.0726 4.1288 4.1698 4.1843 4.2154 4.2662 4.2712 4.3781 4.4384 4.4437 4.4751 4.4779 4.4924 5.7860 5.7887 5.8325 5.8331 5.8818 5.8835 8.0117 8.0258 8.0486 8.0626 8.7920 8.8169 8.9076 8.9188 8.9522 8.9697 10.0490 10.0521 10.2096 10.2124 k = 0.3780 0.5000 0.3780 ( 6486 PWs) bands (ev): -48.9714 -48.9714 -26.6291 -26.6291 -24.5569 -24.5569 -24.5566 -24.5566 -6.7418 -6.7404 -6.6074 -6.5976 -6.5616 -6.5553 -6.5358 -6.5314 0.9087 0.9125 0.9765 0.9766 1.0071 1.0156 1.7186 1.7212 2.0836 2.0898 2.0988 2.1020 2.3062 2.3101 2.3434 2.3468 2.4060 2.4086 2.6612 2.6754 2.7640 2.7884 2.8011 2.8083 3.7048 3.7061 3.8170 3.8775 3.8954 3.9118 3.9552 3.9805 4.0060 4.0407 4.0456 4.0783 4.1251 4.1686 4.1904 4.2206 4.2706 4.2768 4.3854 4.4489 4.4571 4.4932 4.4943 4.5104 5.7554 5.7584 5.8089 5.8092 5.8595 5.8612 8.0055 8.0208 8.0438 8.0587 8.7731 8.7997 8.9102 8.9222 8.9581 8.9770 10.0422 10.0459 10.2360 10.2389 k = 0.3659 0.5000 0.3659 ( 6482 PWs) bands (ev): -48.9714 -48.9714 -26.6290 -26.6290 -24.5569 -24.5568 -24.5565 -24.5565 -6.7556 -6.7541 -6.6086 -6.5981 -6.5568 -6.5500 -6.5295 -6.5247 0.9028 0.9075 0.9827 0.9836 1.0189 1.0282 1.7319 1.7354 2.0758 2.0824 2.0937 2.0969 2.2970 2.3015 2.3411 2.3454 2.4093 2.4128 2.6466 2.6618 2.7711 2.7971 2.8123 2.8194 3.6986 3.7014 3.8116 3.8697 3.8921 3.9060 3.9548 3.9836 4.0037 4.0444 4.0472 4.0834 4.1226 4.1681 4.1974 4.2263 4.2752 4.2826 4.3942 4.4598 4.4699 4.5088 4.5116 4.5303 5.7243 5.7273 5.7840 5.7841 5.8358 5.8372 8.0007 8.0171 8.0387 8.0542 8.7518 8.7798 8.9104 8.9231 8.9611 8.9813 10.0375 10.0418 10.2667 10.2696 k = 0.3537 0.5000 0.3537 ( 6478 PWs) bands (ev): -48.9714 -48.9714 -26.6290 -26.6290 -24.5568 -24.5568 -24.5564 -24.5564 -6.7697 -6.7682 -6.6103 -6.5992 -6.5514 -6.5442 -6.5231 -6.5179 0.8959 0.9014 0.9892 0.9909 1.0316 1.0414 1.7454 1.7497 2.0680 2.0750 2.0889 2.0920 2.2872 2.2926 2.3395 2.3447 2.4131 2.4176 2.6313 2.6474 2.7792 2.8066 2.8241 2.8311 3.6907 3.6954 3.8080 3.8631 3.8889 3.9006 3.9538 3.9863 4.0023 4.0477 4.0485 4.0875 4.1217 4.1685 4.2053 4.2324 4.2798 4.2883 4.4045 4.4710 4.4814 4.5249 4.5260 4.5526 5.6930 5.6960 5.7577 5.7586 5.8108 5.8115 7.9972 8.0148 8.0332 8.0492 8.7283 8.7572 8.9078 8.9211 8.9612 8.9825 10.0351 10.0400 10.3019 10.3049 k = 0.3415 0.5000 0.3415 ( 6462 PWs) bands (ev): -48.9713 -48.9713 -26.6289 -26.6289 -24.5568 -24.5568 -24.5563 -24.5563 -6.7842 -6.7827 -6.6124 -6.6009 -6.5454 -6.5379 -6.5163 -6.5110 0.8880 0.8941 0.9960 0.9982 1.0449 1.0550 1.7586 1.7638 2.0603 2.0679 2.0845 2.0875 2.2772 2.2834 2.3390 2.3451 2.4174 2.4229 2.6154 2.6324 2.7883 2.8170 2.8366 2.8432 3.6815 3.6881 3.8059 3.8578 3.8858 3.8958 3.9520 3.9883 4.0018 4.0495 4.0503 4.0898 4.1237 4.1700 4.2137 4.2390 4.2842 4.2938 4.4161 4.4825 4.4914 4.5377 4.5416 4.5767 5.6622 5.6650 5.7308 5.7326 5.7842 5.7847 7.9953 8.0137 8.0274 8.0437 8.7030 8.7322 8.9023 8.9159 8.9583 8.9807 10.0351 10.0404 10.3416 10.3447 k = 0.3293 0.5000 0.3293 ( 6460 PWs) bands (ev): -48.9713 -48.9713 -26.6289 -26.6289 -24.5567 -24.5567 -24.5562 -24.5562 -6.7989 -6.7974 -6.6149 -6.6031 -6.5389 -6.5311 -6.5094 -6.5038 0.8791 0.8858 1.0028 1.0053 1.0586 1.0689 1.7714 1.7775 2.0530 2.0610 2.0804 2.0833 2.2669 2.2740 2.3397 2.3467 2.4221 2.4286 2.5990 2.6169 2.7984 2.8281 2.8496 2.8558 3.6713 3.6795 3.8048 3.8535 3.8827 3.8918 3.9494 3.9899 4.0023 4.0502 4.0522 4.0899 4.1289 4.1725 4.2226 4.2462 4.2884 4.2992 4.4286 4.4942 4.4998 4.5471 4.5589 4.6017 5.6322 5.6346 5.7033 5.7067 5.7555 5.7577 7.9947 8.0139 8.0213 8.0377 8.6761 8.7052 8.8935 8.9075 8.9527 8.9761 10.0374 10.0429 10.3859 10.3889 k = 0.3171 0.5000 0.3171 ( 6456 PWs) bands (ev): -48.9713 -48.9713 -26.6288 -26.6288 -24.5567 -24.5567 -24.5560 -24.5560 -6.8138 -6.8123 -6.6177 -6.6058 -6.5319 -6.5239 -6.5022 -6.4966 0.8691 0.8764 1.0096 1.0124 1.0727 1.0829 1.7835 1.7905 2.0461 2.0546 2.0769 2.0796 2.2565 2.2645 2.3419 2.3498 2.4271 2.4346 2.5823 2.6010 2.8096 2.8401 2.8631 2.8687 3.6607 3.6700 3.8043 3.8498 3.8797 3.8887 3.9460 3.9908 4.0039 4.0506 4.0534 4.0884 4.1366 4.1762 4.2317 4.2538 4.2923 4.3045 4.4413 4.5058 4.5069 4.5543 4.5768 4.6274 5.6031 5.6048 5.6756 5.6811 5.7255 5.7303 7.9954 8.0147 8.0150 8.0317 8.6482 8.6765 8.8815 8.8957 8.9445 8.9688 10.0418 10.0474 10.4343 10.4374 k = 0.3049 0.5000 0.3049 ( 6452 PWs) bands (ev): -48.9713 -48.9713 -26.6288 -26.6288 -24.5566 -24.5566 -24.5559 -24.5559 -6.8288 -6.8274 -6.6209 -6.6090 -6.5246 -6.5164 -6.4949 -6.4892 0.8582 0.8659 1.0162 1.0191 1.0868 1.0969 1.7948 1.8026 2.0397 2.0488 2.0738 2.0764 2.2462 2.2550 2.3457 2.3546 2.4323 2.4409 2.5655 2.5849 2.8218 2.8530 2.8771 2.8820 3.6498 3.6597 3.8042 3.8466 3.8766 3.8867 3.9420 3.9912 4.0063 4.0506 4.0541 4.0861 4.1461 4.1808 4.2405 4.2620 4.2957 4.3099 4.4530 4.5135 4.5172 4.5595 4.5951 4.6535 5.5750 5.5756 5.6480 5.6563 5.6945 5.7029 7.9964 8.0092 8.0136 8.0281 8.6199 8.6467 8.8664 8.8807 8.9340 8.9592 10.0481 10.0536 10.4867 10.4899 k = 0.2927 0.5000 0.2927 ( 6448 PWs) bands (ev): -48.9713 -48.9713 -26.6287 -26.6287 -24.5566 -24.5566 -24.5558 -24.5558 -6.8438 -6.8425 -6.6244 -6.6125 -6.5170 -6.5087 -6.4874 -6.4817 0.8463 0.8543 1.0225 1.0254 1.1008 1.1106 1.8050 1.8137 2.0340 2.0436 2.0713 2.0739 2.2360 2.2456 2.3511 2.3609 2.4379 2.4474 2.5486 2.5688 2.8351 2.8666 2.8915 2.8957 3.6390 3.6490 3.8040 3.8435 3.8736 3.8860 3.9374 3.9909 4.0096 4.0504 4.0545 4.0834 4.1565 4.1863 4.2487 4.2707 4.2989 4.3158 4.4622 4.5213 4.5277 4.5635 4.6137 