Program PWSCF v.5.4.0 starts on 10Apr2017 at 20:31:45 This program is part of the open-source Quantum ESPRESSO suite for quantum simulation of materials; please cite "P. Giannozzi et al., J. Phys.:Condens. Matter 21 395502 (2009); URL http://www.quantum-espresso.org", in publications or presentations arising from this work. More details at http://www.quantum-espresso.org/quote Parallel version (MPI & OpenMP), running on 144 processor cores Number of MPI processes: 72 Threads/MPI process: 2 R & G space division: proc/nbgrp/npool/nimage = 72 Waiting for input... Reading input from standard input Current dimensions of program PWSCF are: Max number of different atomic species (ntypx) = 10 Max number of k-points (npk) = 40000 Max angular momentum in pseudopotentials (lmaxx) = 3 Atomic positions and unit cell read from directory: ./Cu2WS4.save/ file Cu.rel-pbe-dn-rrkjus_psl.1.0.0.UPF: wavefunction(s) 3D renormalized Subspace diagonalization in iterative solution of the eigenvalue problem: one sub-group per band group will be used scalapack distributed-memory algorithm (size of sub-group: 6* 6 procs) Parallelization info -------------------- sticks: dense smooth PW G-vecs: dense smooth PW Min 37 37 10 1393 1393 206 Max 38 38 11 1397 1397 213 Sum 2693 2693 749 100429 100429 15033 bravais-lattice index = 14 lattice parameter (alat) = 10.2506 a.u. unit-cell volume = 1039.2031 (a.u.)^3 number of atoms/cell = 7 number of atomic types = 3 number of electrons = 74.00 number of Kohn-Sham states= 88 kinetic-energy cutoff = 80.0000 Ry charge density cutoff = 320.0000 Ry Exchange-correlation = PBE ( 1 4 3 4 0 0) Non magnetic calculation with spin-orbit celldm(1)= 10.250630 celldm(2)= 1.000000 celldm(3)= 0.964826 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 0.964826 ) 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 1.036457 ) PseudoPot. # 1 for S read from file: /users/gautes/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 W read from file: /users/gautes/Pseudo/W.rel-pbe-oncvpsp.UPF MD5 check sum: fba24d4693276236030f452adbcbc845 Pseudo is Norm-conserving, Zval = 28.0 Generated using ONCVPSP code by D. R. Hamann Using radial grid of 600 points, 14 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 l(11) = 3 l(12) = 3 l(13) = 3 l(14) = 3 PseudoPot. # 3 for Cu read from file: /users/gautes/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) W 28.00 183.84000 W ( 1.00) Cu 11.00 63.54600 Cu( 1.00) 8 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 inv. 180 deg rotation - cart. axis [1,1,0] cryst. s( 5) = ( 0 -1 0 ) ( -1 0 0 ) ( 0 0 1 ) cart. s( 5) = ( -0.0000000 -1.0000000 0.0000000 ) ( -1.0000000 0.0000000 0.0000000 ) ( 0.0000000 0.0000000 1.0000000 ) isym = 6 inv. 180 deg rotation - cart. axis [1,-1,0] cryst. s( 6) = ( 0 1 0 ) ( 1 0 0 ) ( 0 0 1 ) cart. s( 6) = ( 0.0000000 1.0000000 -0.0000000 ) ( 1.0000000 -0.0000000 0.0000000 ) ( 0.0000000 0.0000000 1.0000000 ) isym = 7 inv. 90 deg rotation - cart. axis [0,0,-1] cryst. s( 7) = ( 0 1 0 ) ( -1 0 0 ) ( 0 0 -1 ) cart. s( 7) = ( 0.0000000 -1.0000000 -0.0000000 ) ( 1.0000000 -0.0000000 -0.0000000 ) ( 0.0000000 0.0000000 -1.0000000 ) isym = 8 inv. 90 deg rotation - cart. axis [0,0,1] cryst. s( 8) = ( 0 -1 0 ) ( 1 0 0 ) ( 0 0 -1 ) cart. s( 8) = ( -0.0000000 1.0000000 -0.0000000 ) ( -1.0000000 0.0000000 -0.0000000 ) ( 0.0000000 0.0000000 -1.0000000 ) double point group D_2d (-42m) there are 7 classes and 2 irreducible representations the character table: E -E 2S4 -2S4 C2 2C2' 2s_d -C2 -2C2' -2s_d G_6 2.00 -2.00 1.41 -1.41 0.00 0.00 0.00 G_7 2.00 -2.00 -1.41 1.41 0.00 0.00 0.00 the symmetry operations in each class and the name of the first element: E 1 identity -E -1 identity E 2S4 7 8 inv. 90 deg rotation - cart. axis [0,0,-1] -2S4 -7 -8 inv. 90 deg rotation - cart. axis [0,0,-1] E C2 -C2 2 -2 180 deg rotation - cart. axis [0,0,1] 2C2' -2C2' 3 -3 4 -4 180 deg rotation - cart. axis [0,1,0] 2s_d -2s_d 5 -5 6 -6 inv. 180 deg rotation - cart. axis [1,1,0] Cartesian axes number of k points= 300 Fermi-Dirac smearing, width (Ry)= 0.0010 cart. coord. in units 2pi/alat k( 1) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0033333 k( 2) = ( 0.0000000 0.0172414 -0.0000000), wk = 0.0033333 k( 3) = ( 0.0000000 0.0344828 -0.0000000), wk = 0.0033333 k( 4) = ( 0.0000000 0.0517241 -0.0000000), wk = 0.0033333 k( 5) = ( 0.0000000 0.0689655 -0.0000000), wk = 0.0033333 k( 6) = ( 0.0000000 0.0862069 -0.0000000), wk = 0.0033333 k( 7) = ( 0.0000000 0.1034483 -0.0000000), wk = 0.0033333 k( 8) = ( 0.0000000 0.1206897 -0.0000000), wk = 0.0033333 k( 9) = ( 0.0000000 0.1379310 -0.0000000), wk = 0.0033333 k( 10) = ( 0.0000000 0.1551724 -0.0000000), wk = 0.0033333 k( 11) = ( 0.0000000 0.1724138 -0.0000000), wk = 0.0033333 k( 12) = ( 0.0000000 0.1896552 -0.0000000), wk = 0.0033333 k( 13) = ( 0.0000000 0.2068966 -0.0000000), wk = 0.0033333 k( 14) = ( 0.0000000 0.2241379 -0.0000000), wk = 0.0033333 k( 15) = ( 0.0000000 0.2413793 -0.0000000), wk = 0.0033333 k( 16) = ( 0.0000000 0.2586207 -0.0000000), wk = 0.0033333 k( 17) = ( 0.0000000 0.2758621 -0.0000000), wk = 0.0033333 k( 18) = ( 0.0000000 0.2931034 -0.0000000), wk = 0.0033333 k( 19) = ( 0.0000000 0.3103448 -0.0000000), wk = 0.0033333 k( 20) = ( 0.0000000 0.3275862 -0.0000000), wk = 0.0033333 k( 21) = ( 0.0000000 0.3448276 -0.0000000), wk = 0.0033333 k( 22) = ( 0.0000000 0.3620690 -0.0000000), wk = 0.0033333 k( 23) = ( 0.0000000 0.3793103 -0.0000000), wk = 0.0033333 k( 24) = ( 0.0000000 0.3965517 -0.0000000), wk = 0.0033333 k( 25) = ( 0.0000000 0.4137931 -0.0000000), wk = 0.0033333 k( 26) = ( 0.0000000 0.4310345 -0.0000000), wk = 0.0033333 k( 27) = ( 0.0000000 0.4482759 -0.0000000), wk = 0.0033333 k( 28) = ( 0.0000000 0.4655172 -0.0000000), wk = 0.0033333 k( 29) = ( 0.0000000 0.4827586 -0.0000000), wk = 0.0033333 k( 30) = ( 0.0000000 0.5000000 -0.0000000), wk = 0.0033333 k( 31) = ( 0.0000000 0.5000000 -0.0000000), wk = 0.0033333 k( 32) = ( 0.0172414 0.5000000 -0.0000000), wk = 0.0033333 k( 33) = ( 0.0344828 0.5000000 -0.0000000), wk = 0.0033333 k( 34) = ( 0.0517241 0.5000000 -0.0000000), wk = 0.0033333 k( 35) = ( 0.0689655 0.5000000 -0.0000000), wk = 0.0033333 k( 36) = ( 0.0862069 0.5000000 -0.0000000), wk = 0.0033333 k( 37) = ( 0.1034483 0.5000000 -0.0000000), wk = 0.0033333 k( 38) = ( 0.1206897 0.5000000 -0.0000000), wk = 0.0033333 k( 39) = ( 0.1379310 0.5000000 -0.0000000), wk = 0.0033333 k( 40) = ( 0.1551724 0.5000000 -0.0000000), wk = 0.0033333 k( 41) = ( 0.1724138 0.5000000 -0.0000000), wk = 0.0033333 k( 42) = ( 0.1896552 0.5000000 -0.0000000), wk = 0.0033333 k( 43) = ( 0.2068966 0.5000000 -0.0000000), wk = 0.0033333 k( 44) = ( 0.2241379 0.5000000 -0.0000000), wk = 0.0033333 k( 45) = ( 0.2413793 0.5000000 -0.0000000), wk = 0.0033333 k( 46) = ( 0.2586207 0.5000000 -0.0000000), wk = 0.0033333 k( 47) = ( 0.2758621 0.5000000 -0.0000000), wk = 0.0033333 k( 48) = ( 0.2931034 0.5000000 -0.0000000), wk = 0.0033333 k( 49) = ( 0.3103448 0.5000000 -0.0000000), wk = 0.0033333 k( 50) = ( 0.3275862 0.5000000 -0.0000000), wk = 0.0033333 k( 51) = ( 0.3448276 0.5000000 -0.0000000), wk = 0.0033333 k( 52) = ( 0.3620690 0.5000000 -0.0000000), wk = 0.0033333 k( 53) = ( 0.3793103 0.5000000 -0.0000000), wk = 0.0033333 k( 54) = ( 0.3965517 0.5000000 -0.0000000), wk = 0.0033333 k( 55) = ( 0.4137931 0.5000000 -0.0000000), wk = 0.0033333 k( 56) = ( 0.4310345 0.5000000 -0.0000000), wk = 0.0033333 k( 57) = ( 0.4482759 0.5000000 -0.0000000), wk = 0.0033333 k( 58) = ( 0.4655172 0.5000000 -0.0000000), wk = 0.0033333 k( 59) = ( 0.4827586 0.5000000 -0.0000000), wk = 0.0033333 k( 60) = ( 0.5000000 0.5000000 -0.0000000), wk = 0.0033333 k( 61) = ( 0.5000000 0.5000000 -0.0000000), wk = 0.0033333 k( 62) = ( 0.4878049 0.4878049 -0.0000000), wk = 0.0033333 k( 63) = ( 0.4756098 0.4756098 -0.0000000), wk = 0.0033333 k( 64) = ( 0.4634146 0.4634146 -0.0000000), wk = 0.0033333 k( 65) = ( 0.4512195 0.4512195 -0.0000000), wk = 0.0033333 k( 66) = ( 0.4390244 0.4390244 -0.0000000), wk = 0.0033333 k( 67) = ( 0.4268293 0.4268293 -0.0000000), wk = 0.0033333 k( 68) = ( 0.4146341 0.4146341 -0.0000000), wk = 0.0033333 k( 69) = ( 0.4024390 0.4024390 -0.0000000), wk = 0.0033333 k( 70) = ( 0.3902439 0.3902439 -0.0000000), wk = 0.0033333 k( 71) = ( 0.3780488 0.3780488 -0.0000000), wk = 0.0033333 k( 72) = ( 0.3658537 0.3658537 -0.0000000), wk = 0.0033333 k( 73) = ( 0.3536585 0.3536585 -0.0000000), wk = 0.0033333 k( 74) = ( 0.3414634 0.3414634 -0.0000000), wk = 0.0033333 k( 75) = ( 0.3292683 0.3292683 -0.0000000), wk = 0.0033333 k( 76) = ( 0.3170732 0.3170732 -0.0000000), wk = 0.0033333 k( 77) = ( 0.3048781 0.3048780 -0.0000000), wk = 0.0033333 k( 78) = ( 0.2926829 0.2926829 -0.0000000), wk = 0.0033333 k( 79) = ( 0.2804878 0.2804878 -0.0000000), wk = 0.0033333 k( 80) = ( 0.2682927 0.2682927 -0.0000000), wk = 0.0033333 k( 81) = ( 0.2560976 0.2560976 -0.0000000), wk = 0.0033333 k( 82) = ( 0.2439024 0.2439024 -0.0000000), wk = 0.0033333 k( 83) = ( 0.2317073 0.2317073 -0.0000000), wk = 0.0033333 k( 84) = ( 0.2195122 0.2195122 -0.0000000), wk = 0.0033333 k( 85) = ( 0.2073171 0.2073171 -0.0000000), wk = 0.0033333 k( 86) = ( 0.1951219 0.1951219 -0.0000000), wk = 0.0033333 k( 87) = ( 0.1829268 0.1829268 -0.0000000), wk = 0.0033333 k( 88) = ( 0.1707317 0.1707317 -0.0000000), wk = 0.0033333 k( 89) = ( 0.1585366 0.1585366 -0.0000000), wk = 0.0033333 k( 90) = ( 0.1463415 0.1463415 -0.0000000), wk = 0.0033333 k( 91) = ( 0.1341463 0.1341463 -0.0000000), wk = 0.0033333 k( 92) = ( 0.1219512 0.1219512 -0.0000000), wk = 0.0033333 k( 93) = ( 0.1097561 0.1097561 -0.0000000), wk = 0.0033333 k( 94) = ( 0.0975610 0.0975610 -0.0000000), wk = 0.0033333 k( 95) = ( 0.0853658 0.0853658 -0.0000000), wk = 0.0033333 k( 96) = ( 0.0731707 0.0731707 -0.0000000), wk = 0.0033333 k( 97) = ( 0.0609756 0.0609756 -0.0000000), wk = 0.0033333 k( 98) = ( 0.0487805 0.0487805 -0.0000000), wk = 0.0033333 k( 99) = ( 0.0365854 0.0365854 -0.0000000), wk = 0.0033333 k( 100) = ( 0.0243902 0.0243902 -0.0000000), wk = 0.0033333 k( 101) = ( 0.0121951 0.0121951 -0.0000000), wk = 0.0033333 k( 102) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0033333 k( 103) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0033333 k( 104) = ( 0.0000000 0.0000000 0.0167170), wk = 0.0033333 k( 105) = ( 0.0000000 0.0000000 0.0334341), wk = 0.0033333 k( 106) = ( 0.0000000 0.0000000 0.0501511), wk = 0.0033333 k( 107) = ( 0.0000000 0.0000000 0.0668682), wk = 0.0033333 k( 108) = ( 0.0000000 0.0000000 0.0835852), wk = 0.0033333 k( 109) = ( 0.0000000 0.0000000 0.1003023), wk = 0.0033333 k( 110) = ( 0.0000000 0.0000000 0.1170193), wk = 0.0033333 k( 111) = ( 0.0000000 0.0000000 0.1337364), wk = 0.0033333 k( 112) = ( 0.0000000 0.0000000 0.1504534), wk = 0.0033333 k( 113) = ( 0.0000000 0.0000000 0.1671704), wk = 0.0033333 k( 114) = ( 0.0000000 0.0000000 0.1838875), wk = 0.0033333 k( 115) = ( 0.0000000 0.0000000 0.2006045), wk = 0.0033333 k( 116) = ( 0.0000000 0.0000000 0.2173216), wk = 0.0033333 k( 117) = ( 0.0000000 0.0000000 0.2340386), wk = 0.0033333 k( 118) = ( 0.0000000 0.0000000 0.2507557), wk = 0.0033333 k( 119) = ( 0.0000000 0.0000000 0.2674727), wk = 0.0033333 k( 120) = ( 0.0000000 0.0000000 0.2841898), wk = 0.0033333 k( 121) = ( 0.0000000 0.0000000 0.3009068), wk = 0.0033333 k( 122) = ( 0.0000000 0.0000000 0.3176238), wk = 0.0033333 k( 123) = ( 0.0000000 0.0000000 0.3343409), wk = 0.0033333 k( 124) = ( 0.0000000 0.0000000 0.3510579), wk = 0.0033333 k( 125) = ( 0.0000000 0.0000000 0.3677750), wk = 0.0033333 k( 126) = ( 0.0000000 0.0000000 0.3844920), wk = 0.0033333 k( 127) = ( 0.0000000 0.0000000 0.4012091), wk = 0.0033333 k( 128) = ( 0.0000000 0.0000000 0.4179261), wk = 0.0033333 k( 129) = ( 0.0000000 0.0000000 0.4346432), wk = 0.0033333 k( 130) = ( 0.0000000 0.0000000 0.4513602), wk = 0.0033333 k( 131) = ( 0.0000000 0.0000000 0.4680772), wk = 0.0033333 k( 132) = ( 0.0000000 0.0000000 0.4847943), wk = 0.0033333 k( 133) = ( 0.0000000 0.0000000 0.5015113), wk = 0.0033333 k( 134) = ( 0.0000000 0.0000000 0.5182284), wk = 0.0033333 k( 135) = ( 0.0000000 0.0000000 0.5182284), wk = 0.0033333 k( 136) = ( 0.0000000 0.0172414 0.5182284), wk = 0.0033333 k( 137) = ( 0.0000000 0.0344828 0.5182284), wk = 0.0033333 k( 138) = ( 0.0000000 0.0517241 0.5182284), wk = 0.0033333 k( 139) = ( 0.0000000 0.0689655 0.5182284), wk = 0.0033333 k( 140) = ( 0.0000000 0.0862069 0.5182284), wk = 0.0033333 k( 141) = ( 0.0000000 0.1034483 0.5182284), wk = 0.0033333 k( 142) = ( 0.0000000 0.1206897 0.5182284), wk = 0.0033333 k( 143) = ( 0.0000000 0.1379310 0.5182284), wk = 0.0033333 k( 144) = ( 0.0000000 0.1551724 0.5182284), wk = 0.0033333 k( 145) = ( 0.0000000 0.1724138 0.5182284), wk = 0.0033333 k( 146) = ( 0.0000000 0.1896552 0.5182284), wk = 0.0033333 k( 147) = ( 0.0000000 0.2068966 0.5182284), wk = 