4.6797 5.5466 5.5478 5.6208 5.6328 5.6629 5.6763 7.9941 8.0072 8.0075 8.0300 8.5918 8.6165 8.8484 8.8627 8.9214 8.9474 10.0558 10.0610 10.5427 10.5459 k = 0.2805 0.5000 0.2805 ( 6452 PWs) bands (ev): -48.9713 -48.9713 -26.6287 -26.6286 -24.5566 -24.5566 -24.5557 -24.5557 -6.8588 -6.8576 -6.6281 -6.6163 -6.5091 -6.5007 -6.4797 -6.4741 0.8335 0.8417 1.0284 1.0312 1.1146 1.1239 1.8142 1.8235 2.0290 2.0391 2.0693 2.0719 2.2260 2.2364 2.3582 2.3689 2.4437 2.4540 2.5319 2.5529 2.8494 2.8810 2.9063 2.9096 3.6285 3.6381 3.8037 3.8403 3.8704 3.8864 3.9325 3.9899 4.0135 4.0500 4.0546 4.0808 4.1676 4.1925 4.2558 4.2798 4.3016 4.3222 4.4669 4.5321 4.5358 4.5677 4.6325 4.7058 5.5171 5.5209 5.5945 5.6109 5.6311 5.6510 7.9868 7.9973 8.0114 8.0356 8.5644 8.5864 8.8276 8.8419 8.9070 8.9339 10.0645 10.0694 10.6016 10.6049 k = 0.2683 0.5000 0.2683 ( 6456 PWs) bands (ev): -48.9713 -48.9713 -26.6286 -26.6286 -24.5565 -24.5565 -24.5555 -24.5555 -6.8738 -6.8726 -6.6320 -6.6204 -6.5010 -6.4925 -6.4720 -6.4665 0.8198 0.8282 1.0338 1.0366 1.1280 1.1367 1.8223 1.8322 2.0248 2.0355 2.0679 2.0706 2.2163 2.2274 2.3667 2.3782 2.4497 2.4608 2.5156 2.5373 2.8648 2.8963 2.9214 2.9239 3.6182 3.6272 3.8031 3.8370 3.8673 3.8878 3.9275 3.9882 4.0178 4.0494 4.0546 4.0785 4.1790 4.1990 4.2614 4.2893 4.3043 4.3294 4.4666 4.5391 4.5467 4.5747 4.6513 4.7319 5.4864 5.4937 5.5699 5.5907 5.6002 5.6278 7.9770 7.9851 8.0180 8.0432 8.5385 8.5571 8.8043 8.8186 8.8911 8.9188 10.0738 10.0781 10.6630 10.6665 k = 0.2561 0.5000 0.2561 ( 6456 PWs) bands (ev): -48.9713 -48.9713 -26.6285 -26.6285 -24.5565 -24.5565 -24.5554 -24.5554 -6.8886 -6.8874 -6.6361 -6.6248 -6.4928 -6.4842 -6.4641 -6.4589 0.8054 0.8138 1.0387 1.0412 1.1408 1.1489 1.8294 1.8397 2.0215 2.0327 2.0670 2.0698 2.2069 2.2187 2.3762 2.3886 2.4559 2.4675 2.4999 2.5225 2.8811 2.9123 2.9370 2.9384 3.6084 3.6164 3.8020 3.8337 3.8642 3.8900 3.9225 3.9859 4.0225 4.0485 4.0547 4.0765 4.1905 4.2057 4.2655 4.2984 4.3076 4.3373 4.4621 4.5372 4.5644 4.5851 4.6701 4.7575 5.4537 5.4655 5.5473 5.5681 5.5757 5.6070 7.9656 7.9709 8.0262 8.0523 8.5145 8.5293 8.7790 8.7931 8.8739 8.9024 10.0832 10.0868 10.7261 10.7299 k = 0.2439 0.5000 0.2439 ( 6456 PWs) bands (ev): -48.9713 -48.9713 -26.6285 -26.6285 -24.5564 -24.5564 -24.5553 -24.5553 -6.9032 -6.9021 -6.6403 -6.6293 -6.4845 -6.4758 -6.4563 -6.4512 0.7902 0.7987 1.0429 1.0453 1.1529 1.1603 1.8355 1.8461 2.0192 2.0308 2.0665 2.0696 2.1980 2.2104 2.3865 2.3998 2.4623 2.4741 2.4851 2.5088 2.8985 2.9290 2.9530 2.9533 3.5991 3.6058 3.8005 3.8305 3.8613 3.8927 3.9177 3.9830 4.0274 4.0475 4.0549 4.0749 4.2018 4.2123 4.2680 4.3044 4.3144 4.3455 4.4546 4.5313 4.5843 4.5977 4.6888 4.7826 5.4186 5.4353 5.5271 5.5408 5.5606 5.5890 7.9525 7.9547 8.0358 8.0627 8.4931 8.5035 8.7518 8.7658 8.8557 8.8849 10.0922 10.0951 10.7905 10.7947 k = 0.2317 0.5000 0.2317 ( 6466 PWs) bands (ev): -48.9714 -48.9714 -26.6284 -26.6284 -24.5564 -24.5564 -24.5552 -24.5552 -6.9175 -6.9165 -6.6447 -6.6339 -6.4762 -6.4674 -6.4484 -6.4436 0.7745 0.7829 1.0465 1.0486 1.1642 1.1709 1.8408 1.8515 2.0179 2.0298 2.0665 2.0699 2.1895 2.2026 2.3969 2.4110 2.4684 2.4721 2.4798 2.4974 2.9167 2.9464 2.9684 2.9694 3.5902 3.5955 3.7983 3.8274 3.8587 3.8957 3.9131 3.9794 4.0325 4.0463 4.0553 4.0736 4.2127 4.2183 4.2694 4.3073 4.3248 4.3534 4.4450 4.5226 4.6057 4.6117 4.7073 4.8070 5.3814 5.4027 5.5093 5.5156 5.5488 5.5739 7.9366 7.9376 8.0466 8.0744 8.4745 8.4804 8.7233 8.7370 8.8366 8.8665 10.1004 10.1025 10.8552 10.8599 k = 0.2195 0.5000 0.2195 ( 6464 PWs) bands (ev): -48.9714 -48.9714 -26.6284 -26.6284 -24.5563 -24.5563 -24.5550 -24.5550 -6.9315 -6.9305 -6.6490 -6.6386 -6.4680 -6.4591 -6.4405 -6.4361 0.7583 0.7666 1.0493 1.0512 1.1746 1.1806 1.8452 1.8560 2.0176 2.0296 2.0668 2.0706 2.1816 2.1952 2.4065 2.4207 2.4608 2.4758 2.4799 2.4936 2.9358 2.9645 2.9839 2.9861 3.5819 3.5855 3.7956 3.8245 3.8566 3.8990 3.9089 3.9754 4.0376 4.0449 4.0560 4.0728 4.2224 4.2236 4.2706 4.3097 4.3364 4.3601 4.4348 4.5120 4.6264 4.6280 4.7255 4.8304 5.3423 5.3679 5.4934 5.4937 5.5398 5.5617 7.9166 7.9209 8.0587 8.0872 8.4590 8.4603 8.6937 8.7071 8.8168 8.8475 10.1074 10.1085 10.9196 10.9249 k = 0.2073 0.5000 0.2073 ( 6468 PWs) bands (ev): -48.9714 -48.9714 -26.6283 -26.6283 -24.5563 -24.5563 -24.5549 -24.5549 -6.9451 -6.9442 -6.6534 -6.6434 -6.4598 -6.4509 -6.4327 -6.4287 0.7419 0.7499 1.0515 1.0532 1.1841 1.1893 1.8490 1.8597 2.0182 2.0304 2.0673 2.0716 2.1742 2.1883 2.4140 2.4251 2.4565 2.4746 2.4826 2.4984 2.9556 2.9830 2.9996 3.0032 3.5739 3.5759 3.7924 3.8217 3.8551 3.9022 3.9051 3.9712 4.0424 4.0435 4.0570 4.0724 4.2277 4.2297 4.2729 4.3123 4.3485 4.3640 4.4257 4.4998 4.6417 4.6508 4.7434 4.8525 5.3018 5.3310 5.4743 5.4803 5.5331 5.5523 7.8949 7.9023 8.0717 8.1011 8.4435 8.4467 8.6635 8.6765 8.7966 8.8278 10.1128 10.1130 10.9827 10.9888 k = 0.1951 0.5000 0.1951 ( 6458 PWs) bands (ev): -48.9713 -48.9713 -26.6282 -26.6282 -24.5563 -24.5563 -24.5548 -24.5548 -6.9582 -6.9574 -6.6577 -6.6481 -6.4517 -6.4429 -6.4251 -6.4214 0.7252 0.7330 1.0530 1.0544 1.1926 1.1970 1.8521 1.8627 2.0197 2.0319 2.0681 2.0729 2.1674 2.1820 2.4176 2.4210 2.4617 2.4723 2.4897 2.5048 2.9759 3.0018 3.0158 3.0207 3.5663 3.5667 3.7887 3.8192 3.8544 3.9017 3.9053 3.9668 4.0413 4.0476 4.0584 4.0724 4.2306 4.2332 4.2779 4.3156 4.3610 4.3629 4.4201 4.4864 4.6573 4.6735 4.7610 4.8731 5.2604 5.2928 5.4584 5.4692 5.5286 5.5452 7.8718 7.8820 8.0858 8.1160 