0.0033333 k( 148) = ( 0.0000000 0.2241379 0.5182284), wk = 0.0033333 k( 149) = ( 0.0000000 0.2413793 0.5182284), wk = 0.0033333 k( 150) = ( 0.0000000 0.2586207 0.5182284), wk = 0.0033333 k( 151) = ( 0.0000000 0.2758621 0.5182284), wk = 0.0033333 k( 152) = ( 0.0000000 0.2931034 0.5182284), wk = 0.0033333 k( 153) = ( 0.0000000 0.3103448 0.5182284), wk = 0.0033333 k( 154) = ( 0.0000000 0.3275862 0.5182284), wk = 0.0033333 k( 155) = ( 0.0000000 0.3448276 0.5182284), wk = 0.0033333 k( 156) = ( 0.0000000 0.3620690 0.5182284), wk = 0.0033333 k( 157) = ( 0.0000000 0.3793103 0.5182284), wk = 0.0033333 k( 158) = ( 0.0000000 0.3965517 0.5182284), wk = 0.0033333 k( 159) = ( 0.0000000 0.4137931 0.5182284), wk = 0.0033333 k( 160) = ( 0.0000000 0.4310345 0.5182284), wk = 0.0033333 k( 161) = ( 0.0000000 0.4482759 0.5182284), wk = 0.0033333 k( 162) = ( 0.0000000 0.4655172 0.5182284), wk = 0.0033333 k( 163) = ( 0.0000000 0.4827586 0.5182284), wk = 0.0033333 k( 164) = ( 0.0000000 0.5000000 0.5182284), wk = 0.0033333 k( 165) = ( 0.0000000 0.5000000 0.5182284), wk = 0.0033333 k( 166) = ( 0.0172414 0.5000000 0.5182284), wk = 0.0033333 k( 167) = ( 0.0344828 0.5000000 0.5182284), wk = 0.0033333 k( 168) = ( 0.0517241 0.5000000 0.5182284), wk = 0.0033333 k( 169) = ( 0.0689655 0.5000000 0.5182284), wk = 0.0033333 k( 170) = ( 0.0862069 0.5000000 0.5182284), wk = 0.0033333 k( 171) = ( 0.1034483 0.5000000 0.5182284), wk = 0.0033333 k( 172) = ( 0.1206897 0.5000000 0.5182284), wk = 0.0033333 k( 173) = ( 0.1379310 0.5000000 0.5182284), wk = 0.0033333 k( 174) = ( 0.1551724 0.5000000 0.5182284), wk = 0.0033333 k( 175) = ( 0.1724138 0.5000000 0.5182284), wk = 0.0033333 k( 176) = ( 0.1896552 0.5000000 0.5182284), wk = 0.0033333 k( 177) = ( 0.2068966 0.5000000 0.5182284), wk = 0.0033333 k( 178) = ( 0.2241379 0.5000000 0.5182284), wk = 0.0033333 k( 179) = ( 0.2413793 0.5000000 0.5182284), wk = 0.0033333 k( 180) = ( 0.2586207 0.5000000 0.5182284), wk = 0.0033333 k( 181) = ( 0.2758621 0.5000000 0.5182284), wk = 0.0033333 k( 182) = ( 0.2931034 0.5000000 0.5182284), wk = 0.0033333 k( 183) = ( 0.3103448 0.5000000 0.5182284), wk = 0.0033333 k( 184) = ( 0.3275862 0.5000000 0.5182284), wk = 0.0033333 k( 185) = ( 0.3448276 0.5000000 0.5182284), wk = 0.0033333 k( 186) = ( 0.3620690 0.5000000 0.5182284), wk = 0.0033333 k( 187) = ( 0.3793103 0.5000000 0.5182284), wk = 0.0033333 k( 188) = ( 0.3965517 0.5000000 0.5182284), wk = 0.0033333 k( 189) = ( 0.4137931 0.5000000 0.5182284), wk = 0.0033333 k( 190) = ( 0.4310345 0.5000000 0.5182284), wk = 0.0033333 k( 191) = ( 0.4482759 0.5000000 0.5182284), wk = 0.0033333 k( 192) = ( 0.4655172 0.5000000 0.5182284), wk = 0.0033333 k( 193) = ( 0.4827586 0.5000000 0.5182284), wk = 0.0033333 k( 194) = ( 0.5000000 0.5000000 0.5182284), wk = 0.0033333 k( 195) = ( 0.5000000 0.5000000 0.5182284), wk = 0.0033333 k( 196) = ( 0.4878049 0.4878049 0.5182284), wk = 0.0033333 k( 197) = ( 0.4756098 0.4756098 0.5182284), wk = 0.0033333 k( 198) = ( 0.4634146 0.4634146 0.5182284), wk = 0.0033333 k( 199) = ( 0.4512195 0.4512195 0.5182284), wk = 0.0033333 k( 200) = ( 0.4390244 0.4390244 0.5182284), wk = 0.0033333 k( 201) = ( 0.4268293 0.4268293 0.5182284), wk = 0.0033333 k( 202) = ( 0.4146341 0.4146341 0.5182284), wk = 0.0033333 k( 203) = ( 0.4024390 0.4024390 0.5182284), wk = 0.0033333 k( 204) = ( 0.3902439 0.3902439 0.5182284), wk = 0.0033333 k( 205) = ( 0.3780488 0.3780488 0.5182284), wk = 0.0033333 k( 206) = ( 0.3658537 0.3658537 0.5182284), wk = 0.0033333 k( 207) = ( 0.3536585 0.3536585 0.5182284), wk = 0.0033333 k( 208) = ( 0.3414634 0.3414634 0.5182284), wk = 0.0033333 k( 209) = ( 0.3292683 0.3292683 0.5182284), wk = 0.0033333 k( 210) = ( 0.3170732 0.3170732 0.5182284), wk = 0.0033333 k( 211) = ( 0.3048781 0.3048780 0.5182284), wk = 0.0033333 k( 212) = ( 0.2926829 0.2926829 0.5182284), wk = 0.0033333 k( 213) = ( 0.2804878 0.2804878 0.5182284), wk = 0.0033333 k( 214) = ( 0.2682927 0.2682927 0.5182284), wk = 0.0033333 k( 215) = ( 0.2560976 0.2560976 0.5182284), wk = 0.0033333 k( 216) = ( 0.2439024 0.2439024 0.5182284), wk = 0.0033333 k( 217) = ( 0.2317073 0.2317073 0.5182284), wk = 0.0033333 k( 218) = ( 0.2195122 0.2195122 0.5182284), wk = 0.0033333 k( 219) = ( 0.2073171 0.2073171 0.5182284), wk = 0.0033333 k( 220) = ( 0.1951219 0.1951219 0.5182284), wk = 0.0033333 k( 221) = ( 0.1829268 0.1829268 0.5182284), wk = 0.0033333 k( 222) = ( 0.1707317 0.1707317 0.5182284), wk = 0.0033333 k( 223) = ( 0.1585366 0.1585366 0.5182284), wk = 0.0033333 k( 224) = ( 0.1463415 0.1463415 0.5182284), wk = 0.0033333 k( 225) = ( 0.1341463 0.1341463 0.5182284), wk = 0.0033333 k( 226) = ( 0.1219512 0.1219512 0.5182284), wk = 0.0033333 k( 227) = ( 0.1097561 0.1097561 0.5182284), wk = 0.0033333 k( 228) = ( 0.0975610 0.0975610 0.5182284), wk = 0.0033333 k( 229) = ( 0.0853658 0.0853658 0.5182284), wk = 0.0033333 k( 230) = ( 0.0731707 0.0731707 0.5182284), wk = 0.0033333 k( 231) = ( 0.0609756 0.0609756 0.5182284), wk = 0.0033333 k( 232) = ( 0.0487805 0.0487805 0.5182284), wk = 0.0033333 k( 233) = ( 0.0365854 0.0365854 0.5182284), wk = 0.0033333 k( 234) = ( 0.0243902 0.0243902 0.5182284), wk = 0.0033333 k( 235) = ( 0.0121951 0.0121951 0.5182284), wk = 0.0033333 k( 236) = ( 0.0000000 0.0000000 0.5182284), wk = 0.0033333 k( 237) = ( 0.0000000 0.5000000 -0.0000000), wk = 0.0033333 k( 238) = ( 0.0000000 0.5000000 0.0167170), wk = 0.0033333 k( 239) = ( 0.0000000 0.5000000 0.0334341), wk = 0.0033333 k( 240) = ( 0.0000000 0.5000000 0.0501511), wk = 0.0033333 k( 241) = ( 0.0000000 0.5000000 0.0668682), wk = 0.0033333 k( 242) = ( 0.0000000 0.5000000 0.0835852), wk = 0.0033333 k( 243) = ( 0.0000000 0.5000000 0.1003023), wk = 0.0033333 k( 244) = ( 0.0000000 0.5000000 0.1170193), wk = 0.0033333 k( 245) = ( 0.0000000 0.5000000 0.1337364), wk = 0.0033333 k( 246) = ( 0.0000000 0.5000000 0.1504534), wk = 0.0033333 k( 247) = ( 0.0000000 0.5000000 0.1671704), wk = 0.0033333 k( 248) = ( 0.0000000 0.5000000 0.1838875), wk = 0.0033333 k( 249) = ( 0.0000000 0.5000000 0.2006045), wk = 0.0033333 k( 250) = ( 0.0000000 0.5000000 0.2173216), wk = 0.0033333 k( 251) = ( 0.0000000 0.5000000 0.2340386), wk = 0.0033333 k( 252) = ( 0.0000000 0.5000000 0.2507557), wk = 0.0033333 k( 253) = ( 0.0000000 0.5000000 0.2674727), wk = 0.0033333 k( 254) = ( 0.0000000 0.5000000 0.2841898), wk = 0.0033333 k( 255) = ( 0.0000000 0.5000000 0.3009068), wk = 0.0033333 k( 256) = ( 0.0000000 0.5000000 0.3176238), wk = 0.0033333 k( 257) = ( 0.0000000 0.5000000 0.3343409), wk = 0.0033333 k( 258) = ( 0.0000000 0.5000000 0.3510579), wk = 0.0033333 k( 259) = ( 0.0000000 0.5000000 0.3677750), wk = 0.0033333 k( 260) = ( 0.0000000 0.5000000 0.3844920), wk = 0.0033333 k( 261) = ( 0.0000000 0.5000000 0.4012091), wk = 0.0033333 k( 262) = ( 0.0000000 0.5000000 0.4179261), wk = 0.0033333 k( 263) = ( 0.0000000 0.5000000 0.4346432), wk = 0.0033333 k( 264) = ( 0.0000000 0.5000000 0.4513602), wk = 0.0033333 k( 265) = ( 0.0000000 0.5000000 0.4680772), wk = 0.0033333 k( 266) = ( 0.0000000 0.5000000 0.4847943), wk = 0.0033333 k( 267) = ( 0.0000000 0.5000000 0.5015113), wk = 0.0033333 k( 268) = ( 0.0000000 0.5000000 0.5182284), wk = 0.0033333 k( 269) = ( 0.5000000 0.5000000 -0.0000000), wk = 0.0033333 k( 270) = ( 0.5000000 0.5000000 0.0167170), wk = 0.0033333 k( 271) = ( 0.5000000 0.5000000 0.0334341), wk = 0.0033333 k( 272) = ( 0.5000000 0.5000000 0.0501511), wk = 0.0033333 k( 273) = ( 0.5000000 0.5000000 0.0668682), wk = 0.0033333 k( 274) = ( 0.5000000 0.5000000 0.0835852), wk = 0.0033333 k( 275) = ( 0.5000000 0.5000000 0.1003023), wk = 0.0033333 k( 276) = ( 0.5000000 0.5000000 0.1170193), wk = 0.0033333 k( 277) = ( 0.5000000 0.5000000 0.1337364), wk = 0.0033333 k( 278) = ( 0.5000000 0.5000000 0.1504534), wk = 0.0033333 k( 279) = ( 0.5000000 0.5000000 0.1671704), wk = 0.0033333 k( 280) = ( 0.5000000 0.5000000 0.1838875), wk = 0.0033333 k( 281) = ( 0.5000000 0.5000000 0.2006045), wk = 0.0033333 k( 282) = ( 0.5000000 0.5000000 0.2173216), wk = 0.0033333 k( 283) = ( 0.5000000 0.5000000 0.2340386), wk = 0.0033333 k( 284) = ( 0.5000000 0.5000000 0.2507557), wk = 0.0033333 k( 285) = ( 0.5000000 0.5000000 0.2674727), wk = 0.0033333 k( 286) = ( 0.5000000 0.5000000 0.2841898), wk = 0.0033333 k( 287) = ( 0.5000000 0.5000000 0.3009068), wk = 0.0033333 k( 288) = ( 0.5000000 0.5000000 0.3176238), wk = 0.0033333 k( 289) = ( 0.5000000 0.5000000 0.3343409), wk = 0.0033333 k( 290) = ( 0.5000000 0.5000000 0.3510579), wk = 0.0033333 k( 291) = ( 0.5000000 0.5000000 0.3677750), wk = 0.0033333 k( 292) = ( 0.5000000 0.5000000 0.3844920), wk = 0.0033333 k( 293) = ( 0.5000000 0.5000000 0.4012091), wk = 0.0033333 k( 294) = ( 0.5000000 0.5000000 0.4179261), wk = 0.0033333 k( 295) = ( 0.5000000 0.5000000 0.4346432), wk = 0.0033333 k( 296) = ( 0.5000000 0.5000000 0.4513602), wk = 0.0033333 k( 297) = ( 0.5000000 0.5000000 0.4680772), wk = 0.0033333 k( 298) = ( 0.5000000 0.5000000 0.4847943), wk = 0.0033333 k( 299) = ( 0.5000000 0.5000000 0.5015113), wk = 0.0033333 k( 300) = ( 0.5000000 0.5000000 0.5182284), wk = 0.0033333 cryst. coord. k( 1) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0033333 k( 2) = ( 0.0000000 0.0172414 -0.0000000), wk = 0.0033333 k( 3) = ( 0.0000000 0.0344828 -0.0000000), wk = 0.0033333 k( 4) = ( 0.0000000 0.0517241 -0.0000000), wk = 0.0033333 k( 5) = ( 0.0000000 0.0689655 -0.0000000), wk = 0.0033333 k( 6) = ( 0.0000000 0.0862069 0.0000000), wk = 0.0033333 k( 7) = ( 0.0000000 0.1034483 -0.0000000), wk = 0.0033333 k( 8) = ( 0.0000000 0.1206897 -0.0000000), wk = 0.0033333 k( 9) = ( 0.0000000 0.1379310 -0.0000000), wk = 0.0033333 k( 10) = ( 0.0000000 0.1551724 0.0000000), wk = 0.0033333 k( 11) = ( 0.0000000 0.1724138 0.0000000), wk = 0.0033333 k( 12) = ( 0.0000000 0.1896552 -0.0000000), wk = 0.0033333 k( 13) = ( 0.0000000 0.2068966 -0.0000000), wk = 0.0033333 k( 14) = ( 0.0000000 0.2241379 -0.0000000), wk = 0.0033333 k( 15) = ( 0.0000000 0.2413793 0.0000000), wk = 0.0033333 k( 16) = ( 0.0000000 0.2586207 -0.0000000), wk = 0.0033333 k( 17) = ( 0.0000000 0.2758621 0.0000000), wk = 0.0033333 k( 18) = ( 0.0000000 0.2931034 0.0000000), wk = 0.0033333 k( 19) = ( 0.0000000 0.3103448 -0.0000000), wk = 0.0033333 k( 20) = ( 0.0000000 0.3275862 -0.0000000), wk = 0.0033333 k( 21) = ( 0.0000000 0.3448276 -0.0000000), wk = 0.0033333 k( 22) = ( 0.0000000 0.3620690 -0.0000000), wk = 0.0033333 k( 23) = ( 0.0000000 0.3793103 -0.0000000), wk = 0.0033333 k( 24) = ( 0.0000000 0.3965517 -0.0000000), wk = 0.0033333 k( 25) = ( 0.0000000 0.4137931 -0.0000000), wk = 0.0033333 k( 26) = ( 0.0000000 0.4310345 -0.0000000), wk = 0.0033333 k( 27) = ( 0.0000000 0.4482759 -0.0000000), wk = 0.0033333 k( 28) = ( 0.0000000 0.4655172 0.0000000), wk = 0.0033333 k( 29) = ( 0.0000000 0.4827586 0.0000000), wk = 0.0033333 k( 30) = ( 0.0000000 0.5000000 -0.0000000), wk = 0.0033333 k( 31) = ( 0.0000000 0.5000000 -0.0000000), wk = 0.0033333 k( 32) = ( 0.0172414 0.5000000 -0.0000000), wk = 0.0033333 k( 33) = ( 0.0344828 0.5000000 0.0000000), wk = 0.0033333 k( 34) = ( 0.0517241 0.5000000 -0.0000000), wk = 0.0033333 k( 35) = ( 0.0689655 0.5000000 0.0000000), wk = 0.0033333 k( 36) = ( 0.0862069 0.5000000 0.0000000), wk = 0.0033333 k( 37) = ( 0.1034483 0.5000000 -0.0000000), wk = 0.0033333 k( 38) = ( 0.1206897 0.5000000 -0.0000000), wk = 0.0033333 k( 39) = ( 0.1379310 0.5000000 -0.0000000), wk = 0.0033333 k( 40) = ( 0.1551724 0.5000000 -0.0000000), wk = 0.0033333 k( 41) = ( 0.1724138 0.5000000 0.0000000), wk = 0.0033333 k( 42) = ( 0.1896552 0.5000000 0.0000000), wk = 0.0033333 k( 43) = ( 0.2068966 0.5000000 -0.0000000), wk = 0.0033333 k( 44) = ( 0.2241379 0.5000000 0.0000000), wk = 0.0033333 k( 45) = ( 0.2413793 0.5000000 0.0000000), wk = 0.0033333 k( 46) = ( 0.2586207 0.5000000 0.0000000), wk = 0.0033333 k( 47) = ( 0.2758621 0.5000000 -0.0000000), wk = 0.0033333 k( 48) = ( 0.2931034 0.5000000 -0.0000000), wk = 0.0033333 k( 49) = ( 0.3103448 0.5000000 -0.0000000), wk = 0.0033333 k( 50) = ( 0.3275862 0.5000000 -0.0000000), wk = 0.0033333 k( 51) = ( 0.3448276 0.5000000 0.0000000), wk = 0.0033333 k( 52) = ( 0.3620690 0.5000000 -0.0000000), wk = 0.0033333 k( 53) = ( 0.3793103 0.5000000 -0.0000000), wk = 0.0033333 k( 54) = ( 0.3965517 0.5000000 -0.0000000), wk = 0.0033333 k( 55) = ( 0.4137931 0.5000000 -0.0000000), wk = 0.0033333 k( 56) = ( 0.4310345 0.5000000 0.0000000), wk = 0.0033333 k( 57) = ( 0.4482759 0.5000000 0.0000000), wk = 0.0033333 k( 58) = ( 0.4655172 0.5000000 -0.0000000), wk = 0.0033333 k( 59) = ( 0.4827586 0.5000000 -0.0000000), wk = 0.0033333 k( 60) = ( 0.5000000 0.5000000 -0.0000000), wk = 0.0033333 k( 61) = ( 0.5000000 0.5000000 -0.0000000), wk = 0.0033333 k( 62) = ( 0.4878049 0.4878049 -0.0000000), wk = 0.0033333 k( 63) = ( 0.4756098 0.4756098 -0.0000000), wk = 0.0033333 k( 64) = ( 0.4634146 0.4634146 -0.0000000), wk = 0.0033333 k( 65) = ( 0.4512195 0.4512195 0.0000000), wk = 0.0033333 k( 66) = ( 0.4390244 0.4390244 -0.0000000), wk = 0.0033333 k( 67) = ( 0.4268293 0.4268293 -0.0000000), wk = 0.0033333 k( 68) = ( 0.4146341 0.4146341 -0.0000000), wk = 0.0033333 k( 69) = ( 0.4024390 0.4024390 -0.0000000), wk = 0.0033333 k( 70) = ( 0.3902439 0.3902439 0.0000000), wk = 0.0033333 k( 71) = ( 0.3780488 0.3780488 -0.0000000), wk = 0.0033333 k( 72) = ( 0.3658537 0.3658537 -0.0000000), wk = 0.0033333 k( 73) = ( 0.3536585 0.3536585 -0.0000000), wk = 0.0033333 k( 74) = ( 0.3414634 0.3414634 0.0000000), wk = 0.0033333 k( 75) = ( 0.3292683 0.3292683 -0.0000000), wk = 0.0033333 k( 76) = ( 0.3170732 0.3170732 -0.0000000), wk = 0.0033333 k( 77) = ( 0.3048781 0.3048781 -0.0000000), wk = 0.0033333 k( 78) = ( 0.2926829 0.2926829 -0.0000000), wk = 0.0033333 k( 79) = ( 0.2804878 0.2804878 -0.0000000), wk = 0.0033333 k( 80) = ( 0.2682927 0.2682927 0.0000000), wk = 0.0033333 k( 81) = ( 0.2560976 0.2560976 0.0000000), wk = 0.0033333 k( 82) = ( 0.2439024 0.2439024 -0.0000000), wk = 0.0033333 k( 83) = ( 0.2317073 0.2317073 0.0000000), wk = 0.0033333 k( 84) = ( 0.2195122 0.2195122 0.0000000), wk = 0.0033333 k( 85) = ( 0.2073171 0.2073171 0.0000000), wk = 0.0033333 k( 86) = ( 0.1951219 0.1951219 0.0000000), wk = 0.0033333 k( 87) = ( 0.1829268 0.1829268 -0.0000000), wk = 0.0033333 k( 88) = ( 0.1707317 0.1707317 -0.0000000), wk = 0.0033333 k( 89) = ( 0.1585366 0.1585366 -0.0000000), wk = 0.0033333 k( 90) = ( 0.1463415 0.1463415 -0.0000000), wk = 0.0033333 k( 91) = ( 0.1341463 0.1341463 0.0000000), wk = 0.0033333 k( 92) = ( 0.1219512 0.1219512 -0.0000000), wk = 0.0033333 k( 93) = ( 0.1097561 0.1097561 0.0000000), wk = 0.0033333 k( 94) = ( 0.0975610 0.0975610 -0.0000000), wk = 0.0033333 k( 95) = ( 0.0853658 0.0853658 -0.0000000), wk = 0.0033333 k( 96) = ( 0.0731707 0.0731707 -0.0000000), wk = 0.0033333 k( 97) = ( 0.0609756 0.0609756 -0.0000000), wk = 0.0033333 k( 98) = ( 0.0487805 0.0487805 -0.0000000), wk = 0.0033333 k( 99) = ( 0.0365854 0.0365854 -0.0000000), wk = 0.0033333 k( 100) = ( 0.0243902 0.0243902 0.0000000), wk = 0.0033333 k( 101) = ( 0.0121951 0.0121951 0.0000000), wk = 0.0033333 k( 102) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0033333 k( 103) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0033333 k( 104) = ( 0.0000000 0.0000000 0.0161290), wk = 0.0033333 k( 105) = ( 0.0000000 0.0000000 0.0322581), wk = 0.0033333 k( 106) = ( 0.0000000 0.0000000 0.0483871), wk = 0.0033333 k( 107) = ( 0.0000000 0.0000000 0.0645161), wk = 0.0033333 k( 108) = ( 0.0000000 0.0000000 0.0806452), wk = 0.0033333 k( 109) = ( 0.0000000 0.0000000 0.0967742), wk = 0.0033333 k( 110) = ( 0.0000000 0.0000000 0.1129032), wk = 0.0033333 k( 111) = ( 0.0000000 0.0000000 0.1290323), wk = 0.0033333 k( 112) = ( 0.0000000 0.0000000 0.1451613), wk = 0.0033333 k( 113) = ( 0.0000000 0.0000000 0.1612903), wk = 0.0033333 k( 114) = ( 0.0000000 0.0000000 0.1774194), wk = 0.0033333 k( 115) = ( 0.0000000 0.0000000 0.1935484), wk = 0.0033333 k( 116) = ( 0.0000000 0.0000000 0.2096774), wk = 0.0033333 k( 117) = ( 0.0000000 0.0000000 0.2258064), wk = 0.0033333 k( 118) = ( 0.0000000 0.0000000 0.2419355), wk = 0.0033333 k( 119) = ( 0.0000000 0.0000000 0.2580645), wk = 0.0033333 k( 120) = ( 0.0000000 0.0000000 0.2741935), wk = 0.0033333 k( 121) = ( 0.0000000 0.0000000 0.2903226), wk = 0.0033333 k( 122) = ( 0.0000000 0.0000000 0.3064516), wk = 0.0033333 k( 123) = ( 0.0000000 0.0000000 0.3225807), wk = 0.0033333 k( 124) = ( 0.0000000 0.0000000 0.3387097), wk = 0.0033333 k( 125) = ( 0.0000000 0.0000000 0.3548387), wk = 0.0033333 k( 126) = ( 0.0000000 0.0000000 0.3709677), wk = 0.0033333 k( 127) = ( 0.0000000 0.0000000 0.3870968), wk = 0.0033333 k( 128) = ( 0.0000000 0.0000000 0.4032258), wk = 0.0033333 k( 129) = ( 0.0000000 0.0000000 0.4193548), wk = 0.0033333 k( 130) = ( 0.0000000 0.0000000 0.4354839), wk = 0.0033333 k( 131) = ( 0.0000000 0.0000000 0.4516129), wk = 0.0033333 k( 132) = ( 0.0000000 0.0000000 0.4677419), wk = 0.0033333 k( 133) = ( 0.0000000 0.0000000 0.4838710), wk = 0.0033333 k( 134) = ( 0.0000000 0.0000000 0.5000000), wk = 0.0033333 k( 135) = ( 0.0000000 0.0000000 0.5000000), wk = 0.0033333 k( 136) = ( 0.0000000 0.0172414 0.5000000), wk = 0.0033333 k( 137) = ( 0.0000000 0.0344828 0.5000000), wk = 0.0033333 k( 138) = ( 0.0000000 0.0517241 0.5000000), wk = 0.0033333 k( 139) = ( 0.0000000 0.0689655 0.5000000), wk = 0.0033333 k( 140) = ( 0.0000000 0.0862069 0.5000000), wk = 0.0033333 k( 141) = ( 0.0000000 0.1034483 0.5000000), wk = 0.0033333 k( 142) = ( 0.0000000 0.1206897 0.5000000), wk = 0.0033333 k( 143) = ( 0.0000000 0.1379310 0.5000000), wk = 0.0033333 k( 144) = ( 0.0000000 0.1551724 0.5000000), wk = 0.0033333 k( 145) = ( 0.0000000 0.1724138 0.5000000), wk = 0.0033333 k( 146) = ( 0.0000000 0.1896552 0.5000000), wk = 0.0033333 k( 147) = ( 0.0000000 0.2068966 0.5000000), wk = 0.0033333 k( 148) = ( 0.0000000 0.2241379 0.5000000), wk = 0.0033333 k( 149) = ( 0.0000000 0.2413793 0.5000000), wk = 0.0033333 k( 150) = ( 0.0000000 0.2586207 0.5000000), wk = 0.0033333 k( 151) = ( 0.0000000 0.2758621 0.5000000), wk = 0.0033333 k( 152) = ( 0.0000000 0.2931034 0.5000000), wk = 0.0033333 k( 153) = ( 0.0000000 0.3103448 0.5000000), wk = 0.0033333 k( 154) = ( 0.0000000 0.3275862 0.5000000), wk = 0.0033333 k( 155) = ( 0.0000000 0.3448276 0.5000000), wk = 0.0033333 k( 156) = ( 0.0000000 0.3620690 0.5000000), wk = 0.0033333 k( 157) = ( 0.0000000 0.3793103 0.5000000), wk = 0.0033333 k( 158) = ( 0.0000000 0.3965517 0.5000000), wk = 0.0033333 k( 159) = ( 0.0000000 0.4137931 0.5000000), wk = 0.0033333 k( 160) = ( 0.0000000 0.4310345 0.5000000), wk = 0.0033333 k( 161) = ( 0.0000000 0.4482759 0.5000000), wk = 0.0033333 k( 162) = ( 0.0000000 0.4655172 0.5000000), wk = 0.0033333 k( 163) = ( 0.0000000 0.4827586 0.5000000), wk = 0.0033333 k( 164) = ( 0.0000000 0.5000000 0.5000000), wk = 0.0033333 k( 165) = ( 0.0000000 0.5000000 0.5000000), wk = 0.0033333 k( 166) = ( 0.0172414 0.5000000 0.5000000), wk = 0.0033333 k( 167) = ( 0.0344828 0.5000000 0.5000000), wk = 0.0033333 k( 168) = ( 0.0517241 0.5000000 0.5000000), wk = 0.0033333 k( 169) = ( 0.0689655 0.5000000 0.5000000), wk = 0.0033333 k( 170) = ( 0.0862069 0.5000000 0.5000000), wk = 0.0033333 k( 171) = ( 0.1034483 0.5000000 0.5000000), wk = 0.0033333 k( 172) = ( 0.1206897 0.5000000 0.5000000), wk = 0.0033333 k( 173) = ( 0.1379310 0.5000000 0.5000000), wk = 0.0033333 k( 174) = ( 0.1551724 0.5000000 0.5000000), wk = 0.0033333 k( 175) = ( 0.1724138 0.5000000 0.5000000), wk = 0.0033333 k( 176) = ( 0.1896552 0.5000000 0.5000000), wk = 0.0033333 k( 177) = ( 0.2068966 0.5000000 0.5000000), wk = 0.0033333 k( 178) = ( 0.2241379 0.5000000 0.5000000), wk = 0.0033333 k( 179) = ( 0.2413793 0.5000000 0.5000000), wk = 0.0033333 k( 180) = ( 0.2586207 0.5000000 0.5000000), wk = 0.0033333 k( 181) = ( 0.2758621 0.5000000 0.5000000), wk = 0.0033333 k( 182) = ( 0.2931034 0.5000000 0.5000000), wk = 0.0033333 k( 183) = ( 0.3103448 0.5000000 0.5000000), wk = 0.0033333 k( 184) = ( 0.3275862 0.5000000 0.5000000), wk = 0.0033333 k( 185) = ( 0.3448276 0.5000000 0.5000000), wk = 0.0033333 k( 186) = ( 0.3620690 0.5000000 0.5000000), wk = 0.0033333 k( 187) = ( 0.3793103 0.5000000 0.5000000), wk = 0.0033333 k( 188) = ( 0.3965517 0.5000000 0.5000000), wk = 0.0033333 k( 189) = ( 0.4137931 0.5000000 0.5000000), wk = 0.0033333 k( 190) = ( 0.4310345 0.5000000 0.5000000), wk = 0.0033333 k( 191) = ( 0.4482759 0.5000000 0.5000000), wk = 0.0033333 k( 192) = ( 0.4655172 0.5000000 0.5000000), wk = 0.0033333 k( 193) = ( 0.4827586 0.5000000 0.5000000), wk = 0.0033333 k( 194) = ( 0.5000000 0.5000000 0.5000000), wk = 0.0033333 k( 195) = ( 0.5000000 0.5000000 0.5000000), wk = 0.0033333 k( 196) = ( 0.4878049 0.4878049 0.5000000), wk = 0.0033333 k( 197) = ( 0.4756098 0.4756098 0.5000000), wk = 0.0033333 k( 198) = ( 0.4634146 0.4634146 0.5000000), wk = 0.0033333 k( 199) = ( 0.4512195 0.4512195 0.5000000), wk = 0.0033333 k( 200) = ( 0.4390244 0.4390244 0.5000000), wk = 0.0033333 k( 201) = ( 0.4268293 0.4268293 0.5000000), wk = 0.0033333 k( 202) = ( 0.4146341 0.4146341 0.5000000), wk = 0.0033333 k( 203) = ( 0.4024390 0.4024390 0.5000000), wk = 0.0033333 k( 204) = ( 0.3902439 0.3902439 0.5000000), wk = 0.0033333 k( 205) = ( 0.3780488 0.3780488 0.5000000), wk = 0.0033333 k( 206) = ( 0.3658537 0.3658537 0.5000000), wk = 0.0033333 k( 207) = ( 0.3536585 0.3536585 0.5000000), wk = 0.0033333 k( 208) = ( 0.3414634 0.3414634 0.5000000), wk = 0.0033333 k( 209) = ( 0.3292683 0.3292683 0.5000000), wk = 0.0033333 k( 210) = ( 0.3170732 0.3170732 0.5000000), wk = 0.0033333 k( 211) = ( 0.3048781 0.3048781 0.5000000), wk = 0.0033333 k( 212) = ( 0.2926829 0.2926829 0.5000000), wk = 0.0033333 k( 213) = ( 0.2804878 0.2804878 0.5000000), wk = 0.0033333 k( 214) = ( 0.2682927 0.2682927 0.5000000), wk = 0.0033333 k( 215) = ( 0.2560976 0.2560976 0.5000000), wk = 0.0033333 k( 216) = ( 0.2439024 0.2439024 0.5000000), wk = 0.0033333 k( 217) = ( 0.2317073 0.2317073 0.5000000), wk = 0.0033333 k( 218) = ( 0.2195122 0.2195122 0.5000000), wk = 0.0033333 k( 219) = ( 0.2073171 0.2073171 0.5000000), wk = 0.0033333 k( 220) = ( 0.1951219 0.1951219 0.5000000), wk = 0.0033333 k( 221) = ( 0.1829268 0.1829268 0.5000000), wk = 0.0033333 k( 222) = ( 0.1707317 0.1707317 0.5000000), wk = 0.0033333 k( 223) = ( 0.1585366 0.1585366 0.5000000), wk = 0.0033333 k( 224) = ( 0.1463415 0.1463415 0.5000000), wk = 0.0033333 k( 225) = ( 0.1341463 0.1341463 0.5000000), wk = 0.0033333 k( 226) = ( 0.1219512 0.1219512 0.5000000), wk = 0.0033333 k( 227) = ( 0.1097561 0.1097561 0.5000000), wk = 0.0033333 k( 228) = ( 0.0975610 0.0975610 0.5000000), wk = 0.0033333 k( 229) = ( 0.0853658 0.0853658 0.5000000), wk = 0.0033333 k( 230) = ( 0.0731707 0.0731707 0.5000000), wk = 0.0033333 k( 231) = ( 0.0609756 0.0609756 0.5000000), wk = 0.0033333 k( 232) = ( 0.0487805 0.0487805 0.5000000), wk = 0.0033333 k( 233) = ( 0.0365854 0.0365854 0.5000000), wk = 0.0033333 k( 234) = ( 0.0243902 0.0243902 0.5000000), wk = 0.0033333 k( 235) = ( 0.0121951 0.0121951 0.5000000), wk = 0.0033333 k( 236) = ( 0.0000000 0.0000000 0.5000000), wk = 0.0033333 k( 237) = ( 0.0000000 0.5000000 -0.0000000), wk = 0.0033333 k( 238) = ( 0.0000000 0.5000000 0.0161290), wk = 0.0033333 k( 239) = ( 0.0000000 0.5000000 0.0322581), wk = 0.0033333 k( 240) = ( 0.0000000 0.5000000 0.0483871), wk = 0.0033333 k( 241) = ( 0.0000000 0.5000000 0.0645161), wk = 0.0033333 k( 242) = ( 0.0000000 0.5000000 0.0806452), wk = 0.0033333 k( 243) = ( 0.0000000 0.5000000 0.0967742), wk = 0.0033333 k( 244) = ( 0.0000000 0.5000000 0.1129032), wk = 0.0033333 k( 245) = ( 0.0000000 0.5000000 0.1290323), wk = 0.0033333 k( 246) = ( 0.0000000 0.5000000 0.1451613), wk = 0.0033333 k( 247) = ( 0.0000000 0.5000000 0.1612903), wk = 0.0033333 k( 248) = ( 0.0000000 0.5000000 0.1774194), wk = 0.0033333 k( 249) = ( 0.0000000 0.5000000 0.1935484), wk = 0.0033333 k( 250) = ( 0.0000000 0.5000000 0.2096774), wk = 0.0033333 k( 251) = ( 0.0000000 0.5000000 0.2258064), wk = 0.0033333 k( 252) = ( 0.0000000 0.5000000 0.2419355), wk = 0.0033333 k( 253) = ( 0.0000000 0.5000000 0.2580645), wk = 0.0033333 k( 254) = ( 0.0000000 0.5000000 0.2741935), wk = 0.0033333 k( 255) = ( 0.0000000 0.5000000 0.2903226), wk = 0.0033333 k( 256) = ( 0.0000000 0.5000000 0.3064516), wk = 0.0033333 k( 257) = ( 0.0000000 0.5000000 0.3225807), wk = 0.0033333 k( 258) = ( 0.0000000 0.5000000 0.3387097), wk = 0.0033333 k( 259) = ( 0.0000000 0.5000000 0.3548387), wk = 0.0033333 k( 260) = ( 0.0000000 0.5000000 0.3709677), wk = 0.0033333 k( 261) = ( 0.0000000 0.5000000 0.3870968), wk = 0.0033333 k( 262) = ( 0.0000000 0.5000000 0.4032258), wk = 0.0033333 k( 263) = ( 0.0000000 0.5000000 0.4193548), wk = 0.0033333 k( 264) = ( 0.0000000 0.5000000 0.4354839), wk = 0.0033333 k( 265) = ( 0.0000000 0.5000000 0.4516129), wk = 0.0033333 k( 266) = ( 0.0000000 0.5000000 0.4677419), wk = 0.0033333 k( 267) = ( 0.0000000 0.5000000 0.4838710), wk = 0.0033333 k( 268) = ( 0.0000000 0.5000000 0.5000000), wk = 0.0033333 k( 269) = ( 0.5000000 0.5000000 -0.0000000), wk = 0.0033333 k( 270) = ( 0.5000000 0.5000000 0.0161290), wk = 0.0033333 k( 271) = ( 0.5000000 0.5000000 0.0322581), wk = 0.0033333 k( 272) = ( 0.5000000 0.5000000 0.0483871), wk = 0.0033333 k( 273) = ( 0.5000000 0.5000000 0.0645161), wk = 0.0033333 k( 274) = ( 0.5000000 0.5000000 0.0806452), wk = 0.0033333 k( 275) = ( 0.5000000 0.5000000 0.0967742), wk = 0.0033333 k( 276) = ( 0.5000000 0.5000000 0.1129032), wk = 0.0033333 k( 277) = ( 0.5000000 0.5000000 0.1290323), wk = 0.0033333 k( 278) = ( 0.5000000 0.5000000 0.1451613), wk = 0.0033333 k( 279) = ( 0.5000000 0.5000000 0.1612903), wk = 0.0033333 k( 280) = ( 0.5000000 0.5000000 0.1774194), wk = 0.0033333 k( 281) = ( 0.5000000 0.5000000 0.1935484), wk = 0.0033333 k( 282) = ( 0.5000000 0.5000000 0.2096774), wk = 0.0033333 k( 283) = ( 0.5000000 0.5000000 0.2258064), wk = 0.0033333 k( 284) = ( 0.5000000 0.5000000 0.2419355), wk = 0.0033333 k( 285) = ( 0.5000000 0.5000000 0.2580645), wk = 0.0033333 k( 286) = ( 0.5000000 0.5000000 0.2741936), wk = 0.0033333 k( 287) = ( 0.5000000 0.5000000 0.2903226), wk = 0.0033333 k( 288) = ( 0.5000000 0.5000000 0.3064516), wk = 0.0033333 k( 289) = ( 0.5000000 0.5000000 0.3225806), wk = 0.0033333 k( 290) = ( 0.5000000 0.5000000 0.3387097), wk = 0.0033333 k( 291) = ( 0.5000000 0.5000000 0.3548387), wk = 0.0033333 k( 292) = ( 0.5000000 0.5000000 0.3709677), wk = 0.0033333 k( 293) = ( 0.5000000 0.5000000 0.3870968), wk = 0.0033333 k( 294) = ( 0.5000000 0.5000000 0.4032258), wk = 0.0033333 k( 295) = ( 0.5000000 0.5000000 0.4193548), wk = 0.0033333 k( 296) = ( 0.5000000 0.5000000 0.4354839), wk = 0.0033333 k( 297) = ( 0.5000000 0.5000000 0.4516129), wk = 0.0033333 k( 298) = ( 0.5000000 0.5000000 0.4677419), wk = 0.0033333 k( 299) = ( 0.5000000 0.5000000 0.4838710), wk = 0.0033333 k( 300) = ( 0.5000000 0.5000000 0.5000000), wk = 0.0033333 Dense grid: 100429 G-vectors FFT dimensions: ( 60, 60, 60) Largest allocated arrays est. size (Mb) dimensions Kohn-Sham Wavefunctions 0.48 Mb ( 356, 88) NL pseudopotentials 0.72 Mb ( 178, 266) Each V/rho on FFT grid 0.05 Mb ( 3600) Each G-vector array 0.01 Mb ( 1396) G-vector shells 0.01 Mb ( 697) Largest temporary arrays est. size (Mb) dimensions Auxiliary wavefunctions 1.91 Mb ( 356, 352) Each subspace H/S matrix 0.05 Mb ( 58, 58) Each matrix 0.71 Mb ( 266, 2, 88) The potential is recalculated from file : ./Cu2WS4.save/charge-density.dat Starting wfc are 68 randomized atomic wfcs + 20 random wfc Band Structure Calculation Davidson diagonalization with overlap Computing kpt #: 1 total cpu time spent up to now is 5.0 secs Computing kpt #: 2 total cpu time spent up to now is 7.2 secs Computing kpt #: 3 total cpu time spent up to now is 9.4 secs Computing kpt #: 4 total cpu time spent up to now is 11.6 secs Computing kpt #: 5 total cpu time spent up to now is 13.9 secs Computing kpt #: 6 total cpu time spent up to now is 16.4 secs Computing kpt #: 7 total cpu time spent up to now is 19.3 secs Computing kpt #: 8 total cpu time spent up to now is 22.1 secs Computing kpt #: 9 total cpu time spent up to now is 25.5 secs Computing kpt #: 10 total cpu time spent up to now is 28.4 secs Computing kpt #: 11 total cpu time spent up to now is 30.6 secs Computing kpt #: 12 total cpu time spent up to now is 32.9 secs Computing kpt #: 13 total cpu time spent up to now is 35.0 secs Computing kpt #: 14 total cpu time spent up to now is 37.1 secs Computing kpt #: 15 total cpu time spent up to now is 39.2 secs Computing kpt #: 16 total cpu time spent up to now is 41.3 secs Computing kpt #: 17 total cpu time spent up to now is 43.2 secs Computing kpt #: 18 total cpu time spent up to now is 45.1 secs Computing kpt #: 19 total cpu time spent up to now is 46.9 secs Computing kpt #: 20 total cpu time spent up to now is 48.8 secs Computing kpt #: 21 total cpu time spent up to now is 50.6 secs Computing kpt #: 22 total cpu time spent up to now is 52.4 secs Computing kpt #: 23 total cpu time spent up to now is 54.2 secs Computing kpt #: 24 total cpu time spent up to now is 56.0 secs Computing kpt #: 25 total cpu time spent up to now is 57.8 secs Computing kpt #: 26 total cpu time spent up to now is 59.6 secs Computing kpt #: 27 total cpu time spent up to now is 61.5 secs Computing kpt #: 28 total cpu time spent up to now is 63.3 secs Computing kpt #: 29 total cpu time spent up to now is 65.1 secs Computing kpt #: 30 total cpu time spent up to now is 67.0 secs Computing kpt #: 31 total cpu time spent up to now is 68.8 secs Computing kpt #: 32 total cpu time spent up to now is 70.6 secs Computing kpt #: 33 total cpu time spent up to now is 72.5 secs Computing kpt #: 34 total cpu time spent up to now is 74.3 secs Computing kpt #: 35 total cpu time spent up to now is 76.1 secs Computing kpt #: 36 total cpu time spent up to now is 77.9 secs Computing kpt #: 37 total cpu time spent up to now is 79.8 secs Computing kpt #: 38 total cpu time spent up to now is 81.8 secs Computing kpt #: 39 total cpu time spent up to now is 84.1 secs Computing kpt #: 40 total cpu time spent up to now is 86.0 secs Computing kpt #: 41 total cpu time spent up to now is 87.8 secs Computing kpt #: 42 total cpu time spent up to now is 89.6 secs Computing kpt #: 43 total cpu time spent up to now is 91.5 secs Computing kpt #: 44 total cpu time spent up to now is 93.3 secs Computing kpt #: 45 total cpu time spent up to now is 95.1 secs Computing kpt #: 46 total cpu time spent up to now is 96.9 secs Computing kpt #: 47 total cpu time spent up to now is 98.7 secs Computing kpt #: 48 total cpu time spent up to now is 100.5 secs Computing kpt #: 49 total cpu time spent up to now is 102.3 secs Computing kpt #: 50 total cpu time spent up to now is 104.1 secs Computing kpt #: 51 total cpu time spent up to now is 105.9 secs Computing kpt #: 52 total cpu time spent up to now is 107.6 secs Computing kpt #: 53 total cpu time spent up to now is 109.4 secs Computing kpt #: 54 total cpu time spent up to now is 111.2 secs Computing kpt #: 55 total cpu time spent up to now is 113.0 secs Computing kpt #: 56 total cpu time spent up to now is 114.7 secs Computing kpt #: 57 total cpu time spent up to now is 116.5 secs Computing kpt #: 58 total cpu time spent up to now is 118.2 secs Computing kpt #: 59 total cpu time spent up to now is 119.9 secs Computing kpt #: 60 total cpu time spent up to now is 121.4 secs Computing kpt #: 61 total cpu time spent up to now is 123.0 secs Computing kpt #: 62 total cpu time spent up to now is 124.7 secs Computing kpt #: 63 total cpu time spent up to now is 126.4 secs Computing kpt #: 64 total cpu time spent up to now is 128.2 secs Computing kpt #: 65 total cpu time spent up to now is 129.9 secs Computing kpt #: 66 total cpu time spent up to now is 131.7 secs Computing kpt #: 67 total cpu time spent up to now is 133.5 secs Computing kpt #: 68 total cpu time spent up to now is 135.3 secs Computing kpt #: 69 total cpu time spent up to now is 137.0 secs Computing kpt #: 70 total cpu time spent up to now is 138.8 secs Computing kpt #: 71 total cpu time spent up to now is 140.6 secs Computing kpt #: 72 total cpu time spent up to now is 142.4 secs Computing kpt #: 73 total cpu time spent up to now is 144.2 secs Computing kpt #: 74 total cpu time spent up to now is 146.2 secs Computing kpt #: 75 total cpu time spent up to now is 148.3 secs Computing kpt #: 76 total cpu time spent up to now is 150.5 secs Computing kpt #: 77 total cpu time spent up to now is 152.7 secs Computing kpt #: 78 total cpu time spent up to now is 155.4 secs Computing kpt #: 79 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 160.3 secs Computing kpt #: 80 total cpu time spent up to now is 165.1 secs Computing kpt #: 81 total cpu time spent up to now is 168.4 secs Computing kpt #: 82 total cpu time spent up to now is 171.8 secs Computing kpt #: 83 total cpu time spent up to now is 175.3 secs Computing kpt #: 84 total cpu time spent up to now is 179.5 secs Computing kpt #: 85 total cpu time spent up to now is 183.5 secs Computing kpt #: 86 total cpu time spent up to now is 187.1 secs Computing kpt #: 87 total cpu time spent up to now is 190.7 secs Computing kpt #: 88 total cpu time spent up to now is 195.5 secs Computing kpt #: 89 total cpu time spent up to now is 200.2 secs Computing kpt #: 90 total cpu time spent up to now is 204.3 secs Computing kpt #: 91 total cpu time spent up to now is 208.2 secs Computing kpt #: 92 total cpu time spent up to now is 211.8 secs Computing kpt #: 93 total cpu time spent up to now is 214.6 secs Computing kpt #: 94 total cpu time spent up to now is 217.4 secs Computing kpt #: 95 total cpu time spent up to now is 220.2 secs Computing kpt #: 96 total cpu time spent up to now is 223.0 secs Computing kpt #: 97 total cpu time spent up to now is 225.3 secs Computing kpt #: 98 total cpu time spent up to now is 228.1 secs Computing kpt #: 99 total cpu time spent up to now is 230.3 secs Computing kpt #: 100 total cpu time spent up to now is 232.6 secs Computing kpt #: 101 total cpu time spent up to now is 234.8 secs Computing kpt #: 102 total cpu time spent up to now is 237.0 secs Computing kpt #: 103 total cpu time spent up to now is 239.3 secs Computing kpt #: 104 total cpu time spent up to now is 241.5 secs Computing kpt #: 105 total cpu time spent up to now is 243.7 secs Computing kpt #: 106 total cpu time spent up to now is 246.0 secs Computing kpt #: 107 total cpu time spent up to now is 248.2 secs Computing kpt #: 108 total cpu time spent up to now is 250.4 secs Computing kpt #: 109 total cpu time spent up to now is 252.7 secs Computing kpt #: 110 total cpu time spent up to now is 254.9 secs Computing kpt #: 111 total cpu time spent up to now is 257.1 secs Computing kpt #: 112 total cpu time spent up to now is 259.3 secs Computing kpt #: 113 total cpu time spent up to now is 261.6 secs Computing kpt #: 114 total cpu time spent up to now is 263.8 secs Computing kpt #: 115 total cpu time spent up to now is 266.0 secs Computing kpt #: 116 total cpu time spent up to now is 268.3 secs Computing kpt #: 117 total cpu time spent up to now is 270.5 secs Computing kpt #: 118 total cpu time spent up to now is 272.7 secs Computing kpt #: 119 total cpu time spent up to now is 274.9 secs Computing kpt #: 120 total cpu time spent up to now is 277.2 secs Computing kpt #: 121 total cpu time spent up to now is 279.5 secs Computing kpt #: 122 total cpu time spent up to now is 281.8 secs Computing kpt #: 123 total cpu time spent up to now is 284.0 secs Computing kpt #: 124 total cpu time spent up to now is 286.2 secs Computing kpt #: 125 total cpu time spent up to now is 288.4 secs Computing kpt #: 126 total cpu time spent up to now is 290.5 secs Computing kpt #: 127 total cpu time spent up to now is 292.6 secs Computing kpt #: 128 total cpu time spent up to now is 294.5 secs Computing kpt #: 129 total cpu time spent up to now is 296.4 secs Computing kpt #: 130 total cpu time spent up to now is 298.3 secs Computing kpt #: 131 total cpu time spent up to now is 300.1 secs Computing kpt #: 132 total cpu time spent up to now is 302.0 secs Computing kpt #: 133 total cpu time spent up to now is 303.9 secs Computing kpt #: 134 total cpu time spent up to now is 305.7 secs Computing kpt #: 135 total cpu time spent up to now is 307.5 secs Computing kpt #: 136 total cpu time spent up to now is 309.4 secs Computing kpt #: 137 total cpu time spent up to now is 311.2 secs Computing kpt #: 138 total cpu time spent up to now is 313.1 secs Computing kpt #: 139 total cpu time spent up to now is 314.9 secs Computing kpt #: 140 total cpu time spent up to now is 316.8 secs Computing kpt #: 141 total cpu time spent up to now is 318.7 secs Computing kpt #: 142 total cpu time spent up to now is 320.5 secs Computing kpt #: 143 total cpu time spent up to now is 322.3 secs Computing kpt #: 144 total cpu time spent up to now is 324.2 secs Computing kpt #: 145 total cpu time spent up to now is 326.0 secs Computing kpt #: 146 total cpu time spent up to now is 328.2 secs Computing kpt #: 147 total cpu time spent up to now is 330.2 secs Computing kpt #: 148 total cpu time spent up to now is 332.4 secs Computing kpt #: 149 total cpu time spent up to now is 334.7 secs Computing kpt #: 150 total cpu time spent up to now is 337.4 secs Computing kpt #: 151 total cpu time spent up to now is 340.8 secs Computing kpt #: 152 total cpu time spent up to now is 343.6 secs Computing kpt #: 153 total cpu time spent up to now is 345.7 secs Computing kpt #: 154 total cpu time spent up to now is 347.8 secs Computing kpt #: 155 total cpu time spent up to now is 349.8 secs Computing kpt #: 156 total cpu time spent up to now is 351.7 secs Computing kpt #: 157 total cpu time spent up to now is 353.5 secs Computing kpt #: 158 total cpu time spent up to now is 355.3 secs Computing kpt #: 159 total cpu time spent up to now is 357.1 secs Computing kpt #: 160 total cpu time spent up to now is 358.9 secs Computing kpt #: 161 total cpu time spent up to now is 360.7 secs Computing kpt #: 162 total cpu time spent up to now is 362.5 secs Computing kpt #: 163 total cpu time spent up to now is 364.3 secs Computing kpt #: 164 total cpu time spent up to now is 366.0 secs Computing kpt #: 165 total cpu time spent up to now is 367.8 secs Computing kpt #: 166 total cpu time spent up to now is 369.6 secs Computing kpt #: 167 total cpu time spent up to now is 371.4 secs Computing kpt #: 168 total cpu time