8.4300 8.4372 8.6331 8.6456 8.7759 8.8077 10.1154 10.1161 11.0438 11.0508 k = 0.1829 0.5000 0.1829 ( 6472 PWs) bands (ev): -48.9714 -48.9714 -26.6282 -26.6282 -24.5562 -24.5562 -24.5547 -24.5547 -6.9708 -6.9701 -6.6620 -6.6528 -6.4438 -6.4350 -6.4176 -6.4143 0.7086 0.7161 1.0539 1.0551 1.2001 1.2038 1.8547 1.8652 2.0220 2.0341 2.0690 2.0742 2.1613 2.1761 2.4131 2.4165 2.4712 2.4750 2.4968 2.5116 2.9966 3.0207 3.0324 3.0385 3.5578 3.5589 3.7849 3.8169 3.8545 3.8987 3.9082 3.9626 4.0390 4.0522 4.0599 4.0726 4.2320 4.2323 4.2862 4.3196 4.3552 4.3735 4.4197 4.4722 4.6731 4.6955 4.7782 4.8917 5.2185 5.2536 5.4455 5.4605 5.5257 5.5401 7.8478 7.8603 8.1008 8.1316 8.4196 8.4305 8.6029 8.6148 8.7549 8.7872 10.1157 10.1173 11.1019 11.1099 k = 0.1707 0.5000 0.1707 ( 6472 PWs) bands (ev): -48.9714 -48.9714 -26.6281 -26.6281 -24.5562 -24.5562 -24.5546 -24.5546 -6.9829 -6.9822 -6.6661 -6.6575 -6.4361 -6.4275 -6.4103 -6.4074 0.6922 0.6993 1.0542 1.0551 1.2066 1.2097 1.8568 1.8670 2.0251 2.0370 2.0699 2.0756 2.1558 2.1709 2.4050 2.4124 2.4813 2.4816 2.5041 2.5183 3.0174 3.0393 3.0496 3.0567 3.5493 3.5517 3.7813 3.8150 3.8554 3.8962 3.9108 3.9587 4.0364 4.0564 4.0617 4.0730 4.2281 4.2320 4.2969 4.3246 4.3425 4.3858 4.4233 4.4577 4.6889 4.7165 4.7949 4.9081 5.1765 5.2140 5.4359 5.4547 5.5244 5.5367 7.8231 7.8374 8.1165 8.1481 8.4119 8.4259 8.5734 8.5846 8.7338 8.7665 10.1136 10.1160 11.1560 11.1652 k = 0.1585 0.5000 0.1585 ( 6470 PWs) bands (ev): -48.9714 -48.9714 -26.6281 -26.6281 -24.5561 -24.5561 -24.5545 -24.5544 -6.9944 -6.9938 -6.6701 -6.6620 -6.4287 -6.4203 -6.4033 -6.4007 0.6760 0.6828 1.0539 1.0547 1.2122 1.2147 1.8584 1.8683 2.0287 2.0403 2.0708 2.0770 2.1510 2.1661 2.3976 2.4070 2.4893 2.4917 2.5115 2.5249 3.0380 3.0572 3.0675 3.0750 3.5411 3.5446 3.7782 3.8133 3.8570 3.8942 3.9130 3.9554 4.0334 4.0603 4.0638 4.0736 4.2216 4.2307 4.3091 4.3272 4.3302 4.3969 4.4290 4.4442 4.7046 4.7358 4.8108 4.9218 5.1348 5.1745 5.4296 5.4518 5.5242 5.5346 7.7984 7.8139 8.1329 8.1651 8.4065 8.4229 8.5454 8.5557 8.7125 8.7456 10.1092 10.1123 11.2052 11.2156 k = 0.1463 0.5000 0.1463 ( 6472 PWs) bands (ev): -48.9714 -48.9714 -26.6280 -26.6280 -24.5561 -24.5561 -24.5544 -24.5543 -7.0052 -7.0046 -6.6740 -6.6663 -6.4216 -6.4134 -6.3965 -6.3943 0.6603 0.6667 1.0532 1.0538 1.2169 1.2189 1.8596 1.8691 2.0328 2.0440 2.0717 2.0782 2.1469 2.1619 2.3913 2.4017 2.4976 2.5010 2.5190 2.5312 3.0583 3.0744 3.0860 3.0936 3.5331 3.5375 3.7759 3.8120 3.8594 3.8928 3.9148 3.9527 4.0299 4.0638 4.0659 4.0741 4.2136 4.2284 4.3102 4.3225 4.3361 4.4036 4.4350 4.4355 4.7199 4.7533 4.8257 4.9325 5.0938 5.1353 5.4267 5.4520 5.5249 5.5335 7.7738 7.7901 8.1498 8.1827 8.4022 8.4203 8.5196 8.5291 8.6913 8.7246 10.1024 10.1061 11.2484 11.2600 k = 0.1341 0.5000 0.1341 ( 6480 PWs) bands (ev): -48.9715 -48.9715 -26.6280 -26.6280 -24.5561 -24.5561 -24.5543 -24.5542 -7.0153 -7.0148 -6.6776 -6.6705 -6.4149 -6.4070 -6.3902 -6.3883 0.6453 0.6512 1.0521 1.0526 1.2208 1.2224 1.8604 1.8695 2.0372 2.0479 2.0726 2.0791 2.1436 2.1582 2.3861 2.3968 2.5056 2.5093 2.5264 2.5373 3.0780 3.0910 3.1047 3.1121 3.5253 3.5302 3.7747 3.8109 3.8622 3.8921 3.9163 3.9507 4.0258 4.0667 4.0682 4.0743 4.2047 4.2252 4.2929 4.3362 4.3414 4.4001 4.4370 4.4422 4.7347 4.7689 4.8392 4.9399 5.0540 5.0969 5.4273 5.4552 5.5263 5.5332 7.7500 7.7664 8.1670 8.2006 8.3978 8.4166 8.4975 8.5064 8.6700 8.7035 10.0935 10.0976 11.2848 11.2974 k = 0.1220 0.5000 0.1220 ( 6488 PWs) bands (ev): -48.9715 -48.9715 -26.6279 -26.6279 -24.5560 -24.5560 -24.5542 -24.5542 -7.0247 -7.0243 -6.6809 -6.6744 -6.4085 -6.4011 -6.3842 -6.3826 0.6310 0.6364 1.0508 1.0511 1.2240 1.2251 1.8609 1.8695 2.0418 2.0519 2.0734 2.0798 2.1409 2.1550 2.3820 2.3927 2.5132 2.5167 2.5335 2.5431 3.0970 3.1071 3.1231 3.1304 3.5177 3.5227 3.7747 3.8101 3.8655 3.8923 3.9175 3.9495 4.0213 4.0693 4.0705 4.0739 4.1952 4.2214 4.2756 4.3438 4.3504 4.3921 4.4464 4.4490 4.7487 4.7823 4.8509 4.9437 5.0160 5.0596 5.4312 5.4613 5.5283 5.5334 7.7272 7.7433 8.1845 8.2185 8.3914 8.4095 8.4808 8.4897 8.6489 8.6824 10.0828 10.0871 11.3128 11.3252 k = 0.1098 0.5000 0.1098 ( 6480 PWs) bands (ev): -48.9715 -48.9715 -26.6279 -26.6279 -24.5560 -24.5560 -24.5541 -24.5541 -7.0333 -7.0329 -6.6840 -6.6781 -6.4026 -6.3957 -6.3786 -6.3773 0.6177 0.6226 1.0493 1.0495 1.2265 1.2274 1.8612 1.8691 2.0464 2.0559 2.0741 2.0802 2.1389 2.1522 2.3791 2.3894 2.5201 2.5233 2.5403 2.5484 3.1150 3.1226 3.1409 3.1482 3.5103 3.5150 3.7761 3.8096 3.8690 3.8936 3.9186 3.9489 4.0164 4.0714 4.0725 4.0732 4.1859 4.2172 4.2589 4.3398 4.3650 4.3889 4.4555 4.4576 4.7618 4.7939 4.8605 4.9429 4.9818 5.0239 5.4381 5.4697 5.5306 5.5339 7.7057 7.7212 8.2019 8.2363 8.3816 8.3978 8.4709 8.4805 8.6279 8.6613 10.0706 10.0750 11.3286 11.3359 k = 0.0976 0.5000 0.0976 ( 6482 PWs) bands (ev): -48.9715 -48.9715 -26.6279 -26.6279 -24.5560 -24.5560 -24.5540 -24.5540 -7.0411 -7.0407 -6.6868 -6.6816 -6.3972 -6.3908 -6.3735 -6.3724 0.6054 0.6098 1.0476 1.0477 1.2285 1.2291 1.8612 1.8684 2.0509 2.0597 2.0748 2.0805 2.1375 2.1498 2.3771 2.3869 2.5263 2.5292 2.5465 2.5533 3.1318 3.1375 3.1580 3.1652 3.5031 3.5072 3.7787 3.8094 3.8725 3.8963 3.9197 3.9488 4.0110 4.0697 4.0732 4.0755 4.1771 4.2127 4.2431 4.3286 4.3798 4.3924 4.4616 4.4689 4.7737 4.8035 4.8681 4.9312 4.9580 4.9900 5.4475 5.4800 5.5333 5.5347 7.6858 7.7003 8.2189 8.2532 8.3691 8.3829 8.4673 8.4776 8.6072 8.6402 10.0574 10.0618 11.3210 11.3248 k = 