spent up to now is 373.1 secs Computing kpt #: 169 total cpu time spent up to now is 374.9 secs Computing kpt #: 170 total cpu time spent up to now is 376.7 secs Computing kpt #: 171 total cpu time spent up to now is 378.5 secs Computing kpt #: 172 total cpu time spent up to now is 380.3 secs Computing kpt #: 173 total cpu time spent up to now is 382.7 secs Computing kpt #: 174 total cpu time spent up to now is 384.8 secs Computing kpt #: 175 total cpu time spent up to now is 386.6 secs Computing kpt #: 176 total cpu time spent up to now is 388.4 secs Computing kpt #: 177 total cpu time spent up to now is 390.2 secs Computing kpt #: 178 total cpu time spent up to now is 392.1 secs Computing kpt #: 179 total cpu time spent up to now is 393.9 secs Computing kpt #: 180 total cpu time spent up to now is 395.6 secs Computing kpt #: 181 total cpu time spent up to now is 397.4 secs Computing kpt #: 182 total cpu time spent up to now is 399.2 secs Computing kpt #: 183 total cpu time spent up to now is 400.9 secs Computing kpt #: 184 total cpu time spent up to now is 402.7 secs Computing kpt #: 185 total cpu time spent up to now is 404.5 secs Computing kpt #: 186 total cpu time spent up to now is 406.2 secs Computing kpt #: 187 total cpu time spent up to now is 408.0 secs Computing kpt #: 188 total cpu time spent up to now is 409.7 secs Computing kpt #: 189 total cpu time spent up to now is 411.5 secs Computing kpt #: 190 total cpu time spent up to now is 413.2 secs Computing kpt #: 191 total cpu time spent up to now is 415.0 secs Computing kpt #: 192 total cpu time spent up to now is 416.7 secs Computing kpt #: 193 total cpu time spent up to now is 418.3 secs Computing kpt #: 194 total cpu time spent up to now is 420.0 secs Computing kpt #: 195 total cpu time spent up to now is 421.7 secs Computing kpt #: 196 total cpu time spent up to now is 423.4 secs Computing kpt #: 197 total cpu time spent up to now is 425.1 secs Computing kpt #: 198 total cpu time spent up to now is 426.9 secs Computing kpt #: 199 total cpu time spent up to now is 428.6 secs Computing kpt #: 200 total cpu time spent up to now is 430.4 secs Computing kpt #: 201 total cpu time spent up to now is 432.3 secs Computing kpt #: 202 total cpu time spent up to now is 434.0 secs Computing kpt #: 203 total cpu time spent up to now is 435.8 secs Computing kpt #: 204 total cpu time spent up to now is 437.6 secs Computing kpt #: 205 total cpu time spent up to now is 439.4 secs Computing kpt #: 206 total cpu time spent up to now is 441.2 secs Computing kpt #: 207 total cpu time spent up to now is 443.0 secs Computing kpt #: 208 total cpu time spent up to now is 444.7 secs Computing kpt #: 209 total cpu time spent up to now is 446.5 secs Computing kpt #: 210 total cpu time spent up to now is 448.3 secs Computing kpt #: 211 total cpu time spent up to now is 450.1 secs Computing kpt #: 212 total cpu time spent up to now is 452.0 secs Computing kpt #: 213 total cpu time spent up to now is 453.8 secs Computing kpt #: 214 total cpu time spent up to now is 455.8 secs Computing kpt #: 215 total cpu time spent up to now is 458.0 secs Computing kpt #: 216 total cpu time spent up to now is 460.3 secs Computing kpt #: 217 total cpu time spent up to now is 462.6 secs Computing kpt #: 218 total cpu time spent up to now is 464.9 secs Computing kpt #: 219 total cpu time spent up to now is 467.0 secs Computing kpt #: 220 total cpu time spent up to now is 469.0 secs Computing kpt #: 221 total cpu time spent up to now is 471.1 secs Computing kpt #: 222 total cpu time spent up to now is 473.2 secs Computing kpt #: 223 total cpu time spent up to now is 475.3 secs Computing kpt #: 224 total cpu time spent up to now is 477.2 secs Computing kpt #: 225 total cpu time spent up to now is 479.1 secs Computing kpt #: 226 total cpu time spent up to now is 480.9 secs Computing kpt #: 227 total cpu time spent up to now is 482.8 secs Computing kpt #: 228 total cpu time spent up to now is 484.7 secs Computing kpt #: 229 total cpu time spent up to now is 486.5 secs Computing kpt #: 230 total cpu time spent up to now is 488.4 secs Computing kpt #: 231 total cpu time spent up to now is 490.3 secs Computing kpt #: 232 total cpu time spent up to now is 492.2 secs Computing kpt #: 233 total cpu time spent up to now is 494.0 secs Computing kpt #: 234 total cpu time spent up to now is 495.9 secs Computing kpt #: 235 total cpu time spent up to now is 497.7 secs Computing kpt #: 236 total cpu time spent up to now is 499.6 secs Computing kpt #: 237 total cpu time spent up to now is 501.4 secs Computing kpt #: 238 total cpu time spent up to now is 503.3 secs Computing kpt #: 239 total cpu time spent up to now is 505.2 secs Computing kpt #: 240 total cpu time spent up to now is 507.0 secs Computing kpt #: 241 total cpu time spent up to now is 508.9 secs Computing kpt #: 242 total cpu time spent up to now is 510.7 secs Computing kpt #: 243 total cpu time spent up to now is 512.6 secs Computing kpt #: 244 total cpu time spent up to now is 514.4 secs Computing kpt #: 245 total cpu time spent up to now is 516.2 secs Computing kpt #: 246 total cpu time spent up to now is 518.0 secs Computing kpt #: 247 total cpu time spent up to now is 519.9 secs Computing kpt #: 248 total cpu time spent up to now is 521.7 secs Computing kpt #: 249 total cpu time spent up to now is 523.5 secs Computing kpt #: 250 total cpu time spent up to now is 525.3 secs Computing kpt #: 251 total cpu time spent up to now is 527.2 secs Computing kpt #: 252 total cpu time spent up to now is 529.0 secs Computing kpt #: 253 total cpu time spent up to now is 530.7 secs Computing kpt #: 254 total cpu time spent up to now is 532.6 secs Computing kpt #: 255 total cpu time spent up to now is 534.3 secs Computing kpt #: 256 total cpu time spent up to now is 536.1 secs Computing kpt #: 257 total cpu time spent up to now is 537.9 secs Computing kpt #: 258 total cpu time spent up to now is 539.7 secs Computing kpt #: 259 total cpu time spent up to now is 541.5 secs Computing kpt #: 260 total cpu time spent up to now is 543.2 secs Computing kpt #: 261 total cpu time spent up to now is 545.1 secs Computing kpt #: 262 total cpu time spent up to now is 546.8 secs Computing kpt #: 263 total cpu time spent up to now is 548.6 secs Computing kpt #: 264 total cpu time spent up to now is 550.4 secs Computing kpt #: 265 total cpu time spent up to now is 552.2 secs Computing kpt #: 266 total cpu time spent up to now is 553.9 secs Computing kpt #: 267 total cpu time spent up to now is 555.7 secs Computing kpt #: 268 total cpu time spent up to now is 557.5 secs Computing kpt #: 269 total cpu time spent up to now is 559.1 secs Computing kpt #: 270 total cpu time spent up to now is 560.7 secs Computing kpt #: 271 total cpu time spent up to now is 562.4 secs Computing kpt #: 272 total cpu time spent up to now is 564.0 secs Computing kpt #: 273 total cpu time spent up to now is 565.6 secs Computing kpt #: 274 total cpu time spent up to now is 567.2 secs Computing kpt #: 275 total cpu time spent up to now is 568.8 secs Computing kpt #: 276 total cpu time spent up to now is 570.5 secs Computing kpt #: 277 total cpu time spent up to now is 572.2 secs Computing kpt #: 278 total cpu time spent up to now is 573.8 secs Computing kpt #: 279 total cpu time spent up to now is 575.5 secs Computing kpt #: 280 total cpu time spent up to now is 577.2 secs Computing kpt #: 281 total cpu time spent up to now is 578.8 secs Computing kpt #: 282 total cpu time spent up to now is 580.5 secs Computing kpt #: 283 total cpu time spent up to now is 582.2 secs Computing kpt #: 284 total cpu time spent up to now is 583.9 secs Computing kpt #: 285 total cpu time spent up to now is 585.5 secs Computing kpt #: 286 total cpu time spent up to now is 587.2 secs Computing kpt #: 287 total cpu time spent up to now is 588.9 secs Computing kpt #: 288 total cpu time spent up to now is 590.6 secs Computing kpt #: 289 total cpu time spent up to now is 592.3 secs Computing kpt #: 290 total cpu time spent up to now is 594.0 secs Computing kpt #: 291 total cpu time spent up to now is 595.7 secs Computing kpt #: 292 total cpu time spent up to now is 597.4 secs Computing kpt #: 293 total cpu time spent up to now is 599.1 secs Computing kpt #: 294 total cpu time spent up to now is 600.8 secs Computing kpt #: 295 total cpu time spent up to now is 602.5 secs Computing kpt #: 296 total cpu time spent up to now is 604.2 secs Computing kpt #: 297 total cpu time spent up to now is 605.9 secs Computing kpt #: 298 total cpu time spent up to now is 607.6 secs Computing kpt #: 299 total cpu time spent up to now is 609.3 secs Computing kpt #: 300 total cpu time spent up to now is 611.0 secs ethr = 1.35E-08, avg # of iterations = 23.1 total cpu time spent up to now is 611.0 secs End of band structure calculation k = 0.0000 0.0000 0.0000 ( 12589 PWs) bands (ev): -67.2293 -67.2293 -38.6588 -38.6588 -28.9325 -28.9325 -28.8727 -28.8727 -22.7378 -22.7378 -22.6928 -22.6928 -22.6862 -22.6862 -20.5083 -20.5083 -20.4673 -20.4673 -20.4505 -20.4505 -20.4492 -20.4492 -6.1261 -6.1261 -4.9769 -4.9769 -4.8899 -4.8899 -4.8652 -4.8652 1.4060 1.4060 1.8524 1.8524 2.7904 2.7904 3.2412 3.2412 3.2521 3.2521 3.3438 3.3438 3.9058 3.9058 4.1621 4.1621 4.1895 4.1895 4.2402 4.2402 4.7579 4.7579 4.8276 4.8276 5.1051 5.1051 5.1103 5.1103 5.1776 5.1776 5.3054 5.3054 5.5646 5.5646 5.6267 5.6267 5.8582 5.8582 6.4713 6.4713 6.5238 6.5238 6.9341 6.9341 8.5415 8.5415 8.5812 8.5812 8.8411 8.8411 9.3532 9.3532 9.3995 9.3995 10.2426 10.2426 12.9368 12.9368 k = 0.0000 0.0172-0.0000 ( 12585 PWs) bands (ev): -67.2293 -67.2293 -38.6588 -38.6588 -28.9325 -28.9325 -28.8727 -28.8727 -22.7378 -22.7378 -22.6928 -22.6928 -22.6862 -22.6862 -20.5083 -20.5083 -20.4673 -20.4673 -20.4505 -20.4505 -20.4492 -20.4492 -6.1254 -6.1254 -4.9780 -4.9766 -4.8905 -4.8903 -4.8660 -4.8646 1.4066 1.4080 1.8532 1.8539 2.7881 2.7934 3.2400 3.2428 3.2513 3.2526 3.3423 3.3451 3.9043 3.9066 4.1487 4.1678 4.1841 4.1992 4.2419 4.2425 4.7507 4.7620 4.8227 4.8300 5.0909 5.1053 5.1129 5.1203 5.1773 5.1779 5.3025 5.3079 5.5575 5.5699 5.6195 5.6315 5.8553 5.8643 6.4686 6.4703 6.5205 6.5239 6.9327 6.9351 8.5408 8.5431 8.5806 8.5828 8.8416 8.8430 9.3526 9.3526 9.3943 9.4032 10.2472 10.2510 12.9381 12.9410 k = 0.0000 0.0345-0.0000 ( 12591 PWs) bands (ev): -67.2293 -67.2293 -38.6588 -38.6588 -28.9325 -28.9325 -28.8727 -28.8727 -22.7378 -22.7378 -22.6928 -22.6928 -22.6862 -22.6862 -20.5083 -20.5083 -20.4673 -20.4673 -20.4505 -20.4505 -20.4492 -20.4492 -6.1233 -6.1232 -4.9798 -4.9770 -4.8918 -4.8918 -4.8670 -4.8642 1.4099 1.4127 1.8564 1.8578 2.7865 2.7971 3.2394 3.2435 3.2513 3.2525 3.3408 3.3463 3.9021 3.9065 4.1335 4.1571 4.1921 4.2067 4.2469 4.2494 4.7405 4.7630 4.8155 4.8293 5.0739 5.1021 5.1178 5.1310 5.1769 5.1781 5.2993 5.3097 5.5488 5.5730 5.6110 5.6341 5.8558 5.8728 6.4626 6.4655 6.5140 6.5211 6.9311 6.9358 8.5404 8.5455 8.5810 8.5859 8.8447 8.8474 9.3500 9.3506 9.3887 9.4055 10.2648 10.2721 12.9447 12.9507 k = 0.0000 0.0517-0.0000 ( 12575 PWs) bands (ev): -67.2293 -67.2293 -38.6588 -38.6588 -28.9325 -28.9325 -28.8727 -28.8727 -22.7378 -22.7378 -22.6928 -22.6928 -22.6862 -22.6862 -20.5083 -20.5083 -20.4673 -20.4673 -20.4505 -20.4505 -20.4492 -20.4492 -6.1196 -6.1196 -4.9823 -4.9783 -4.8943 -4.8937 -4.8684 -4.8637 1.4159 1.4201 1.8619 1.8639 2.7856 2.8014 3.2388 3.2413 3.2521 3.2541 3.3394 3.3479 3.8990 3.9058 4.1172 4.1421 4.2019 4.2117 4.2547 4.2601 4.7273 4.7608 4.8064 4.8253 5.0552 5.1005 5.1215 5.1400 5.1767 5.1785 5.2958 5.3109 5.5380 5.5725 5.6026 5.6356 5.8595 5.8825 6.4534 6.4568 6.5045 6.5159 6.9292 6.9361 8.5398 8.5482 8.5824 8.5907 8.8506 8.8543 9.3442 9.3467 9.3850 9.4074 10.2947 10.3049 12.9561 12.9659 k = 0.0000 0.0690-0.0000 ( 12567 PWs) bands (ev): -67.2293 -67.2293 -38.6588 -38.6588 -28.9325 -28.9325 -28.8727 -28.8727 -22.7378 -22.7378 -22.6928 -22.6928 -22.6862 -22.6862 -20.5083 -20.5083 -20.4673 -20.4673 -20.4505 -20.4505 -20.4492 -20.4492 -6.1146 -6.1145 -4.9857 -4.9807 -4.8977 -4.8962 -4.8699 -4.8633 1.4244 1.4301 1.8698 1.8724 2.7851 2.8064 3.2366 3.2374 3.2522 3.2590 3.3385 3.3500 3.8953 3.9044 4.0998 4.1255 4.2109 4.2155 4.2647 4.2734 4.7116 4.7556 4.7956 4.8178 5.0353 5.1006 5.1227 5.1473 5.1771 5.1790 5.2924 5.3114 5.5245 5.5671 5.5959 5.6379 5.8654 5.8924 6.4414 6.4443 6.4926 6.5087 6.9270 6.9359 8.5382 8.5501 8.5858 8.5975 8.8594 8.8635 9.3349 9.3404 9.3848 9.4101 10.3358 10.3480 12.9715 12.9863 k = 0.0000 0.0862-0.0000 ( 12567 PWs) bands (ev): -67.2293 -67.2293 -38.6588 -38.6588 -28.9326 -28.9326 -28.8727 -28.8727 -22.7378 -22.7378 -22.6928 -22.6928 -22.6862 -22.6862 -20.5083 -20.5083 -20.4673 -20.4673 -20.4505 -20.4505 -20.4492 -20.4492 -6.1081 -6.1080 -4.9900 -4.9844 -4.9019 -4.8989 -4.8716 -4.8629 1.4355 1.4426 1.8800 1.8832 2.7851 2.8118 3.2299 3.2338 3.2538 3.2654 3.3385 3.3531 3.8909 3.9023 4.0815 4.1077 4.2190 4.2190 4.2763 4.2880 4.6936 4.7475 4.7834 4.8065 5.0146 5.1023 5.1203 5.1531 5.1788 5.1796 5.2893 5.3111 5.5087 5.5567 5.5911 5.6417 5.8723 5.9015 6.4268 6.4283 6.4791 6.5003 6.9246 6.9351 8.5351 8.5494 8.5921 8.6062 8.8712 8.8752 9.3236 9.3323 9.3877 9.4144 10.3867 10.4002 12.9887 13.0117 k = 0.0000 0.1034-0.0000 ( 12567 PWs) bands (ev): -67.2293 -67.2293 -38.6588 -38.6588 -28.9326 -28.9326 -28.8728 -28.8728 -22.7378 -22.7378 -22.6928 -22.6928 -22.6862 -22.6862 -20.5083 -20.5083 -20.4673 -20.4673 -20.4505 -20.4505 -20.4492 -20.4492 -6.1002 -6.1001 -4.9956 -4.9897 -4.9067 -4.9017 -4.8733 -4.8624 1.4491 1.4577 1.8927 1.8964 2.7852 2.8176 3.2214 3.2279 3.2571 3.2728 3.3396 3.3574 3.8858 3.8996 4.0620 4.0886 4.2226 4.2268 4.2884 4.3033 4.6738 4.7364 4.7698 4.7917 4.9939 5.1057 5.1138 5.1576 5.1803 5.1819 5.2867 5.3099 5.4912 5.5422 5.5883 5.6470 5.8789 5.9088 6.4091 6.4096 6.4652 6.4914 6.9219 6.9338 8.5300 8.5452 8.6017 8.6166 8.8860 8.8893 9.3121 9.3231 9.3928 9.4202 10.4462 10.4603 13.0033 13.0412 k = 0.0000 0.1207-0.0000 ( 12559 PWs) bands (ev): -67.2293 -67.2293 -38.6588 -38.6588 -28.9326 -28.9326 -28.8728 -28.8728 -22.7378 -22.7378 -22.6928 -22.6928 -22.6862 -22.6862 -20.5083 -20.5083 -20.4673 -20.4673 -20.4505 -20.4505 -20.4492 -20.4492 -6.0910 -6.0908 -5.0026 -4.9969 -4.9117 -4.9043 -4.8751 -4.8620 1.4650 1.4752 1.9077 1.9119 2.7854 2.8234 3.2115 3.2202 3.2618 3.2814 3.3420 3.3631 3.8802 3.8963 4.0411 4.0681 4.2266 4.2346 4.3002 4.3189 4.6529 4.7221 4.7552 4.7738 4.9736 5.1034 5.1104 5.1608 5.1812 5.1856 5.2849 5.3078 5.4730 5.5247 5.5868 5.6531 5.8843 5.9134 6.3871 6.3899 6.4523 6.4829 6.9188 6.9319 8.5227 8.5377 8.6141 8.6286 8.9038 8.9058 9.3018 9.3138 9.3995 9.4272 10.5130 10.5271 13.0105 13.0719 k = 0.0000 0.1379-0.0000 ( 12559 PWs) bands (ev): -67.2293 -67.2293 -38.6588 -38.6588 -28.9327 -28.9327 -28.8728 -28.8728 -22.7378 -22.7378 -22.6928 -22.6928 -22.6862 -22.6862 -20.5083 -20.5083 -20.4673 -20.4673 -20.4505 -20.4505 -20.4492 -20.4492 -6.0803 -6.0802 -5.0113 -5.0061 -4.9166 -4.9066 -4.8768 -4.8615 1.4833 1.4950 1.9251 1.9297 2.7851 2.8289 3.2004 3.2113 3.2676 3.2909 3.3458 3.3701 3.8740 3.8925 4.0187 4.0458 4.2311 4.2426 4.3108 4.3342 4.6316 4.7044 4.7395 4.7539 4.9540 5.0898 5.1163 5.1623 5.1820 5.1893 5.2842 5.3046 5.4550 5.5053 5.5861 5.6596 5.8873 5.9144 6.3628 6.3678 6.4417 6.4755 6.9155 6.9294 8.5130 8.5272 8.6287 8.6417 8.9243 8.9246 9.2935 9.3052 9.4073 9.4351 10.5860 10.5998 13.0110 13.0879 k = 0.0000 0.1552-0.0000 ( 12567 PWs) bands (ev): -67.2293 -67.2293 -38.6588 -38.6588 -28.9327 -28.9327 -28.8728 -28.8728 -22.7378 -22.7378 -22.6928 -22.6928 -22.6862 -22.6862 -20.5083 -20.5083 -20.4673 -20.4673 -20.4505 -20.4505 -20.4492 -20.4492 -6.0684 -6.0683 -5.0219 -5.0173 -4.9211 -4.9085 -4.8785 -4.8612 1.5038 1.5172 1.9450 1.9498 2.7841 2.8336 3.1888 3.2018 3.2745 3.3014 3.3509 3.3785 3.8673 3.8883 3.9945 4.0217 4.2361 4.2509 4.3192 4.3490 4.6110 4.6827 4.7230 4.7332 4.9354 5.0739 5.1229 5.1618 5.1830 5.1923 5.2850 5.3004 5.4381 5.4849 5.5858 5.6661 5.8873 5.9114 6.3369 6.3435 6.4344 6.4699 6.9118 6.9264 8.5009 8.5141 8.6449 8.6557 8.9454 8.9472 9.2877 9.2979 9.4160 9.4436 10.6644 10.6773 13.0080 13.0860 k = 0.0000 0.1724-0.0000 ( 12555 PWs) bands (ev): -67.2293 -67.2293 -38.6588 -38.6588 -28.9328 -28.9328 -28.8728 -28.8728 -22.7378 -22.7378 -22.6928 -22.6928 -22.6862 -22.6862 -20.5083 -20.5083 -20.4673 -20.4673 -20.4505 -20.4505 -20.4492 -20.4492 -6.0552 -6.0550 -5.0345 -5.0306 -4.9250 -4.9099 -4.8800 -4.8609 1.5263 1.5414 1.9672 1.9723 2.7820 2.8369 3.1775 3.1924 3.2822 3.3126 3.3572 3.3879 3.8603 3.8837 3.9684 3.9954 4.2416 4.2596 4.3241 4.3627 4.5925 4.6570 4.7057 4.7130 4.9178 5.0561 5.1299 5.1589 5.1840 5.1939 5.2874 5.2952 5.4230 5.4639 5.5856 5.6725 5.8836 5.9037 6.3099 6.3178 6.4310 6.4668 6.9077 6.9227 8.4867 8.4986 8.6623 8.6704 8.9680 8.9721 9.2844 9.2923 9.4253 9.4524 10.7473 10.7591 13.0033 13.0794 k = 0.0000 0.1897-0.0000 ( 12563 PWs) bands (ev): -67.2293 -67.2293 -38.6588 -38.6588 -28.9328 -28.9328 -28.8728 -28.8728 -22.7378 -22.7378 -22.6928 -22.6928 -22.6862 -22.6862 -20.5083 -20.5083 -20.4673 -20.4673 -20.4505 -20.4505 -20.4492 -20.4492 -6.0408 -6.0406 -5.0490 -5.0457 -4.9283 -4.9109 -4.8815 -4.8606 1.5508 1.5676 1.9919 1.9971 2.7782 2.8382 3.1675 3.1839 3.2907 3.3246 3.3647 3.3985 3.8529 3.8788 3.9402 3.9667 4.2476 4.2686 4.3240 4.3746 4.5774 4.6280 4.6877 4.6939 4.9013 5.0372 5.1369 5.1533 5.1854 5.1938 5.2888 5.2916 5.4104 5.4429 5.5851 5.6787 5.8760 5.8914 6.2823 6.2912 6.4317 6.4666 6.9033 6.9184 8.4705 8.4812 8.6804 8.6855 8.9919 8.9986 9.2837 9.2885 9.4350 9.4612 10.8339 10.8445 12.9976 13.0709 k = 0.0000 0.2069-0.0000 ( 12557 PWs) bands (ev): -67.2293 -67.2293 -38.6588 -38.6588 -28.9329 -28.9329 -28.8729 -28.8729 -22.7378 -22.7378 -22.6928 -22.6928 -22.6862 -22.6862 -20.5083 -20.5083 -20.4673 -20.4673 -20.4505 -20.4505 -20.4492 -20.4492 -6.0252 -6.0249 -5.0654 -5.0627 -4.9310 -4.9116 -4.8828 -4.8605 1.5771 1.5957 2.0190 2.0242 2.7723 2.8366 3.1597 3.1769 3.2999 3.3371 3.3733 3.4099 3.8453 3.8737 3.9096 3.9355 4.2539 4.2779 4.3178 4.3834 4.5670 4.5974 4.6693 4.6761 4.8859 5.0177 5.1429 5.1450 5.1874 5.1920 5.2813 5.2972 5.4008 5.4225 5.5844 5.6844 5.8644 5.8747 6.2545 6.2643 6.4363 6.4695 6.8986 6.9136 8.4527 8.4623 8.6989 8.7008 9.0169 9.0264 9.2854 9.2865 9.4449 9.4697 10.9235 10.9327 12.9912 13.0610 k = 0.0000 0.2241-0.0000 ( 12543 PWs) bands (ev): -67.2293 -67.2293 -38.6589 -38.6589 -28.9329 -28.9329 -28.8729 -28.8729 -22.7378 -22.7378 -22.6928 -22.6928 -22.6862 -22.6862 -20.5083 -20.5083 -20.4673 -20.4673 -20.4505 -20.4505 -20.4492 -20.4492 -6.0084 -6.0082 -5.0835 -5.0813 -4.9332 -4.9121 -4.8838 -4.8604 1.6051 1.6255 2.0485 2.0536 2.7637 2.8313 3.1551 3.1722 3.3098 3.3499 3.3830 3.4220 3.8375 3.8683 3.8767 3.9016 4.2606 4.2870 4.3054 4.3873 4.5618 4.5673 4.6507 4.6598 4.8717 4.9980 5.1341 5.1472 5.1883 5.1905 5.2729 5.3040 5.3944 5.4030 5.5834 5.6898 5.8492 5.8541 6.2270 6.2376 6.4446 6.4755 6.8934 6.9083 8.4337 8.4424 8.7161 8.7175 9.0426 9.0550 9.2862 9.2891 9.4548 9.4778 11.0156 11.0233 12.9844 13.0501 k = 0.0000 0.2414-0.0000 ( 12551 PWs) bands (ev): -67.2293 -67.2293 -38.6589 -38.6589 -28.9330 -28.9330 -28.8729 -28.8729 -22.7378 -22.7378 -22.6928 -22.6928 -22.6862 -22.6862 -20.5083 -20.5083 -20.4673 -20.4673 -20.4505 -20.4505 -20.4492 -20.4492 -5.9906 -5.9904 -5.1031 -5.1013 -4.9348 -4.9125 -4.8847 -4.8605 1.6345 1.6567 2.0803 2.0852 2.7522 2.8217 3.1543 3.1702 3.3202 3.3629 3.3936 3.4346 3.8297 3.8413 3.8628 3.8650 4.2676 4.2837 4.2993 4.3837 4.5404 4.5611 4.6323 4.6456 4.8587 4.9786 5.1210 5.1488 5.1831 5.1952 5.2636 5.3112 5.3849 5.3911 5.5820 5.6948 5.8302 5.8307 6.2000 6.2117 6.4560 6.4843 6.8879 6.9024 8.4140 8.4218 8.7313 8.7358 9.0687 9.0839 9.2875 9.2945 9.4644 9.4853 11.1095 11.1157 12.9770 13.0386 k = 0.0000 0.2586-0.0000 ( 12545 PWs) bands (ev): -67.2293 -67.2293 -38.6589 -38.6589 -28.9331 -28.9331 -28.8729 -28.8729 -22.7378 -22.7378 -22.6928 -22.6928 -22.6862 -22.6862 -20.5083 -20.5083 -20.4673 -20.4673 -20.4505 -20.4505 -20.4492 -20.4492 -5.9718 -5.9716 -5.1241 -5.1225 -4.9360 -4.9130 -4.8853 -4.8606 1.6653 1.6893 2.1143 2.1191 2.7376 2.8078 3.1576 3.1713 3.3311 3.3758 3.4053 3.4476 3.8034 3.8218 3.8259 3.8573 4.2602 4.2748 4.3085 4.3701 4.5189 4.5630 4.6150 4.6341 4.8472 4.9600 5.1064 5.1475 5.1765 5.2009 5.2541 5.3185 5.3687 5.3908 5.5804 5.6992 5.8038 5.8095 6.1739 6.1867 6.4699 6.4958 6.8819 6.8960 8.3938 8.4009 8.7462 8.7536 9.0947 9.1129 9.2904 9.3013 9.4736 9.4921 11.2046 11.2093 12.9692 13.0265 k = 0.0000 0.2759-0.0000 ( 12539 PWs) bands (ev): -67.2293 -67.2293 -38.6589 -38.6589 -28.9331 -28.9331 -28.8729 -28.8729 -22.7378 -22.7378 -22.6928 -22.6928 -22.6862 -22.6862 -20.5083 -20.5083 -20.4673 -20.4673 -20.4506 -20.4505 -20.4492 -20.4492 -5.9522 -5.9519 -5.1461 -5.1448 -4.9368 -4.9135 -4.8856 -4.8608 1.6972 1.7231 2.1505 2.1550 2.7199 2.7896 3.1651 3.1755 3.3423 3.3885 3.4178 3.4608 3.7631 3.7838 3.8144 3.8517 4.2322 4.2820 4.3184 4.3461 4.5029 4.5631 4.6019 4.6260 4.8374 4.9425 5.0907 5.1434 5.1688 5.2060 5.2455 5.3252 5.3546 5.3931 5.5788 5.7031 5.7756 5.7865 6.1490 6.1630 6.4859 6.5093 6.8755 6.8891 8.3737 8.3801 8.7606 8.7706 9.1205 9.1416 9.2944 9.3091 9.4823 9.4979 11.3003 11.3035 12.9609 13.0141 k = 0.0000 0.2931-0.0000 ( 12543 PWs) bands (ev): -67.2293 -67.2293 -38.6589 -38.6589 -28.9332 -28.9332 -28.8730 -28.8730 -22.7378 -22.7378 -22.6928 -22.6928 -22.6862 -22.6862 -20.5083 -20.5083 -20.4673 -20.4673 -20.4506 -20.4505 -20.4492 -20.4492 -5.9317 -5.9314 -5.1691 -5.1680 -4.9373 -4.9141 -4.8856 -4.8612 1.7301 1.7577 2.1888 2.1928 2.6994 2.7677 3.1763 3.1828 3.3538 3.4006 3.4311 3.4740 3.7205 3.7394 3.8071 3.8463 4.2014 4.2891 4.3141 4.3283 4.4904 4.5551 4.5985 4.6215 4.8295 4.9266 5.0748 5.1369 5.1601 5.2068 5.2412 5.3313 5.3432 5.3973 5.5774 5.7061 5.7463 5.7623 6.1254 6.1407 6.5035 6.5246 6.8686 6.8816 8.3539 8.3598 8.7744 8.7867 9.1458 9.1695 9.2996 9.3176 9.4901 9.5028 11.3960 11.3976 12.9522 13.0013 k = 0.0000 0.3103-0.0000 ( 12531 PWs) bands (ev): -67.2293 -67.2293 -38.6589 -38.6589 -28.9332 -28.9332 -28.8730 -28.8730 -22.7378 -22.7378 -22.6928 -22.6928 -22.6862 -22.6862 -20.5083 -20.5083 -20.4673 -20.4673 -20.4506 -20.4505 -20.4492 -20.4492 -5.9106 -5.9103 -5.1929 -5.1919 -4.9375 -4.9148 -4.8853 -4.8616 1.7637 1.7930 2.2288 2.2323 2.6764 2.7427 3.1905 3.1929 3.3655 3.4123 3.4449 3.4868 3.6760 3.6929 3.8003 3.8409 4.1689 4.2770 4.2962 4.3377 4.4790 4.5399 4.6031 4.6203 4.8237 4.9126 5.0590 5.1283 5.1506 5.2001 5.2440 5.3344 5.3364 5.4027 5.5764 5.7074 5.7169 5.7384 6.1032 6.1200 6.5222 6.5412 6.8612 6.8736 8.3348 8.3401 8.7877 8.8016 9.1703 9.1965 9.3058 9.3264 9.4972 9.5066 11.4909 11.4910 12.9430 12.9882 k = 0.0000 0.3276-0.0000 ( 12531 PWs) bands (ev): -67.2293 -67.2293 -38.6589 -38.6589 -28.9333 -28.9333 -28.8730 -28.8730 -22.7378 -22.7378 -22.6928 -22.6928 -22.6862 -22.6862 -20.5083 -20.5083 -20.4673 -20.4673 -20.4506 -20.4505 -20.4492 -20.4492 -5.8890 -5.8887 -5.2171 -5.2162 -4.9375 -4.9158 -4.8848 -4.8622 1.7980 1.8287 2.2703 2.2732 2.6516 2.7152 3.2055 3.2073 3.3773 3.4234 3.4588 3.4991 3.6298 3.6446 3.7942 3.8358 4.1356 4.2375 4.3025 4.3466 4.4679 4.5223 4.6104 4.6214 4.8202 4.9009 5.0440 5.1181 5.1406 5.1886 5.2510 5.3284 5.3408 5.4085 5.5759 5.6881 5.7011 5.7212 6.0828 6.1009 6.5416 6.5588 6.8533 6.8651 8.3166 8.3214 8.8002 8.8153 9.1939 9.2221 9.3126 9.3352 9.5032 9.5095 11.5830 11.5843 12.9332 12.9746 k = 0.0000 0.3448-0.0000 ( 12541 PWs) bands (ev): -67.2293 -67.2293 -38.6589 -38.6589 -28.9333 -28.9333 -28.8730 -28.8730 -22.7378 -22.7378 -22.6928 -22.6928 -22.6862 -22.6862 -20.5083 -20.5083 -20.4673 -20.4673 -20.4506 -20.4506 -20.4492 -20.4492 -5.8670 -5.8667 -5.2416 -5.2408 -4.9373 -4.9168 -4.8841 -4.8628 1.8326 1.8646 2.3129 2.3150 2.6255 2.6861 3.2200 3.2258 3.3889 3.4339 3.4723 3.5107 3.5824 3.5950 3.7888 3.8309 4.1021 4.1968 4.3081 4.3544 4.4573 4.5045 4.6180 4.6238 4.8192 4.8916 5.0302 5.1065 5.1301 5.1749 5.2595 5.3253 5.3443 5.4141 5.5755 5.6611 5.6806 5.7175 6.0642 6.0834 6.5614 6.5770 6.8448 6.8560 8.2995 8.3038 8.8118 8.8275 9.2164 9.2461 9.3201 9.3439 9.5082 9.5113 11.6728 11.6754 12.9227 12.9606 k = 0.0000 0.3621-0.0000 ( 12539 PWs) bands (ev): -67.2293 -67.2293 -38.6589 -38.6589 -28.9334 -28.9334 -28.8730 -28.8730 -22.7379 -22.7378 -22.6928 -22.6928 -22.6862 -22.6862 -20.5083 -20.5083 -20.4673 -20.4673 -20.4506 -20.4506 -20.4492 -20.4492 -5.8450 -5.8446 -5.2661 -5.2654 -4.9369 -4.9180 -4.8831 -4.8635 1.8672 1.9002 2.3559 2.3568 2.5992 2.6561 3.2359 3.2455 3.4003 3.4436 3.4850 3.5211 3.5347 3.5452 3.7845 3.8263 4.0692 4.1561 4.3126 4.3607 4.4479 4.4875 4.6248 4.6266 4.8207 4.8848 5.0180 5.0941 5.1194 5.1604 5.2681 5.3249 5.3470 5.4189 5.5737 5.6384 5.6567 5.7169 6.0476 6.0675 6.5814 6.5956 6.8357 6.8463 8.2838 8.2877 8.8226 8.8383 9.2376 9.2681 9.3281 9.3520 9.5120 9.5122 11.7595 11.7632 12.9116 12.9460 k = 0.0000 0.3793-0.0000 ( 12557 PWs) bands (ev): -67.2293 -67.2293 -38.6589 -38.6589 -28.9334 -28.9334 -28.8730 -28.8730 -22.7379 -22.7379 -22.6928 -22.6928 -22.6862 -22.6862 -20.5083 -20.5083 -20.4673 -20.4673 -20.4506 -20.4506 -20.4492 -20.4492 -5.8231 -5.8228 -5.2902 -5.2896 -4.9363 -4.9193 -4.8820 -4.8644 1.9017 1.9352 2.3970 2.3982 2.5745 2.6263 3.2525 3.2654 3.4109 3.4522 3.4876 3.4877 3.5047 3.5305 3.7813 3.8219 4.0376 4.1162 4.3159 4.3648 4.4403 4.4723 4.6293 4.6305 4.8244 4.8804 5.0076 5.0811 5.1087 5.1454 5.2764 5.3272 5.3487 5.4225 5.5670 5.6240 5.6332 5.7158 6.0330 6.0531 6.6014 6.6142 6.8260 6.8360 8.2696 8.2730 8.8325 8.8476 9.2573 9.2876 9.3366 9.3596 9.5122 9.5148 11.8420 11.8467 12.8998 12.9309 k = 0.0000 0.3966-0.0000 ( 12565 PWs) bands (ev): -67.2293 -67.2293 -38.6590 -38.6590 -28.9335 -28.9335 -28.8731 -28.8731 -22.7379 -22.7379 -22.6928 -22.6928 -22.6862 -22.6862 -20.5083 -20.5083 -20.4673 -20.4673 -20.4506 -20.4506 -20.4492 -20.4492 -5.8017 -5.8014 -5.3136 -5.3130 -4.9356 -4.9207 -4.8808 -4.8653 1.9356 1.9689 2.4318 2.4378 2.5550 2.5987 3.2686 3.2848 3.4172 3.4419 3.4461 3.4618 3.5108 3.5383 3.7795 3.8178 4.0081 4.0778 4.3178 4.3661 4.4349 4.4598 4.6316 4.6348 4.8302 4.8783 4.9994 5.0680 5.0984 5.1306 5.2842 5.3319 5.3494 5.4248 5.5535 5.6107 5.6206 5.7138 6.0207 6.0402 6.6210 6.6328 6.8157 6.8252 8.2570 8.2600 8.8414 8.8554 9.2754 9.3042 9.3455 9.3663 9.5117 9.5164 11.9192 11.9246 12.8875 12.9151 k = 0.0000 0.4138-0.0000 ( 12562 PWs) bands (ev): -67.2293 -67.2293 -38.6590 -38.6590 -28.9335 -28.9335 -28.8731 -28.8731 -22.7379 -22.7379 -22.6928 -22.6928 -22.6862 -22.6862 -20.5083 -20.5083 -20.4673 -20.4673 -20.4506 -20.4506 -20.4492 -20.4492 -5.7814 -5.7811 -5.3356 -5.3351 -4.9348 -4.9221 -4.8794 -4.8663 1.9683 2.0007 2.4521 2.4693 2.5498 2.5780 3.2824 3.3020 3.3939 3.3970 3.4379 3.4674 3.5204 3.5446 3.7790 3.8137 3.9815 4.0419 4.3187 4.3639 4.4319 4.4507 4.6334 4.6378 4.8373 4.8779 4.9934 5.0550 5.0888 5.1163 5.2916 5.3388 5.3488 5.4255 5.5371 5.5896 5.6246 5.7104 6.0107 6.0289 6.6402 6.6510 6.8048 6.8138 8.2463 8.2487 8.8492 8.8617 9.2918 9.3175 9.3547 9.3722 9.5108 9.5169 11.9898 11.9956 12.8750 12.8990 k = 0.0000 0.4310-0.0000 ( 12554 PWs) bands (ev): -67.2293 -67.2293 -38.6590 -38.6590 -28.9335 -28.9335 -28.8731 -28.8731 -22.7379 -22.7379 -22.6928 -22.6928 -22.6862 -22.6862 -20.5083 -20.5083 -20.4673 -20.4673 -20.4506 -20.4506 -20.4492 -20.4492 -5.7628 -5.7625 -5.3557 -5.3552 -4.9338 -4.9235 -4.8781 -4.8674 1.9993 2.0294 2.4509 2.4810 2.5657 2.5757 3.2889 3.3119 3.3598 3.3636 3.4458 3.4722 3.5291 3.5491 3.7799 3.8097 3.9590 4.0091 4.3191 4.3587 4.4308 4.4448 4.6349 4.6395 4.8454 4.8784 4.9899 5.0424 5.0804 5.1030 5.2987 5.3468 5.3473 5.4242 5.5225 5.5703 5.6324 5.7057 6.0031 6.0190 6.6587 6.6686 6.7933 6.8018 8.2374 8.2394 8.8560 8.8665 9.3061 9.3274 9.3638 9.3771 9.5097 9.5166 12.0521 12.0578 12.8628 12.8830 k = 0.0000 0.4483-0.0000 ( 12556 PWs) bands (ev): -67.2293 -67.2293 -38.6590 -38.6590 -28.9336 -28.9336 -28.8731 -28.8731 -22.7379 -22.7379 -22.6928 -22.6928 -22.6862 -22.6862 -20.5083 -20.5083 -20.4673 -20.4673 -20.4506 -20.4506 -20.4492 -20.4492 -5.7466 -5.7464 -5.3729 -5.3726 -4.9328 -4.9249 -4.8767 -4.8686 2.0275 2.0535 2.4392 2.4704 2.5913 2.5932 3.2799 3.2976 3.3491 3.3511 3.4541 3.4753 3.5365 3.5520 3.7820 3.8056 3.9416 3.9805 4.3198 4.3513 4.4313 4.4413 4.6360 4.6402 4.8538 4.8791 4.9890 5.0305 5.0737 5.0911 5.3057 5.3435 5.3572 5.4200 5.5124 5.5530 5.6420 5.6995 5.9978 6.0107 6.6763 6.6852 6.7815 6.7895 8.2305 8.2320 8.8617 8.8699 9.3181 9.3342 9.3719 9.3809 9.5090 9.5154 12.1042 12.1093 12.8519 12.8678 k = 0.0000 0.4655-0.0000 ( 12564 PWs) bands (ev): -67.2293 -67.2293 -38.6590 -38.6590 -28.9336 -28.9336 -28.8731 -28.8731 -22.7379 -22.7379 -22.6928 -22.6928 -22.6862 -22.6862 -20.5083 -20.5083 -20.4673 -20.4673 -20.4506 -20.4506 -20.4492 -20.4492 -5.7340 -5.7338 -5.3864 -5.3862 -4.9316 -4.9263 -4.8753 -4.8698 2.0515 2.0712 2.4281 2.4524 2.6150 2.6151 3.2612 3.2710 3.3532 3.3547 3.4616 3.4763 3.5426 3.5532 3.7850 3.8014 3.9303 3.9570 4.3214 4.3433 4.4326 4.4392 4.6371 4.6402 4.8617 4.8791 4.9907 5.0194 5.0693 5.0812 5.3128 5.3389 5.3680 5.4126 5.5081 5.5378 5.6525 5.6920 5.9949 6.0040 6.6925 6.7002 6.7701 6.7772 8.2255 8.2265 8.8662 8.8718 9.3276 9.3383 9.3783 9.3836 9.5087 9.5138 12.1440 12.1480 12.8435 12.8546 k = 0.0000 0.4828-0.0000 ( 12568 PWs) bands (ev): -67.2293 -67.2293 -38.6590 -38.6590 -28.9336 -28.9336 -28.8731 -28.8731 -22.7379 -22.7379 -22.6928 -22.6928 -22.6862 -22.6862 -20.5083 -20.5083 -20.4673 -20.4673 -20.4506 -20.4506 -20.4492 -20.4492 -5.7258 -5.7257 -5.3950 -5.3949 -4.9304 -4.9277 -4.8739 -4.8711 2.0696 2.0803 2.4227 2.4359 2.6311 2.6314 3.2466 3.2511 3.3581 3.3596 3.4678 3.4754 3.5474 3.5528 3.7887 3.7971 3.9260 3.9396 4.3245 4.3357 4.4343 4.4376 4.6381 4.6397 4.8687 4.8775 4.9948 5.0095 5.0677 5.0737 5.3199 5.3332 5.3795 5.4026 5.5094 5.5252 5.6632 5.6832 5.9942 5.9989 6.7062 6.7115 6.7609 6.7659 8.2227 8.2232 8.8695 8.8724 9.3344 9.3397 9.3826 9.3850 9.5092 9.5120 12.1696 12.1717 12.8390 12.8447 k = 0.0000 0.5000-0.0000 ( 12570 PWs) bands (ev): -67.2293 -67.2293 -38.6590 -38.6590 -28.9336 -28.9336 -28.8731 -28.8731 -22.7379 -22.7379 -22.6928 -22.6928 -22.6862 -22.6862 -20.5083 -20.5083 -20.4673 -20.4673 -20.4506 -20.4506 -20.4492 -20.4492 -5.7229 -5.7229 -5.3980 -5.3980 -4.9291 -4.9291 -4.8725 -4.8725 2.0797 2.0797 2.4253 2.4253 2.6371 2.6371 3.2426 3.2426 3.3607 3.3607 3.4724 3.4724 3.5509 3.5509 3.7928 3.7928 3.9291 3.9291 4.3293 4.3293 4.4360 4.4360 4.6389 4.6389 4.8741 4.8741 5.0012 5.0012 5.0692 5.0692 5.3268 5.3268 5.3912 5.3912 5.5155 5.5155 5.6735 5.6735 5.9956 5.9956 6.7142 6.7142 6.7588 6.7588 8.2219 8.2219 8.8716 8.8716 9.3384 9.3384 9.3848 9.3848 9.5103 9.5103 12.1790 12.1790 12.8393 12.8393 k = 0.0000 0.5000-0.0000 ( 12570 PWs) bands (ev): -67.2293 -67.2293 -38.6590 -38.6590 -28.9336 -28.9336 -28.8731 -28.8731 -22.7379 -22.7379 -22.6928 -22.6928 -22.6862 -22.6862 -20.5083 -20.5083 -20.4673 -20.4673 -20.4506 -20.4506 -20.4492 -20.4492 -5.7229 -5.7229 -5.3980 -5.3980 -4.9291 -4.9291 -4.8725 -4.8725 2.0797 2.0797 2.4253 2.4253 2.6371 2.6371 3.2426 3.2426 3.3607 3.3607 3.4724 3.4724 3.5509 3.5509 3.7928 3.7928 3.9291 3.9291 4.3293 4.3293 4.4360 4.4360 4.6389 4.6389 4.8741 4.8741 5.0012 5.0012 5.0692 5.0692 5.3268 5.3268 5.3912 5.3912 5.5155 5.5155 5.6735 5.6735 5.9956 5.9956 6.7142 6.7142 6.7588 6.7588 8.2219 8.2219 8.8716 8.8716 9.3384 9.3384 9.3848 9.3848 9.5103 9.5103 12.1790 12.1790 12.8393 12.8393 k = 0.0172 0.5000-0.0000 ( 12566 PWs) bands (ev): -67.2293 -67.2293 -38.6590 -38.6590 -28.9336 -28.9336 -28.8731 -28.8731 -22.7379 -22.7379 -22.6928 -22.6928 -22.6862 -22.6862 -20.5083 -20.5083 -20.4673 -20.4673 -20.4506 -20.4506 -20.4492 -20.4492 -5.7223 -5.7223 -5.3988 -5.3965 -4.9311 -4.9279 -4.8732 -4.8727 2.0808 2.0810 2.4255 2.4257 2.6358 2.6391 3.2387 3.2460 3.3599 3.3608 3.4726 3.4726 3.5485 3.5517 3.7916 3.7931 3.9298 3.9298 4.3279 4.3292 4.4302 4.4379 4.6356 4.6466 4.8679 4.8722 4.9999 5.0059 5.0625 5.0758 5.3157 5.3377 5.3881 5.3946 5.5056 5.5211 5.6698 5.6765 5.9936 6.0065 6.7131 6.7143 6.7559 6.7591 8.2165 8.2299 8.8650 8.8773 9.3363 9.3397 9.3784 9.3899 9.5001 9.5254 12.1805 12.1805 12.8374 12.8441 k = 0.0345 0.5000-0.0000 ( 12568 PWs) bands (ev): -67.2293 -67.2293 -38.6590 -38.6590 -28.9336 -28.9336 -28.8731 -28.8731 -22.7379 -22.7379 -22.6928 -22.6928 -22.6862 -22.6862 -20.5083 -20.5083 -20.4673 -20.4673 -20.4506 -20.4506 -20.4492 -20.4492 -5.7206 -5.7205 -5.3989 -5.3944 -4.9339 -4.9275 -4.8749 -4.8740 2.0844 2.0848 2.4263 2.4267 2.6353 2.6419 3.2344 3.2490 3.3584 3.3602 3.4728 3.4732 3.5449 3.5510 3.7896 3.7925 3.9318 3.9320 4.3249 4.3275 4.4212 4.4354 4.6369 4.6577 4.8548 4.8624 5.0010 5.0134 5.0568 5.0818 5.3051 5.3469 5.3862 5.3976 5.4926 5.5217 5.6656 5.6784 6.0009 6.0254 6.7110 6.7134 6.7504 6.7569 8.2136 8.2404 8.8577 8.8817 9.3330 9.3402 9.3714 9.3929 9.4960 9.5442 12.1848 12.1849 12.8385 12.8519 k = 0.0517 0.5000-0.0000 ( 12584 PWs) bands (ev): -67.2293 -67.2293 -38.6590 -38.6590 -28.9336 -28.9336 -28.8731 -28.8731 -22.7379 -22.7379 -22.6928 -22.6928 -22.6862 -22.6862 -20.5083 -20.5083 -20.4673 -20.4673 -20.4506 -20.4506 -20.4492 -20.4492 -5.7177 -5.7175 -5.3985 -5.3917 -4.9376 -4.9279 -4.8775 -4.8762 2.0903 2.0909 2.4275 2.4282 2.6357 2.6455 3.2299 3.2515 3.3563 3.3589 3.4727 3.4743 3.5404 3.5486 3.7869 3.7910 3.9351 3.9356 4.3203 4.3241 4.4099 4.4289 4.6425 4.6715 4.8368 4.8464 5.0022 5.0224 5.0532 5.0866 5.2955 5.3519 5.3876 5.4000 5.4779 5.5171 5.6611 5.6792 6.0171 6.0512 6.7081 6.7115 6.7425 6.7522 8.2134 8.2534 8.8499 8.8847 9.3287 9.3391 9.3654 9.3937 9.4982 9.5659 12.1920 12.1921 12.8426 12.8622 k = 0.0690 0.5000-0.0000 ( 12582 PWs) bands (ev): -67.2293 -67.2293 -38.6590 -38.6590 -28.9336 -28.9336 -28.8731 -28.8731 -22.7379 -22.7379 -22.6928 -22.6928 -22.6862 -22.6862 -20.5083 -20.5083 -20.4673 -20.4673 -20.4506 -20.4506 -20.4492 -20.4492 -5.7136 -5.7134 -5.3974 -5.3884 -4.9420 -4.9293 -4.8810 -4.8794 2.0986 2.0995 2.4294 2.4302 2.6369 2.6498 3.2251 3.2535 3.3536 3.3568 3.4717 3.4758 3.5357 3.5447 3.7836 3.7886 3.9396 3.9407 4.3142 4.3190 4.3970 4.4190 4.6516 4.6869 4.8154 4.8257 5.0012 5.0318 5.0529 5.0901 5.2870 5.3512 5.3930 5.4014 5.4628 5.5082 5.6562 5.6789 6.0414 6.0827 6.7043 6.7086 6.7324 6.7454 8.2157 8.2688 8.8417 8.8861 9.3232 9.3342 9.3635 9.3932 9.5063 9.5894 12.2020 12.2020 12.8494 12.8747 k = 0.0862 0.5000-0.0000 ( 12584 PWs) bands (ev): -67.2293 -67.2293 -38.6590 -38.6590 -28.9337 -28.9337 -28.8731 -28.8731 -22.7379 -22.7379 -22.6928 -22.6928 -22.6862 -22.6862 -20.5083 -20.5083 -20.4673 -20.4673 -20.4506 -20.4506 -20.4492 -20.4492 -5.7084 -5.7081 -5.3956 -5.3844 -4.9472 -4.9315 -4.8854 -4.8836 2.1091 2.1103 2.4317 2.4328 2.6390 2.6549 3.2201 3.2551 3.3505 3.3540 3.4689 3.4776 3.5316 3.5394 3.7797 3.7854 3.9452 3.9472 4.3065 4.3121 4.3832 4.4066 4.6635 4.7026 4.7924 4.8017 4.9974 5.0412 5.0556 5.0920 5.2796 5.3462 5.3999 5.4014 5.4489 5.4963 5.6509 5.6776 6.0723 6.1187 6.6997 6.7048 6.7204 6.7366 8.2204 8.2865 8.8335 8.8855 9.3163 9.3247 9.3670 9.3930 9.5189 9.6143 12.2145 12.2146 12.8585 12.8890 k = 0.1034 0.5000-0.0000 ( 12588 PWs) bands (ev): -67.2293 -67.2293 -38.6590 -38.6590 -28.9337 -28.9337 -28.8731 -28.8731 -22.7379 -22.7379 -22.6928 -22.6928 -22.6862 -22.6862 -20.5083 -20.5083 -20.4673 -20.4673 -20.4506 -20.4506 -20.4492 -20.4492 -5.7020 -5.7017 -5.3933 -5.3799 -4.9531 -4.9347 -4.8906 -4.8886 2.1218 2.1234 2.4344 2.4358 2.6421 2.6607 3.2151 3.2563 3.3471 3.3506 3.4635 3.4795 3.5291 3.5331 3.7753 3.7814 3.9518 3.9550 4.2973 4.3032 4.3689 4.3924 4.6769 4.7158 4.7711 4.7756 4.9915 5.0500 5.0602 5.0925 5.2732 5.3387 5.3992 5.4037 5.4393 5.4830 5.6450 5.6753 6.1087 6.1582 6.6943 6.6999 6.7069 6.7265 8.2276 8.3063 8.8253 8.8831 9.3077 9.3120 9.3748 9.3950 9.5347 9.6398 12.2294 12.2297 12.8696 12.9044 k = 0.1207 0.5000-0.0000 ( 12582 PWs) bands (ev): -67.2293 -67.2293 -38.6590 -38.6590 -28.9337 -28.9337 -28.8732 -28.8732 -22.7379 -22.7379 -22.6928 -22.6928 -22.6862 -22.6862 -20.5083 -20.5083 -20.4673 -20.4673 -20.4506 -20.4506 -20.4492 -20.4492 -5.6945 -5.6942 -5.3903 -5.3748 -4.9598 -4.9389 -4.8965 -4.8946 2.1366 2.1386 2.4376 2.4393 2.6462 2.6674 3.2102 3.2571 3.3435 3.3465 3.4550 3.4809 3.5262 3.5286 3.7705 3.7767 3.9593 3.9641 4.2864 4.2921 4.3547 4.3769 4.6906 4.7149 4.7489 4.7631 4.9846 5.0579 5.0654 5.0922 5.2674 5.3292 5.3938 5.3998 5.4376 5.4703 5.6384 5.6721 6.1491 6.2001 6.6867 6.6934 6.6940 6.7159 8.2372 8.3280 8.8173 8.8788 9.2971 9.2975 9.3860 9.4003 9.5526 9.6656 12.2465 12.2471 12.8818 12.9201 k = 0.1379 0.5000-0.0000 ( 12580 PWs) bands (ev): -67.2293 -67.2293 -38.6590 -38.6590 -28.9338 -28.9338 -28.8732 -28.8732 -22.7379 -22.7379 -22.6928 -22.6928 -22.6862 -22.6862 -20.5083 -20.5083 -20.4673 -20.4673 -20.4506 -20.4506 -20.4492 -20.4492 -5.6860 -5.6856 -5.3867 -5.3691 -4.9673 -4.9442 -4.9030 -4.9014 2.1532 2.1557 2.4412 2.4431 2.6515 2.6749 3.2054 3.2577 3.3396 3.3418 3.4437 3.4809 3.5199 3.5301 3.7653 3.7715 3.9677 3.9744 4.2737 4.2789 4.3407 4.3608 4.6944 4.6976 4.7286 4.7742 4.9774 5.0640 5.0707 5.0920 5.2620 5.3183 5.3842 5.3904 5.4415 5.4598 5.6311 5.6681 6.1923 6.2437 6.6730 6.6845 6.6862 6.7064 8.2489 8.3515 8.8096 8.8730 9.2818 9.2845 9.4003 9.4095 9.5719 9.6912 12.2655 12.2666 12.8946 12.9353 k = 0.1552 0.5000-0.0000 ( 12578 PWs) bands (ev): -67.2293 -67.2293 -38.6590 -38.6590 -28.9338 -28.9338 -28.8732 -28.8732 -22.7379 -22.7379 -22.6928 -22.6928 -22.6862 -22.6862 -20.5084 -20.5084 -20.4673 -20.4673 -20.4506 -20.4506 -20.4492 -20.4492 -5.6763 -5.6759 -5.3825 -5.3629 -4.9755 -4.9506 -4.9101 -4.9091 2.1715 2.1747 2.4451 2.4473 2.6580 2.6833 3.2009 3.2581 3.3358 3.3366 3.4301 3.4781 3.5156 3.5331 3.7598 3.7658 3.9770 3.9858 4.2592 4.2633 4.3271 4.3441 4.6672 4.6793 4.7334 4.7916 4.9703 5.0670 5.0756 5.0936 5.2566 5.3061 5.3700 5.3796 5.4462 5.4521 5.6232 5.6633 6.2372 6.2880 6.6567 6.6727 6.6808 6.6992 8.2627 8.3765 8.8024 8.8659 9.2656 9.2704 9.4172 9.4225 9.5922 9.7161 12.2862 12.2877 12.9070 12.9489 k = 0.1724 0.5000-0.0000 ( 12564 PWs) bands (ev): -67.2293 -67.2293 -38.6590 -38.6590 -28.9339 -28.9339 -28.8732 -28.8732 -22.7379 -22.7379 -22.6928 -22.6928 -22.6862 -22.6862 -20.5084 -20.5084 -20.4673 -20.4673 -20.4506 -20.4506 -20.4492 -20.4492 -5.6657 -5.6652 -5.3778 -5.3562 -4.9844 -4.9581 -4.9176 -4.9175 2.1914 2.1953 2.4493 2.4518 2.6658 2.6927 3.1967 3.2583 3.3309 3.3319 3.4149 3.4715 3.5146 3.5371 3.7540 3.7597 3.9870 3.9982 4.2428 4.2454 4.3140 4.3274 4.6384 4.6508 4.7484 4.8107 4.9634 5.0663 5.0800 5.0979 5.2510 5.2930 5.3521 5.3689 5.4466 5.4500 5.6146 5.6578 6.2825 