0.0854 0.5000 0.0854 ( 6478 PWs) bands (ev): -48.9715 -48.9715 -26.6278 -26.6278 -24.5560 -24.5560 -24.5539 -24.5539 -7.0480 -7.0477 -6.6893 -6.6847 -6.3923 -6.3865 -6.3689 -6.3680 0.5943 0.5982 1.0460 1.0460 1.2300 1.2304 1.8610 1.8675 2.0551 2.0633 2.0755 2.0805 2.1366 2.1477 2.3760 2.3849 2.5318 2.5343 2.5520 2.5576 3.1474 3.1514 3.1739 3.1812 3.4960 3.4995 3.7825 3.8094 3.8760 3.9006 3.9209 3.9490 4.0053 4.0648 4.0746 4.0780 4.1698 4.2080 4.2288 4.3134 4.3948 4.3999 4.4671 4.4796 4.7842 4.8113 4.8736 4.9062 4.9486 4.9584 5.4587 5.4912 5.5356 5.5361 7.6678 7.6811 8.2346 8.2683 8.3562 8.3684 8.4681 8.4783 8.5869 8.6193 10.0439 10.0480 11.2964 11.3051 k = 0.0732 0.5000 0.0732 ( 6474 PWs) bands (ev): -48.9715 -48.9715 -26.6278 -26.6278 -24.5559 -24.5559 -24.5539 -24.5539 -7.0541 -7.0538 -6.6915 -6.6874 -6.3879 -6.3828 -6.3648 -6.3641 0.5845 0.5878 1.0444 1.0444 1.2311 1.2313 1.8607 1.8665 2.0589 2.0663 2.0762 2.0805 2.1362 2.1459 2.3755 2.3836 2.5365 2.5387 2.5568 2.5614 3.1616 3.1643 3.1885 3.1957 3.4893 3.4919 3.7871 3.8096 3.8797 3.9064 3.9221 3.9492 3.9993 4.0573 4.0759 4.0802 4.1645 4.2033 4.2164 4.2967 4.4091 4.4097 4.4717 4.4893 4.7928 4.8172 4.8771 4.8805 4.9301 4.9421 5.4709 5.5025 5.5367 5.5390 7.6519 7.6637 8.2480 8.2791 8.3458 8.3581 8.4715 8.4808 8.5673 8.5986 10.0306 10.0343 11.2725 11.2820 k = 0.0610 0.5000 0.0610 ( 6474 PWs) bands (ev): -48.9715 -48.9715 -26.6278 -26.6278 -24.5559 -24.5559 -24.5538 -24.5538 -7.0593 -7.0591 -6.6933 -6.6899 -6.3841 -6.3798 -6.3613 -6.3608 0.5760 0.5788 1.0429 1.0429 1.2319 1.2320 1.8604 1.8653 2.0622 2.0687 2.0771 2.0805 2.1361 2.1443 2.3756 2.3826 2.5406 2.5425 2.5609 2.5646 3.1741 3.1759 3.2016 3.2084 3.4829 3.4847 3.7921 3.8099 3.8839 3.9136 3.9233 3.9495 3.9933 4.0472 4.0769 4.0820 4.1619 4.1987 4.2064 4.2794 4.4189 4.4243 4.4754 4.4973 4.7985 4.8208 4.8595 4.8776 4.9069 4.9354 5.4831 5.5128 5.5381 5.5421 7.6383 7.6484 8.2573 8.2829 8.3408 8.3557 8.4762 8.4837 8.5486 8.5783 10.0181 10.0214 11.2517 11.2605 k = 0.0488 0.5000 0.0488 ( 6482 PWs) bands (ev): -48.9715 -48.9715 -26.6278 -26.6278 -24.5559 -24.5559 -24.5538 -24.5538 -7.0635 -7.0634 -6.6947 -6.6920 -6.3808 -6.3773 -6.3584 -6.3580 0.5691 0.5713 1.0416 1.0416 1.2325 1.2325 1.8602 1.8641 2.0649 2.0703 2.0780 2.0806 2.1363 2.1429 2.3761 2.3818 2.5439 2.5455 2.5643 2.5671 3.1847 3.1859 3.2130 3.2192 3.4772 3.4782 3.7970 3.8103 3.8889 3.9217 3.9241 3.9497 3.9876 4.0350 4.0779 4.0833 4.1619 4.1941 4.1991 4.2621 4.4287 4.4382 4.4782 4.5031 4.7998 4.8214 4.8461 4.8712 4.8945 4.9282 5.4946 5.5208 5.5403 5.5451 7.6271 7.6353 8.2610 8.2795 8.3429 8.3615 8.4812 8.4863 8.5315 8.5585 10.0071 10.0098 11.2347 11.2422 k = 0.0366 0.5000 0.0366 ( 6486 PWs) bands (ev): -48.9715 -48.9715 -26.6277 -26.6277 -24.5559 -24.5559 -24.5537 -24.5537 -7.0669 -7.0667 -6.6957 -6.6937 -6.3782 -6.3755 -6.3561 -6.3558 0.5636 0.5653 1.0405 1.0405 1.2329 1.2329 1.8600 1.8630 2.0670 2.0712 2.0791 2.0809 2.1367 2.1417 2.3768 2.3812 2.5466 2.5478 2.5669 2.5690 3.1932 3.1940 3.2225 3.2277 3.4723 3.4728 3.8014 3.8105 3.8948 3.9241 3.9307 3.9500 3.9824 4.0214 4.0788 4.0838 4.1644 4.1899 4.1948 4.2455 4.4382 4.4505 4.4805 4.5063 4.7963 4.8178 4.8412 4.8603 4.8928 4.9209 5.5046 5.5254 5.5438 5.5480 7.6185 7.6248 8.2606 8.2728 8.3510 8.3710 8.4861 8.4880 8.5171 8.5396 9.9980 10.0001 11.2217 11.2275 k = 0.0244 0.5000 0.0244 ( 6478 PWs) bands (ev): -48.9715 -48.9715 -26.6277 -26.6277 -24.5559 -24.5559 -24.5537 -24.5537 -7.0692 -7.0692 -6.6964 -6.6950 -6.3761 -6.3743 -6.3544 -6.3543 0.5598 0.5609 1.0397 1.0397 1.2331 1.2331 1.8600 1.8621 2.0686 2.0714 2.0800 2.0813 2.1372 2.1406 2.3776 2.3806 2.5485 2.5494 2.5689 2.5703 3.1995 3.2000 3.2299 3.2336 3.4685 3.4687 3.8050 3.8106 3.9014 3.9226 3.9399 3.9508 3.9786 4.0073 4.0798 4.0836 4.1687 4.1858 4.1940 4.2299 4.4468 4.4591 4.4838 4.5062 4.7922 4.8100 4.8415 4.8529 4.8946 4.9139 5.5128 5.5267 5.5478 5.5504 7.6126 7.6168 8.2587 8.2662 8.3622 8.3796 8.4888 8.4904 8.5068 8.5221 9.9913 9.9927 11.2127 11.2166 k = 0.0122 0.5000 0.0122 ( 6480 PWs) bands (ev): -48.9715 -48.9715 -26.6277 -26.6277 -24.5559 -24.5559 -24.5537 -24.5537 -7.0707 -7.0706 -6.6966 -6.6960 -6.3747 -6.3738 -6.3534 -6.3533 0.5576 0.5582 1.0392 1.0392 1.2332 1.2332 1.8602 1.8612 2.0698 2.0712 2.0808 2.0814 2.1379 2.1396 2.3785 2.3800 2.5498 2.5502 2.5702 2.5709 3.2034 3.2036 3.2348 3.2368 3.4661 3.4661 3.8076 3.8102 3.9081 3.9193 3.9477 3.9517 3.9780 3.9939 4.0808 4.0828 4.1736 4.1820 4.1971 4.2160 4.4541 4.4618 4.4899 4.5030 4.7911 4.8010 4.8437 4.8489 4.8978 4.9076 5.5190 5.5258 5.5509 5.5521 7.6095 7.6116 8.2575 8.2611 8.3732 8.3837 8.4903 8.4941 8.5009 8.5071 9.9872 9.9880 11.2077 11.2097 k = 0.0000 0.5000-0.0000 ( 6480 PWs) bands (ev): -48.9715 -48.9715 -26.6277 -26.6277 -24.5559 -24.5559 -24.5537 -24.5537 -7.0711 -7.0711 -6.6965 -6.6965 -6.3739 -6.3739 -6.3530 -6.3530 0.5571 0.5571 1.0391 1.0391 1.2332 1.2332 1.8606 1.8606 2.0707 2.0707 2.0813 2.0813 2.1387 2.1387 2.3793 2.3793 2.5504 2.5504 2.5709 2.5709 3.2048 3.2048 3.2372 3.2372 3.4653 3.4653 3.8093 3.8093 3.9143 3.9143 3.9515 3.9515 3.9832 3.9832 4.0819 4.0819 4.1781 4.1781 4.2047 4.2047 4.4594 4.4594 4.4971 4.4971 4.7941 4.7941 4.8462 4.8462 4.9022 4.9022 5.5232 5.5232 5.5523 5.5523 7.6091 7.6091 8.2582 8.2582 8.3813 8.3813 8.4957 8.4957 8.4977 8.4977 9.9861 9.9861 11.2067 11.2067 k = 0.5000 0.5000-0.0000 ( 6496 PWs) bands (ev): -48.9715 -48.9715 -26.6285 -26.6285 -24.5570 -24.5570 -24.5548 -24.5548 -6.8244 -6.8244 -6.6139 -6.6139 -6.5836 -6.5836 -6.4614 -6.4614 0.9380 0.9380 1.0792 1.0792 1.0943 1.0943 1.9973 1.9973 2.1034 2.1034 2.1584 2.1584 2.2076 2.2076 2.2090 2.2090 2.4072 2.4072 2.5277 2.5277 2.7602 2.7602 2.7902 2.7902 3.5905 3.5905 3.8463 3.8463 3.8940 3.8940 3.9347 3.9347 4.0609 4.0609 4.0851 4.0851 4.0952 4.0952 4.4351 4.4351 4.4656 4.4656 4.5158 4.5158 4.6027 4.6027 4.6258 4.6258 5.2037 5.2037 5.2150 5.2150 5.8038 5.8038 8.1358 8.1358 8.1402 8.1402 8.2386 8.2386 8.8668 8.8668 8.8669 8.8669 10.8117 10.8117 10.8153 10.8153 k = 0.5000 0.5000 0.0172 ( 6472 PWs) bands (ev): -48.9714 -48.9714 -26.6285 -26.6285 -24.5570 -24.5570 -24.5548 -24.5548 -6.8240 -6.8240 -6.6139 -6.6139 -6.5836 -6.5836 -6.4616 -6.4616 0.9381 0.9381 1.0787 1.0787 1.0939 1.0939 1.9976 1.9976 2.1023 2.1023 2.1554 2.1554 2.2077 2.2077 2.2096 2.2096 2.4105 2.4105 2.5274 2.5274 2.7603 2.7603 2.7903 2.7903 3.5911 3.5911 3.8466 3.8466 3.8931 3.8931 3.9355 3.9355 4.0606 4.0606 4.0844 4.0844 4.0959 4.0959 4.4331 4.4331 4.4660 4.4660 4.5154 4.5154 4.6013 4.6013 4.6268 4.6268 5.2046 5.2046 5.2184 5.2184 5.8042 5.8042 8.1212 8.1212 8.1481 8.1481 8.2467 8.2467 8.8669 8.8669 8.8680 8.8680 10.8088 10.8088 10.8123 10.8123 k = 0.5000 0.5000 0.0345 ( 6472 PWs) bands (ev): -48.9714 -48.9714 -26.6285 -26.6285 -24.5570 -24.5570 -24.5548 -24.5548 -6.8231 -6.8231 -6.6138 -6.6138 -6.5835 -6.5835 -6.4622 -6.4622 0.9385 0.9385 1.0774 1.0774 1.0926 1.0926 1.9984 1.9984 2.0987 2.0987 2.1475 2.1475 2.2081 2.2081 2.2112 2.2112 2.4200 2.4200 2.5264 2.5264 2.7603 2.7603 2.7903 2.7903 3.5928 3.5928 3.8472 3.8472 3.8906 3.8906 3.9376 3.9376 4.0594 4.0594 4.0826 4.0826 4.0972 4.0972 4.4277 4.4277 4.4667 4.4667 4.5139 4.5139 4.5976 4.5976 4.6290 4.6290 5.2085 5.2085 5.2275 5.2275 5.8056 5.8056 8.1003 8.1003 8.1522 8.1522 8.2673 8.2673 8.8681 8.8681 8.8702 8.8702 10.8001 10.8001 10.8034 10.8034 k = 0.5000 0.5000 0.0517 ( 6472 PWs) bands (ev): -48.9714 -48.9714 -26.6285 -26.6285 -24.5570 -24.5570 -24.5549 -24.5549 -6.8214 -6.8214 -6.6137 -6.6137 -6.5835 -6.5835 -6.4631 -6.4631 0.9391 0.9391 1.0751 1.0751 1.0905 1.0905 1.9999 1.9999 2.0912 2.0912 2.1372 2.1372 2.2091 2.2091 2.2134 2.2134 2.4343 2.4343 2.5247 2.5247 2.7604 2.7604 2.7904 2.7904 3.5955 3.5955 3.8483 3.8483 3.8869 3.8869 3.9406 3.9406 4.0574 4.0574 4.0806 4.0806 4.0988 4.0988 4.4198 4.4198 4.4668 4.4668 4.5115 4.5115 4.5922 4.5922 4.6316 4.6316 5.2162 5.2162 5.2412 5.2412 5.8080 5.8080 8.0777 8.0777 8.1532 8.1532 8.2952 8.2952 8.8703 8.8703 8.8735 8.8735 10.7857 10.7857 10.7889 10.7889 k = 0.5000 0.5000 0.0690 ( 6464 PWs) bands (ev): -48.9713 -48.9713 -26.6285 -26.6285 -24.5570 -24.5570 -24.5549 -24.5549 -6.8192 -6.8192 -6.6135 -6.6135 -6.5833 -6.5833 -6.4643 -6.4643 0.9399 0.9399 1.0721 1.0721 1.0875 1.0875 2.0018 2.0018 2.0784 2.0784 2.1277 2.1277 2.2108 2.2108 2.2164 2.2164 2.4517 2.4517 2.5224 2.5224 2.7606 2.7606 2.7905 2.7905 3.5994 3.5994 3.8496 3.8496 3.8826 3.8826 3.9441 3.9441 4.0544 4.0544 4.0787 4.0787 4.1004 4.1004 4.4102 4.4102 4.4657 4.4657 4.5081 4.5081 4.5859 4.5859 4.6341 4.6341 5.2282 5.2282 5.2588 5.2588 5.8112 5.8112 8.0553 8.0553 8.1527 8.1527 8.3270 8.3270 8.8735 8.8735 8.8778 8.8778 10.7660 10.7660 10.7690 10.7690 k = 0.5000 0.5000 0.0862 ( 6464 PWs) bands (ev): -48.9713 -48.9713 -26.6286 -26.6286 -24.5570 -24.5570 -24.5550 -24.5550 -6.8163 -6.8163 -6.6133 -6.6133 -6.5832 -6.5832 -6.4660 -6.4660 0.9409 0.9409 1.0682 1.0682 1.0838 1.0838 2.0044 2.0044 2.0601 2.0601 2.1206 2.1206 2.2132 2.2132 2.2199 2.2199 2.4711 2.4711 2.5194 2.5194 2.7607 2.7607 2.7905 2.7905 3.6042 3.6042 3.8509 3.8509 3.8782 3.8782 3.9478 3.9478 4.0505 4.0505 4.0771 4.0771 4.1018 4.1018 4.3994 4.3994 4.4633 4.4633 4.5036 4.5036 4.5789 4.5789 4.6360 4.6360 5.2444 5.2444 5.2799 5.2799 5.8153 5.8153 8.0339 8.0339 8.1513 8.1513 8.3613 8.3613 8.8777 8.8777 8.8829 8.8829 10.7413 10.7413 10.7442 10.7442 k = 0.5000 0.5000 0.1034 ( 6448 PWs) bands (ev): -48.9713 -48.9713 -26.6286 -26.6286 -24.5570 -24.5570 -24.5550 -24.5550 -6.8127 -6.8127 -6.6131 -6.6131 -6.5830 -6.5830 -6.4680 -6.4680 0.9419 0.9419 1.0635 1.0635 1.0794 1.0794 2.0074 2.0074 2.0379 2.0379 2.1154 2.1154 2.2162 2.2162 2.2242 2.2242 2.4915 2.4915 2.5158 2.5158 2.7608 2.7608 2.7905 2.7905 3.6100 3.6100 3.8515 3.8515 3.8746 3.8746 3.9517 3.9517 4.0459 4.0459 4.0760 4.0760 4.1031 4.1031 4.3876 4.3876 4.4595 4.4595 4.4981 4.4981 4.5712 4.5712 4.6372 4.6372 5.2647 5.2647 5.3043 5.3043 5.8201 5.8201 8.0141 8.0141 8.1492 8.1492 8.3972 8.3972 8.8826 8.8826 8.8888 8.8888 10.7122 10.7122 10.7149 10.7149 k = 0.5000 0.5000 0.1207 ( 6448 PWs) bands (ev): -48.9713 -48.9713 -26.6286 -26.6286 -24.5570 -24.5570 -24.5551 -24.5551 -6.8086 -6.8086 -6.6128 -6.6128 -6.5827 -6.5827 -6.4704 -6.4704 0.9431 0.9431 1.0581 1.0581 1.0742 1.0742 2.0102 2.0102 2.0141 2.0141 2.1113 2.1113 2.2199 2.2199 2.2290 2.2290 2.5109 2.5109 2.5129 2.5129 2.7609 2.7609 2.7905 2.7905 3.6167 3.6167 3.8505 3.8505 3.8728 3.8728 3.9555 3.9555 4.0406 4.0406 4.0753 4.0753 4.1044 4.1044 4.3749 4.3749 4.4545 4.4545 4.4913 4.4913 4.5631 4.5631 4.6373 4.6373 5.2888 5.2888 5.3316 5.3316 5.8257 5.8257 7.9961 7.9961 8.1466 8.1466 8.4343 8.4343 8.8881 8.8881 8.8952 8.8952 10.6792 10.6792 10.6818 10.6818 k = 0.5000 0.5000 0.1379 ( 6448 PWs) bands (ev): -48.9713 -48.9713 -26.6286 -26.6286 -24.5570 -24.5570 -24.5552 -24.5552 -6.8039 -6.8039 -6.6124 -6.6124 -6.5825 -6.5825 -6.4731 -6.4731 0.9442 0.9442 1.0522 1.0522 1.0685 1.0685 1.9874 1.9874 2.0153 2.0153 2.1078 2.1078 2.2243 2.2243 2.2345 2.2345 2.5067 2.5067 2.5330 2.5330 2.7609 2.7609 2.7903 2.7903 3.6242 3.6242 3.8475 3.8475 3.8734 3.8734 3.9591 3.9591 4.0349 4.0349 4.0749 4.0749 4.1056 4.1056 4.3616 4.3616 4.4483 4.4483 4.4832 4.4832 4.5545 4.5545 4.6363 4.6363 5.3164 5.3164 5.3614 5.3614 5.8320 5.8320 7.9801 7.9801 8.1436 8.1436 8.4722 8.4722 8.8940 8.8940 8.9020 8.9020 10.6430 10.6430 10.6457 10.6457 k = 0.5000 0.5000 0.1552 ( 6448 PWs) bands (ev): -48.9713 -48.9713 -26.6287 -26.6287 -24.5570 -24.5570 -24.5553 -24.5553 -6.7987 -6.7987 -6.6121 -6.6121 -6.5822 -6.5822 -6.4762 -6.4762 0.9452 0.9452 1.0456 1.0456 1.0622 1.0622 1.9611 1.9611 2.0199 2.0199 2.1049 2.1049 2.2293 2.2293 2.2405 2.2405 2.5014 2.5014 2.5532 2.5532 2.7608 2.7608 2.7900 2.7900 3.6324 3.6324 3.8431 3.8431 3.8759 3.8759 3.9626 3.9626 4.0289 4.0289 4.0749 4.0749 4.1070 4.1070 4.3478 4.3478 4.4412 4.4412 4.4741 4.4741 4.5458 4.5458 4.6341 4.6341 5.3471 5.3471 5.3936 5.3936 5.8389 5.8389 7.9665 7.9665 8.1402 8.1402 8.5106 8.5106 8.9001 8.9001 8.9088 8.9088 10.6041 10.6041 10.6071 10.6071 k = 0.5000 0.5000 0.1724 ( 6440 PWs) bands (ev): -48.9712 -48.9712 -26.6287 -26.6287 -24.5570 -24.5570 -24.5554 -24.5554 -6.7929 -6.7929 -6.6117 -6.6117 -6.5819 -6.5819 -6.4797 -6.4797 0.9462 0.9462 1.0386 1.0386 1.0555 1.0555 1.9346 1.9346 2.0249 2.0249 2.1025 2.1025 2.2349 2.2349 2.2472 2.2472 2.4956 2.4956 2.5728 2.5728 2.7606 2.7606 2.7895 2.7895 3.6412 3.6412 3.8381 3.8381 3.8796 3.8796 3.9657 3.9657 4.0230 4.0230 4.0750 4.0750 4.1084 4.1084 4.3336 4.3336 4.4331 4.4331 4.4639 4.4639 4.5368 4.5368 4.6304 4.6304 5.3806 5.3806 5.4278 5.4278 5.8463 5.8463 7.9553 7.9553 8.1365 8.1365 8.5491 8.5491 8.9061 8.9061 8.9156 8.9156 10.5634 10.5634 10.5668 10.5668 k = 0.5000 0.5000 0.1897 ( 6464 PWs) bands (ev): -48.9713 -48.9713 -26.6288 -26.6288 -24.5570 -24.5570 -24.5555 -24.5555 -6.7866 -6.7866 -6.6113 -6.6113 -6.5816 -6.5816 -6.4835 -6.4835 0.9469 0.9469 1.0313 1.0313 1.0484 1.0484 1.9084 1.9084 2.0304 2.0304 2.1006 2.1006 2.2410 2.2410 2.2543 2.2543 2.4892 2.4892 2.5914 2.5914 2.7602 2.7602 2.7887 2.7887 3.6505 3.6505 3.8329 3.8329 3.8839 3.8839 3.9684 3.9684 4.0171 4.0171 4.0753 4.0753 4.1101 4.1101 4.3191 4.3191 4.4239 4.4239 4.4531 4.4531 4.5276 4.5276 4.6252 4.6252 5.4162 5.4162 5.4637 5.4637 5.8541 5.8541 7.9467 7.9467 8.1325 8.1325 8.5873 8.5873 8.9118 8.9118 8.9219 8.9219 10.5216 10.5216 10.5255 10.5255 k = 0.5000 0.5000 0.2069 ( 6464 PWs) bands (ev): -48.9713 -48.9713 -26.6288 -26.6288 -24.5570 -24.5570 -24.5556 -24.5556 -6.7799 -6.7799 -6.6109 -6.6109 -6.5813 -6.5813 -6.4876 -6.4876 0.9474 0.9474 1.0237 1.0237 1.0411 1.0411 1.8826 1.8826 2.0363 2.0363 2.0993 2.0993 2.2477 2.2477 2.2620 2.2620 2.4825 2.4825 2.6092 2.6092 2.7596 2.7596 2.7877 2.7877 3.6602 3.6602 3.8282 3.8282 3.8889 3.8889 3.9707 3.9707 4.0117 4.0117 4.0758 4.0758 4.1119 4.1119 4.3045 4.3045 4.4138 4.4138 4.4421 4.4421 4.5184 4.5184 4.6183 4.6183 5.4538 5.4538 5.5009 5.5009 5.8624 5.8624 7.9406 7.9406 8.1284 8.1284 8.6249 8.6249 8.9169 8.9169 8.9276 8.9276 10.4795 10.4795 10.4840 10.4840 k = 0.5000 0.5000 0.2241 ( 6480 PWs) bands (ev): -48.9714 -48.9714 -26.6288 -26.6288 -24.5570 -24.5570 -24.5557 -24.5557 -6.7727 -6.7727 -6.6104 -6.6104 -6.5809 -6.5809 -6.4922 -6.4922 0.9476 0.9476 1.0159 1.0159 1.0335 1.0335 1.8575 1.8575 2.0426 2.0426 2.0986 2.0986 2.2549 2.2549 2.2701 2.2701 2.4754 2.4754 2.6258 2.6258 2.7589 2.7589 2.7864 2.7864 3.6698 3.6698 3.8240 3.8240 3.8941 3.8941 3.9723 3.9723 4.0067 4.0067 4.0762 4.0762 4.1140 4.1140 4.2899 4.2899 4.4024 4.4024 4.4314 4.4314 4.5090 4.5090 4.6098 4.6098 5.4927 5.4927 5.5392 5.5392 5.8708 5.8708 7.9372 7.9372 8.1240 8.1240 8.6615 8.6615 8.9212 8.9212 8.9324 8.9324 10.4377 10.4377 10.4428 10.4428 k = 0.5000 0.5000 0.2414 ( 6472 PWs) bands (ev): -48.9714 -48.9714 -26.6289 -26.6289 -24.5570 -24.5570 -24.5559 -24.5559 -6.7651 -6.7651 -6.6100 -6.6100 -6.5806 -6.5806 -6.4970 -6.4970 0.9474 0.9474 1.0082 1.0082 1.0258 1.0258 1.8333 1.8333 2.0492 2.0492 2.0987 2.0987 2.2625 2.2625 2.2786 2.2786 2.4680 2.4680 2.6413 2.6413 2.7580 2.7580 2.7849 2.7849 3.6793 3.6793 3.8209 3.8209 3.8997 3.8997 3.9731 3.9731 4.0028 4.0028 4.0765 4.0765 4.1165 4.1165 4.2755 4.2755 4.3898 4.3898 4.4213 4.4213 4.4995 4.4995 4.5995 4.5995 5.5326 5.5326 5.5781 5.5781 5.8794 5.8794 7.9365 7.9365 8.1196 8.1196 8.6965 8.6965 8.9245 8.9245 8.9360 8.9360 10.3970 10.3970 10.4028 10.4028 k = 0.5000 0.5000 0.2586 ( 6472 PWs) bands (ev): -48.9714 -48.9714 -26.6289 -26.6289 -24.5570 -24.5570 -24.5560 -24.5560 -6.7572 -6.7572 -6.6096 -6.6096 -6.5803 -6.5803 -6.5022 -6.5022 0.9469 0.9469 1.0005 1.0005 1.0181 1.0181 1.8100 1.8100 2.0561 2.0561 2.0994 2.0994 2.2704 2.2704 2.2874 2.2874 2.4604 2.4604 2.6556 2.6556 2.7569 2.7569 2.7830 2.7830 3.6882 3.6882 3.8192 3.8192 3.9055 3.9055 3.9729 3.9729 4.0001 4.0001 4.0766 4.0766 4.1193 4.1193 4.2615 4.2615 4.3761 4.3761 4.4120 4.4120 4.4900 4.4900 4.5876 4.5876 5.5730 5.5730 5.6172 5.6172 5.8882 5.8882 7.9384 7.9384 8.1151 8.1151 8.7295 8.7295 8.9265 8.9265 8.9382 8.9382 10.3580 10.3580 10.3643 10.3643 k = 0.5000 0.5000 0.2759 ( 6480 PWs) bands (ev): -48.9714 -48.9714 -26.6290 -26.6290 -24.5570 -24.5570 -24.5561 -24.5561 -6.7489 -6.7489 -6.6092 -6.6092 -6.5799 -6.5799 -6.5077 -6.5077 0.9458 0.9458 0.9931 0.9931 1.0104 1.0104 1.7879 1.7879 2.0633 2.0633 2.1008 2.1008 2.2785 2.2785 2.2964 2.2964 2.4526 2.4526 2.6688 2.6688 2.7556 2.7556 2.7809 2.7809 3.6962 3.6962 3.8191 3.8191 3.9113 3.9113 3.9714 3.9714 3.9987 3.9987 4.0763 4.0763 4.1225 4.1225 4.2482 4.2482 4.3617 4.3617 4.4034 4.4034 4.4804 4.4804 4.5739 4.5739 5.6135 5.6135 5.6562 5.6562 5.8969 5.8969 7.9428 7.9428 8.1106 8.1106 8.7599 8.7599 8.9270 8.9270 8.9389 8.9389 10.3212 10.3212 10.3280 10.3280 k = 0.5000 0.5000 0.2931 ( 6464 PWs) bands (ev): -48.9713 -48.9713 -26.6290 -26.6290 -24.5570 -24.5570 -24.5562 -24.5562 -6.7404 -6.7404 -6.6089 -6.6089 -6.5796 -6.5796 -6.5135 -6.5135 0.9443 0.9443 0.9861 0.9861 1.0029 1.0029 1.7670 1.7670 2.0706 2.0706 2.1029 2.1029 2.2868 2.2868 2.3055 2.3055 2.4448 2.4448 2.6807 2.6807 2.7542 2.7542 2.7784 2.7784 3.7029 3.7029 3.8211 3.8211 3.9173 3.9173 3.9691 3.9691 3.9987 3.9987 4.0753 4.0753 4.1260 4.1260 4.2357 4.2357 4.3471 4.3471 4.3957 4.3957 4.4707 4.4707 4.5588 4.5588 5.6535 5.6535 5.6947 5.6947 5.9055 5.9055 7.9497 7.9497 8.1062 8.1062 8.7873 8.7873 8.9261 8.9261 8.9380 8.9380 10.2870 10.2870 10.2941 10.2941 k = 0.5000 0.5000 0.3103 ( 6472 PWs) bands (ev): -48.9714 -48.9714 -26.6291 -26.6291 -24.5570 -24.5570 -24.5563 -24.5563 -6.7316 -6.7316 -6.6085 -6.6085 -6.5793 -6.5793 -6.5196 -6.5196 0.9423 0.9423 0.9796 0.9796 0.9957 0.9957 1.7475 1.7475 2.0780 2.0780 2.1055 2.1055 2.2951 2.2951 2.3145 2.3145 2.4371 2.4371 2.6915 2.6915 2.7526 2.7526 2.7756 2.7756 3.7080 3.7080 3.8252 3.8252 3.9232 3.9232 3.9663 3.9663 3.9995 3.9995 4.0736 4.0736 4.1299 4.1299 4.2244 4.2244 4.3325 4.3325 4.3886 4.3886 4.4610 4.4610 4.5422 4.5422 5.6927 5.6927 5.7321 5.7321 5.9140 5.9140 7.9586 7.9586 8.1018 8.1018 8.8110 8.8110 8.9236 8.9236 8.9354 8.9354 10.2558 10.2558 10.2629 10.2629 k = 0.5000 0.5000 0.3276 ( 6472 PWs) bands (ev): -48.9714 -48.9714 -26.6291 -26.6291 -24.5570 -24.5570 -24.5564 -24.5564 -6.7227 -6.7227 -6.6083 -6.6083 -6.5789 -6.5789 -6.5259 -6.5259 0.9398 0.9398 0.9739 0.9739 0.9888 0.9888 1.7293 1.7293 2.0855 2.0855 2.1086 2.1086 2.3033 2.3033 2.3233 2.3233 2.4296 2.4296 2.7011 2.7011 2.7509 2.7509 2.7726 2.7726 3.7116 3.7116 3.8315 3.8315 3.9289 3.9289 3.9633 3.9633 4.0010 4.0010 4.0710 4.0710 4.1340 4.1340 4.2146 4.2146 4.3182 4.3182 4.3822 4.3822 4.4514 4.4514 4.5244 4.5244 5.7306 5.7306 5.7681 5.7681 5.9223 5.9223 7.9694 7.9694 8.0976 8.0976 8.8309 8.8309 8.9197 8.9197 8.9312 8.9312 10.2279 10.2279 10.2341 10.2341 k = 0.5000 0.5000 0.3448 ( 6480 PWs) bands (ev): -48.9714 -48.9714 -26.6291 -26.6291 -24.5570 -24.5570 -24.5566 -24.5566 -6.7136 -6.7136 -6.6081 -6.6081 -6.5786 -6.5786 -6.5324 -6.5324 0.9368 0.9368 0.9688 0.9688 0.9823 0.9823 1.7127 1.7127 2.0929 2.0929 2.1121 2.1121 2.3113 2.3113 2.3315 2.3315 2.4225 2.4225 2.7095 2.7095 2.7491 2.7491 2.7693 2.7693 3.7137 3.7137 3.8396 3.8396 3.9344 3.9344 3.9602 3.9602 4.0030 4.0030 4.0675 4.0675 4.1382 4.1382 4.2063 4.2063 4.3047 4.3047 4.3767 4.3767 4.4420 4.4420 4.5057 4.5057 5.7667 5.7667 5.8021 5.8021 5.9304 5.9304 7.9817 7.9817 8.0937 8.0937 8.8466 8.8466 8.9145 8.9145 8.9257 8.9257 10.2031 10.2031 10.2073 10.2073 k = 0.5000 0.5000 0.3621 ( 6476 PWs) bands (ev): -48.9714 -48.9714 -26.6292 -26.6292 -24.5570 -24.5570 -24.5566 -24.5566 -6.7045 -6.7045 -6.6081 -6.6081 -6.5784 -6.5784 -6.5390 -6.5390 0.9335 0.9335 0.9645 0.9645 0.9763 0.9763 1.6977 1.6977 2.1001 2.1001 2.1157 2.1157 2.3190 2.3190 2.3390 2.3390 2.4161 2.4161 2.7169 2.7169 2.7474 2.7474 2.7660 2.7660 3.7147 3.7147 3.8492 3.8492 3.9394 3.9394 3.9573 3.9573 4.0054 4.0054 4.0629 4.0629 4.1425 4.1425 4.1998 4.1998 4.2921 4.2921 4.3720 4.3720 4.4327 4.4327 4.4862 4.4862 5.8006 5.8006 5.8336 5.8336 5.9383 5.9383 7.9951 7.9951 8.0900 8.0900 8.8580 8.8580 8.9083 8.9083 8.9190 8.9190 10.1812 10.1812 10.1836 10.1836 k = 0.5000 0.5000 0.3793 ( 6480 PWs) bands (ev): -48.9714 -48.9714 -26.6292 -26.6292 -24.5570 -24.5570 -24.5567 -24.5567 -6.6953 -6.6953 -6.6082 -6.6082 -6.5781 -6.5781 -6.5458 -6.5458 0.9300 0.9300 0.9609 0.9609 0.9708 0.9708 1.6843 1.6843 2.1070 2.1070 2.1195 2.1195 2.3262 2.3262 2.3453 2.3453 2.4107 2.4107 2.7231 2.7231 2.7458 2.7458 2.7625 2.7625 3.7148 3.7148 3.8597 3.8597 3.9440 3.9440 3.9546 3.9546 4.0082 4.0082 4.0575 4.0575 4.1469 4.1469 4.1950 4.1950 4.2807 4.2807 4.3682 4.3682 4.4236 4.4236 4.4666 4.4666 5.8318 5.8318 5.8620 5.8620 5.9461 5.9461 8.0091 8.0091 8.0866 8.0866 8.8655 8.8655 8.9014 8.9014 8.9116 8.9116 10.1615 10.1615 10.1649 10.1649 k = 0.5000 0.5000 0.3966 ( 6484 PWs) bands (ev): -48.9714 -48.9714 -26.6292 -26.6292 -24.5570 -24.5570 -24.5568 -24.5568 -6.6863 -6.6863 -6.6085 -6.6085 -6.5779 -6.5779 -6.5524 -6.5524 0.9265 0.9265 0.9580 0.9580 0.9659 0.9659 1.6725 1.6725 2.1134 2.1134 2.1231 2.1231 2.3328 2.3328 2.3502 2.3502 2.4066 2.4066 2.7284 2.7284 2.7443 2.7443 2.7590 2.7590 3.7145 3.7145 3.8707 3.8707 3.9476 3.9476 3.9523 3.9523 4.0113 4.0113 4.0514 4.0514 4.1511 4.1511 4.1916 4.1916 4.2710 4.2710 4.3654 4.3654 4.4149 4.4149 4.4469 4.4469 5.8598 5.8598 5.8866 5.8866 5.9541 5.9541 8.0231 8.0231 8.0835 8.0835 8.8694 8.8694 8.8944 8.8944 8.9039 8.9039 10.1456 10.1456 10.1499 10.1499 k = 0.5000 0.5000 0.4138 ( 6484 PWs) bands (ev): -48.9714 -48.9714 -26.6293 -26.6293 -24.5570 -24.5570 -24.5569 -24.5569 -6.6775 -6.6775 -6.6091 -6.6091 -6.5777 -6.5777 -6.5588 -6.5588 0.9233 0.9233 0.9556 0.9556 0.9617 0.9617 1.6625 1.6625 2.1193 2.1193 2.1266 2.1266 2.3386 2.3386 2.3532 2.3532 2.4042 2.4042 2.7325 2.7325 2.7432 2.7432 2.7557 2.7557 3.7139 3.7139 3.8818 3.8818 3.9480 3.9480 3.9526 3.9526 4.0145 4.0145 4.0451 4.0451 4.1552 4.1552 4.1891 4.1891 4.2634 4.2634 4.3637 4.3637 4.4067 4.4067 4.4280 4.4280 5.8844 5.8844 5.9067 5.9067 5.9625 5.9625 8.0365 8.0365 8.0809 8.0809 8.8705 8.8705 8.8876 8.8876 8.8962 8.8962 10.1336 10.1336 10.1379 10.1379 k = 0.5000 0.5000 0.4310 ( 6484 PWs) bands (ev): -48.9714 -48.9714 -26.6293 -26.6293 -24.5570 -24.5570 -24.5569 -24.5569 -6.6691 -6.6691 -6.6101 -6.6101 -6.5776 -6.5776 -6.5647 -6.5647 0.9204 0.9204 0.9537 0.9537 0.9581 0.9581 1.6543 1.6543 2.1245 2.1245 2.1296 2.1296 2.3437 2.3437 2.3545 2.3545 2.4034 2.4034 2.7356 2.7356 2.7427 2.7427 2.7526 2.7526 3.7132 3.7132 3.8926 3.8926 3.9455 3.9455 3.9549 3.9549 4.0176 4.0176 4.0388 4.0388 4.1592 4.1592 4.1871 4.1871 4.2580 4.2580 4.3629 4.3629 4.3989 4.3989 4.4105 4.4105 5.9051 5.9051 5.9217 5.9217 5.9713 5.9713 8.0487 8.0487 8.0787 8.0787 8.8696 8.8696 8.8815 8.8815 8.8890 8.8890 10.1251 10.1251 10.1286 10.1286 k = 0.5000 0.5000 0.4483 ( 6472 PWs) bands (ev): -48.9713 -48.9713 -26.6293 -26.6293 -24.5570 -24.5570 -24.5570 -24.5570 -6.6613 -6.6613 -6.6116 -6.6116 -6.5774 -6.5774 -6.5699 -6.5699 0.9181 0.9181 0.9523 0.9523 0.9553 0.9553 1.6479 1.6479 2.1287 2.1287 2.1321 2.1321 2.3477 2.3477 2.3545 2.3545 2.4037 2.4037 2.7373 2.7373 2.7429 2.7429 2.7499 2.7499 3.7126 3.7126 3.9029 3.9029 3.9424 3.9424 3.9569 3.9569 4.0204 4.0204 4.0332 4.0332 4.1632 4.1632 4.1848 4.1848 4.2552 4.2552 4.3633 4.3633 4.3914 4.3914 4.3955 4.3955 5.9215 5.9215 5.9321 5.9321 5.9799 5.9799 8.0590 8.0590 8.0769 8.0769 8.8676 8.8676 8.8766 8.8766 8.8826 8.8826 10.1192 10.1192 10.1216 10.1216 k = 0.5000 0.5000 0.4655 ( 6488 PWs) bands (ev): -48.9714 -48.9714 -26.6293 -26.6293 -24.5570 -24.5570 -24.5570 -24.5570 -6.6546 -6.6546 -6.6134 -6.6134 -6.5773 -6.5773 -6.5739 -6.5739 0.9164 0.9164 0.9514 0.9514 0.9532 0.9532 1.6433 1.6433 2.1319 2.1319 2.1339 2.1339 2.3506 2.3506 2.3539 2.3539 2.4045 2.4045 2.7380 2.7380 2.7437 2.7437 2.7477 2.7477 3.7120 3.7120 3.9122 3.9122 3.9385 3.9385 3.9582 3.9582 4.0226 4.0226 4.0287 4.0287 4.1671 4.1671 4.1820 4.1820 4.2543 4.2543 4.3645 4.3645 4.3813 4.3813 4.3869 4.3869 5.9335 5.9335 5.9385 5.9385 5.9872 5.9872 8.0669 8.0669 8.0756 8.0756 8.8654 8.8654 8.8731 8.8731 8.8774 8.8774 10.1155 10.1155 10.1168 10.1168 k = 0.5000 0.5000 0.4828 ( 6488 PWs) bands (ev): -48.9714 -48.9714 -26.6293 -26.6293 -24.5570 -24.5570 -24.5570 -24.5570 -6.6498 -6.6498 -6.6152 -6.6152 -6.5773 -6.5773 -6.5764 -6.5764 0.9153 0.9153 0.9509 0.9509 0.9518 0.9518 1.6405 1.6405 2.1340 2.1340 2.1349 2.1349 2.3524 2.3524 2.3533 2.3533 2.4052 2.4052 2.7383 2.7383 2.7445 2.7445 2.7461 2.7461 3.7117 3.7117 3.9206 3.9206 3.9337 3.9337 3.9590 3.9590 4.0241 4.0241 4.0257 4.0257 4.1710 4.1710 4.1786 4.1786 4.2545 4.2545 4.3663 4.3663 4.3730 4.3730 4.3823 4.3823 5.9407 5.9407 5.9420 5.9420 5.9921 5.9921 8.0719 8.0719 8.0748 8.0748 8.8637 8.8637 8.8715 8.8715 8.8737 8.8737 10.1134 10.1134 10.1140 10.1140 k = 0.5000 0.5000 0.5000 ( 6488 PWs) bands (ev): -48.9714 -48.9714 -26.6293 -26.6293 -24.5570 -24.5570 -24.5570 -24.5570 -6.6480 -6.6480 -6.6160 -6.6160 -6.5773 -6.5773 -6.5773 -6.5773 0.9150 0.9150 0.9510 0.9510 0.9510 0.9510 1.6396 1.6396 2.1350 2.1350 2.1350 2.1350 2.3531 2.3531 2.3531 2.3531 2.4055 2.4055 2.7384 2.7384 2.7452 2.7452 2.7452 2.7452 3.7115 3.7115 3.9278 3.9278 3.9278 3.9278 3.9593 3.9593 4.0246 4.0246 4.0246 4.0246 4.1749 4.1749 4.1749 4.1749 4.2548 4.2548 4.3686 4.3686 4.3686 4.3686 4.3805 4.3805 5.9431 5.9431 5.9431 5.9431 5.9938 5.9938 8.0741 8.0741 8.0741 8.0741 8.8631 8.8631 8.8717 8.8717 8.8717 8.8717 10.1129 10.1129 10.1129 10.1129 Writing output data file NbCu3S4.save init_run : 3.00s CPU 14.29s WALL ( 1 calls) electrons : 1320.43s CPU 1332.41s WALL ( 1 calls) Called by init_run: wfcinit : 0.00s CPU 0.00s WALL ( 1 calls) potinit : 0.46s CPU 1.47s WALL ( 1 calls) Called by electrons: c_bands : 1320.39s CPU 1332.14s WALL ( 1 calls) v_of_rho : 0.21s CPU 0.91s WALL ( 1 calls) v_h : 0.05s CPU 0.06s WALL ( 1 calls) v_xc : 0.16s CPU 0.57s WALL ( 1 calls) newd : 0.65s CPU 0.98s WALL ( 1 calls) Called by c_bands: init_us_2 : 0.09s CPU 0.49s WALL ( 225 calls) cegterg : 1257.24s CPU 1266.59s WALL ( 607 calls) Called by sum_band: Called by *egterg: h_psi : 405.41s CPU 412.91s WALL ( 10711 calls) s_psi : 83.73s CPU 84.05s WALL ( 10711 calls) g_psi : 1.14s CPU 1.14s WALL ( 9879 calls) cdiaghg : 589.87s CPU 588.34s WALL ( 10104 calls) cegterg:over : 105.11s CPU 102.63s WALL ( 9879 calls) cegterg:upda : 34.53s CPU 36.80s WALL ( 9879 calls) cegterg:last : 24.38s CPU 24.79s WALL ( 1342 calls) Called by h_psi: h_psi:vloc : 253.94s CPU 259.05s WALL ( 10711 calls) h_psi:vnl : 150.84s CPU 152.67s WALL ( 10711 calls) add_vuspsi : 62.37s CPU 65.69s WALL ( 10711 calls) General routines calbec : 88.41s CPU 86.89s WALL ( 10711 calls) fft : 0.22s CPU 1.21s WALL ( 19 calls) ffts : 0.01s CPU 0.05s WALL ( 4 calls) fftw : 241.00s CPU 243.28s WALL ( 1358200 calls) interpolate : 0.06s CPU 0.11s WALL ( 4 calls) davcio : 0.01s CPU 1.85s WALL ( 450 calls) Parallel routines fft_scatter : 165.93s CPU 167.18s WALL ( 1358223 calls) PWSCF : 23m13.89s CPU 25m24.97s WALL This run was terminated on: 0:29:27 30Oct2015 =------------------------------------------------------------------------------= JOB DONE. =------------------------------------------------------------------------------=