6.3319 6.6400 6.6587 6.6767 6.6942 8.2783 8.4027 8.7958 8.8579 9.2491 9.2551 9.4367 9.4389 9.6129 9.7402 12.3081 12.3103 12.9179 12.9599 k = 0.1897 0.5000-0.0000 ( 12572 PWs) bands (ev): -67.2293 -67.2293 -38.6590 -38.6590 -28.9339 -28.9339 -28.8732 -28.8732 -22.7379 -22.7379 -22.6928 -22.6928 -22.6862 -22.6862 -20.5084 -20.5084 -20.4673 -20.4673 -20.4506 -20.4506 -20.4492 -20.4492 -5.6541 -5.6536 -5.3725 -5.3490 -4.9940 -4.9668 -4.9266 -4.9255 2.2125 2.2173 2.4537 2.4565 2.6751 2.7031 3.1929 3.2584 3.3247 3.3280 3.3987 3.4619 3.5160 3.5417 3.7481 3.7533 3.9976 4.0114 4.2243 4.2253 4.3013 4.3108 4.6090 4.6208 4.7649 4.8302 4.9570 5.0628 5.0837 5.1041 5.2450 5.2796 5.3318 5.3585 5.4422 5.4521 5.6056 5.6516 6.3271 6.3742 6.6235 6.6436 6.6744 6.6914 8.2956 8.4297 8.7900 8.8494 9.2329 9.2394 9.4581 9.4584 9.6338 9.7631 12.3310 12.3339 12.9262 12.9671 k = 0.2069 0.5000-0.0000 ( 12564 PWs) bands (ev): -67.2293 -67.2293 -38.6590 -38.6590 -28.9340 -28.9340 -28.8732 -28.8732 -22.7379 -22.7379 -22.6928 -22.6928 -22.6862 -22.6862 -20.5084 -20.5084 -20.4673 -20.4673 -20.4506 -20.4506 -20.4492 -20.4492 -5.6416 -5.6410 -5.3666 -5.3413 -5.0044 -4.9767 -4.9364 -4.9336 2.2345 2.2404 2.4582 2.4613 2.6860 2.7147 3.1896 3.2584 3.3182 3.3238 3.3824 3.4505 3.5190 3.5468 3.7420 3.7466 4.0088 4.0252 4.2030 4.2037 4.2890 4.2944 4.5798 4.5907 4.7818 4.8499 4.9512 5.0580 5.0866 5.1111 5.2384 5.2661 5.3101 5.3484 5.4380 5.4522 5.5962 5.6447 6.3696 6.4132 6.6078 6.6283 6.6750 6.6912 8.3143 8.4571 8.7849 8.8408 9.2172 9.2236 9.4795 9.4820 9.6547 9.7846 12.3543 12.3581 12.9306 12.9693 k = 0.2241 0.5000-0.0000 ( 12568 PWs) bands (ev): -67.2293 -67.2293 -38.6591 -38.6591 -28.9341 -28.9341 -28.8733 -28.8733 -22.7379 -22.7379 -22.6928 -22.6928 -22.6862 -22.6862 -20.5084 -20.5084 -20.4673 -20.4673 -20.4506 -20.4506 -20.4492 -20.4492 -5.6282 -5.6275 -5.3603 -5.3332 -5.0155 -4.9878 -4.9467 -4.9420 2.2573 2.2644 2.4628 2.4662 2.6987 2.7274 3.1868 3.2583 3.3113 3.3188 3.3668 3.4384 3.5226 3.5520 3.7360 3.7399 4.0204 4.0395 4.1786 4.1809 4.2771 4.2786 4.5511 4.5612 4.7984 4.8693 4.9459 5.0525 5.0886 5.1183 5.2310 5.2532 5.2879 5.3385 5.4334 5.4501 5.5865 5.6372 6.4085 6.4468 6.5934 6.6132 6.6801 6.6945 8.3342 8.4845 8.7808 8.8325 9.2026 9.2084 9.5026 9.5073 9.6753 9.8044 12.3777 12.3824 12.9299 12.9655 k = 0.2414 0.5000-0.0000 ( 12564 PWs) bands (ev): -67.2293 -67.2293 -38.6591 -38.6591 -28.9341 -28.9341 -28.8733 -28.8733 -22.7379 -22.7379 -22.6928 -22.6928 -22.6862 -22.6862 -20.5084 -20.5084 -20.4673 -20.4673 -20.4506 -20.4506 -20.4492 -20.4492 -5.6139 -5.6132 -5.3535 -5.3248 -5.0273 -4.9999 -4.9574 -4.9507 2.2803 2.2889 2.4674 2.4711 2.7133 2.7415 3.1847 3.2579 3.3043 3.3119 3.3538 3.4263 3.5267 3.5571 3.7299 3.7331 4.0322 4.0536 4.1521 4.1562 4.2632 4.2657 4.5231 4.5324 4.8146 4.8883 4.9413 5.0467 5.0897 5.1256 5.2227 5.2412 5.2659 5.3288 5.4281 5.4458 5.5766 5.6292 6.4420 6.4727 6.5807 6.5988 6.6914 6.7024 8.3550 8.5112 8.7778 8.8250 9.1892 9.1940 9.5268 9.5337 9.6955 9.8223 12.4006 12.4064 12.9233 12.9550 k = 0.2586 0.5000-0.0000 ( 12556 PWs) bands (ev): -67.2293 -67.2293 -38.6591 -38.6591 -28.9342 -28.9342 -28.8733 -28.8733 -22.7379 -22.7379 -22.6928 -22.6928 -22.6862 -22.6862 -20.5084 -20.5084 -20.4673 -20.4673 -20.4506 -20.4506 -20.4492 -20.4492 -5.5989 -5.5981 -5.3463 -5.3160 -5.0397 -5.0131 -4.9686 -4.9596 2.3034 2.3134 2.4720 2.4760 2.7298 2.7570 3.1832 3.2572 3.2974 3.3017 3.3451 3.4145 3.5308 3.5622 3.7240 3.7264 4.0440 4.0663 4.1233 4.1309 4.2486 4.2550 4.4962 4.5047 4.8301 4.9065 4.9374 5.0410 5.0899 5.1328 5.2125 5.2305 5.2454 5.3193 5.4218 5.4395 5.5667 5.6205 6.4686 6.4896 6.5700 6.5853 6.7099 6.7160 8.3763 8.5366 8.7758 8.8185 9.1774 9.1810 9.5516 9.5611 9.7153 9.8383 12.4226 12.4296 12.9102 12.9376 k = 0.2759 0.5000-0.0000 ( 12548 PWs) bands (ev): -67.2293 -67.2293 -38.6591 -38.6591 -28.9342 -28.9342 -28.8733 -28.8733 -22.7379 -22.7379 -22.6928 -22.6928 -22.6862 -22.6862 -20.5084 -20.5084 -20.4673 -20.4673 -20.4506 -20.4506 -20.4492 -20.4492 -5.5832 -5.5823 -5.3387 -5.3070 -5.0528 -5.0271 -4.9801 -4.9687 2.3261 2.3377 2.4765 2.4807 2.7483 2.7740 3.1822 3.2555 3.2884 3.2911 3.3409 3.4036 3.5349 3.5669 3.7184 3.7197 4.0553 4.0711 4.0926 4.1112 4.2346 4.2450 4.4706 4.4784 4.8447 4.9237 4.9341 5.0357 5.0892 5.1398 5.1986 5.2213 5.2287 5.3099 5.4145 5.4311 5.5569 5.6114 6.4875 6.4980 6.5615 6.5729 6.7348 6.7358 8.3978 8.5599 8.7749 8.8135 9.1674 9.1698 9.5766 9.5891 9.7344 9.8522 12.4433 12.4514 12.8905 12.9135 k = 0.2931 0.5000-0.0000 ( 12540 PWs) bands (ev): -67.2293 -67.2293 -38.6591 -38.6591 -28.9343 -28.9343 -28.8734 -28.8734 -22.7379 -22.7379 -22.6928 -22.6928 -22.6862 -22.6862 -20.5084 -20.5084 -20.4673 -20.4673 -20.4506 -20.4506 -20.4492 -20.4492 -5.5669 -5.5659 -5.3308 -5.2978 -5.0665 -5.0418 -4.9917 -4.9780 2.3481 2.3613 2.4808 2.4852 2.7687 2.7924 3.1818 3.2524 3.2738 3.2860 3.3401 3.3938 3.5388 3.5711 3.7130 3.7133 4.0530 4.0563 4.0694 4.1116 4.2216 4.2361 4.4465 4.4537 4.8581 4.9315 4.9392 5.0314 5.0878 5.1461 5.1806 5.2138 5.2168 5.3009 5.4062 5.4211 5.5475 5.6019 6.4993 6.5000 6.5547 6.5619 6.7606 6.7640 8.4192 8.5804 8.7752 8.8104 9.1593 9.1605 9.6014 9.6172 9.7528 9.8639 12.4624 12.4716 12.8648 12.8837 k = 0.3103 0.5000-0.0000 ( 12536 PWs) bands (ev): -67.2293 -67.2293 -38.6591 -38.6591 -28.9343 -28.9343 -28.8734 -28.8734 -22.7379 -22.7379 -22.6928 -22.6928 -22.6862 -22.6862 -20.5084 -20.5084 -20.4673 -20.4673 -20.4506 -20.4506 -20.4492 -20.4492 -5.5500 -5.5489 -5.3227 -5.2885 -5.0807 -5.0571 -5.0035 -4.9876 2.3691 2.3838 2.4849 2.4895 2.7909 2.8122 3.1817 3.2474 3.2594 3.2829 3.3417 3.3855 3.5426 3.5749 3.7071 3.7081 4.0220 4.0226 4.0776 4.1221 4.2098 4.2284 4.4241 4.4308 4.8700 4.9294 4.9520 5.0293 5.0862 5.1488 5.1633 5.2078 5.2083 5.2922 5.3970 5.4095 5.5384 5.5921 6.4984 6.5053 6.5490 6.5524 6.7888 6.7952 8.4402 8.5974 8.7766 8.8095 9.1533 9.1535 9.6257 9.6452 9.7704 9.8733 12.4794 12.4897 12.8341 12.8494 k = 0.3276 0.5000-0.0000 ( 12552 PWs) bands (ev): -67.2293 -67.2293 -38.6591 -38.6591 -28.9344 -28.9344 -28.8734 -28.8734 -22.7379 -22.7379 -22.6928 -22.6928 -22.6862 -22.6862 -20.5084 -20.5084 -20.4673 -20.4673 -20.4506 -20.4506 -20.4492 -20.4492 -5.5326 -5.5315 -5.3144 -5.2793 -5.0953 -5.0729 -5.0152 -4.9974 2.3890 2.4049 2.4888 2.4934 2.8144 2.8332 3.1816 3.2407 3.2467 3.2818 3.3454 3.3790 3.5461 3.5780 3.7011 3.7036 3.9853 3.9868 4.0861 4.1329 4.2000 4.2223 4.4037 4.4100 4.8804 4.9279 4.9605 5.0306 5.0850 5.1338 5.1622 5.2018 5.2030 5.2843 5.3870 5.3966 5.5299 5.5821 6.4952 6.5072 6.5439 6.5445 6.8186 6.8267 8.4604 8.6105 8.7793 8.8108 9.1489 9.1493 9.6492 9.6726 9.7871 9.8804 12.4944 12.5054 12.7999 12.8120 k = 0.3448 0.5000-0.0000 ( 12544 PWs) bands (ev): -67.2293 -67.2293 -38.6591 -38.6591 -28.9345 -28.9345 -28.8734 -28.8734 -22.7379 -22.7379 -22.6928 -22.6928 -22.6862 -22.6862 -20.5084 -20.5084 -20.4673 -20.4673 -20.4506 -20.4506 -20.4492 -20.4492 -5.5149 -5.5138 -5.3060 -5.2704 -5.1101 -5.0890 -5.0268 -5.0074 2.4075 2.4243 2.4924 2.4971 2.8387 2.8549 3.1809 3.2330 3.2366 3.2822 3.3510 3.3744 3.5494 3.5804 3.6954 3.6996 3.9459 3.9494 4.0929 4.1406 4.1935 4.2181 4.3855 4.3915 4.8890 4.9269 4.9639 5.0364 5.0846 5.1126 5.1664 5.1973 5.1990 5.2772 5.3764 5.3828 5.5221 5.5721 6.4916 6.5062 6.5380 6.5392 6.8482 6.8569 8.4796 8.6195 8.7830 8.8139 9.1465 9.1472 9.6717 9.6992 9.8026 9.8852 12.5071 12.5187 12.7636 12.7731 k = 0.3621 0.5000-0.0000 ( 12540 PWs) bands (ev): -67.2293 -67.2293 -38.6591 -38.6591 -28.9345 -28.9345 -28.8734 -28.8734 -22.7379 -22.7379 -22.6928 -22.6928 -22.6862 -22.6862 -20.5084 -20.5084 -20.4673 -20.4673 -20.4506 -20.4506 -20.4492 -20.4492 -5.4970 -5.4959 -5.2977 -5.2619 -5.1249 -5.1050 -5.0380 -5.0175 2.4246 2.4417 2.4956 2.5003 2.8631 2.8767 3.1792 3.2250 3.2304 3.2837 3.3587 3.3723 3.5523 3.5820 3.6898 3.6961 3.9048 3.9107 4.0975 4.1429 4.1921 4.2157 4.3699 4.3756 4.8960 4.9262 4.9629 5.0456 5.0857 5.0913 5.1693 5.1953 5.1955 5.2713 5.3652 5.3683 5.5152 5.5621 6.4883 6.5036 6.5328 6.5349 6.8765 6.8852 8.4976 8.6247 8.7877 8.8184 9.1464 9.1469 9.6932 9.7246 9.8169 9.8877 12.5177 12.5295 12.7268 12.7342 k = 0.3793 0.5000-0.0000 ( 12528 PWs) bands (ev): -67.2293 -67.2293 -38.6591 -38.6591 -28.9345 -28.9345 -28.8734 -28.8734 -22.7379 -22.7379 -22.6928 -22.6928 -22.6862 -22.6862 -20.5084 -20.5084 -20.4673 -20.4673 -20.4506 -20.4506 -20.4492 -20.4492 -5.4791 -5.4780 -5.2898 -5.2544 -5.1392 -5.1208 -5.0489 -5.0276 2.4401 2.4569 2.4985 2.5031 2.8867 2.8978 3.1763 3.2174 3.2285 3.2855 3.3686 3.3733 3.5549 3.5828 3.6842 3.6930 3.8625 3.8712 4.1002 4.1397 4.1955 4.2149 4.3569 4.3624 4.9014 4.9259 4.9591 5.0552 5.0722 5.0884 5.1696 5.1916 5.1971 5.2668 5.3534 5.3538 5.5093 5.5524 6.4853 6.5002 6.5286 6.5308 6.9028 6.9110 8.5143 8.6268 8.7933 8.8234 9.1480 9.1481 9.7136 9.7484 9.8297 9.8880 12.5263 12.5379 12.6909 12.6967 k = 0.3966 0.5000-0.0000 ( 12520 PWs) bands (ev): -67.2293 -67.2293 -38.6591 -38.6591 -28.9346 -28.9346 -28.8735 -28.8735 -22.7379 -22.7379 -22.6928 -22.6928 -22.6862 -22.6862 -20.5084 -20.5084 -20.4673 -20.4673 -20.4506 -20.4506 -20.4492 -20.4492 -5.4613 -5.4603 -5.2825 -5.2484 -5.1525 -5.1359 -5.0590 -5.0376 2.4541 2.4700 2.5010 2.5054 2.9084 2.9174 3.1733 3.2105 3.2303 3.2872 3.3783 3.3811 3.5570 3.5828 3.6782 3.6901 3.8197 3.8321 4.1011 4.1335 4.2007 4.2151 4.3468 4.3520 4.9054 4.9262 4.9538 5.0470 5.0726 5.0927 5.1678 5.1874 5.2016 5.2640 5.3384 5.3422 5.5045 5.5431 6.4830 6.4965 6.5252 6.5273 6.9263 6.9337 8.5295 8.6264 8.7995 8.8282 9.1504 9.1509 9.7330 9.7703 9.8408 9.8861 12.5332 12.5441 12.6573 12.6617 k = 0.4138 0.5000-0.0000 ( 12492 PWs) bands (ev): -67.2293 -67.2293 -38.6592 -38.6592 -28.9346 -28.9346 -28.8735 -28.8735 -22.7379 -22.7379 -22.6928 -22.6928 -22.6862 -22.6862 -20.5084 -20.5084 -20.4673 -20.4673 -20.4506 -20.4506 -20.4492 -20.4492 -5.4441 -5.4431 -5.2762 -5.2448 -5.1638 -5.1498 -5.0681 -5.0474 2.4665 2.4808 2.5031 2.5072 2.9274 2.9345 3.1712 3.2044 3.2347 3.2881 3.3883 3.3964 3.5586 3.5819 3.6710 3.6866 3.7777 3.7946 4.1008 4.1265 4.2057 4.2157 4.3395 4.3444 4.9083 4.9276 4.9478 5.0289 5.0841 5.0983 5.1650 5.1826 5.2079 5.2628 5.3234 5.3307 5.5009 5.5342 6.4813 6.4929 6.5224 6.5242 6.9468 6.9531 8.5434 8.6241 8.8060 8.8323 9.1535 9.1545 9.7513 9.7900 9.8500 9.8824 12.5386 12.5484 12.6270 12.6304 k = 0.4310 0.5000-0.0000 ( 12502 PWs) bands (ev): -67.2293 -67.2293 -38.6592 -38.6592 -28.9346 -28.9346 -28.8735 -28.8735 -22.7379 -22.7379 -22.6928 -22.6928 -22.6862 -22.6862 -20.5084 -20.5084 -20.4673 -20.4673 -20.4506 -20.4506 -20.4492 -20.4492 -5.4277 -5.4269 -5.2714 -5.2447 -5.1721 -5.1616 -5.0758 -5.0568 2.4773 2.4894 2.5048 2.5084 2.9430 2.9485 3.1706 3.1991 3.2410 3.2876 3.4040 3.4147 3.5592 3.5800 3.6612 3.6803 3.7396 3.7613 4.1001 4.1196 4.2095 4.2162 4.3349 4.3394 4.9103 4.9305 4.9416 5.0114 5.0957 5.1046 5.1617 5.1771 5.2154 5.2634 5.3087 5.3196 5.4986 5.5261 6.4802 6.4897 6.5202 6.5216 6.9640 6.9691 8.5560 8.6203 8.8125 8.8352 9.1570 9.1583 9.7686 9.8070 9.8570 9.8769 12.5428 12.5510 12.6009 12.6036 k = 0.4483 0.5000-0.0000 ( 12494 PWs) bands (ev): -67.2293 -67.2293 -38.6592 -38.6592 -28.9347 -28.9347 -28.8735 -28.8735 -22.7379 -22.7379 -22.6928 -22.6928 -22.6862 -22.6862 -20.5084 -20.5084 -20.4673 -20.4673 -20.4506 -20.4506 -20.4492 -20.4492 -5.4130 -5.4123 -5.2685 -5.2482 -5.1769 -5.1707 -5.0817 -5.0656 2.4864 2.4959 2.5060 2.5089 2.9550 2.9589 3.1717 3.1943 3.2483 3.2855 3.4255 3.4362 3.5582 3.5762 3.6470 3.6642 3.7139 3.7352 4.0994 4.1135 4.2120 4.2163 4.3324 4.3362 4.9120 4.9349 4.9355 4.9953 5.1064 5.1113 5.1584 5.1711 5.2239 5.2656 5.2945 5.3089 5.4977 5.5188 6.4796 6.4868 6.5185 6.5195 6.9776 6.9815 8.5673 8.6153 8.8188 8.8368 9.1604 9.1618 9.7849 9.8208 9.8616 9.8704 12.5461 12.5522 12.5799 12.5822 k = 0.4655 0.5000-0.0000 ( 12488 PWs) bands (ev): -67.2293 -67.2293 -38.6592 -38.6592 -28.9347 -28.9347 -28.8735 -28.8735 -22.7379 -22.7379 -22.6928 -22.6928 -22.6862 -22.6862 -20.5084 -20.5084 -20.4673 -20.4673 -20.4506 -20.4506 -20.4492 -20.4492 -5.4008 -5.4004 -5.2672 -5.2541 -5.1792 -5.1766 -5.0852 -5.0733 2.4939 2.5007 2.5066 2.5084 2.9633 2.9659 3.1742 3.1900 3.2561 3.2819 3.4518 3.4601 3.5537 3.5685 3.6296 3.6381 3.7045 3.7184 4.0992 4.1083 4.2135 4.2161 4.3316 4.3343 4.9139 4.9297 4.9409 4.9809 5.1156 5.1174 5.1555 5.1650 5.2333 5.2690 5.2813 5.2990 5.4980 5.5123 6.4795 6.4844 6.5173 6.5180 6.9876 6.9902 8.5776 8.6095 8.8245 8.8370 9.1632 9.1644 9.8000 9.8300 9.8638 9.8641 12.5485 12.5521 12.5647 12.5668 k = 0.4828 0.5000-0.0000 ( 12470 PWs) bands (ev): -67.2293 -67.2293 -38.6592 -38.6592 -28.9347 -28.9347 -28.8735 -28.8735 -22.7379 -22.7379 -22.6928 -22.6928 -22.6862 -22.6862 -20.5084 -20.5084 -20.4673 -20.4673 -20.4506 -20.4506 -20.4492 -20.4492 -5.3926 -5.3924 -5.2664 -5.2601 -5.1801 -5.1795 -5.0860 -5.0797 2.4998 2.5038 2.5065 2.5069 2.9684 2.9697 3.1777 3.1857 3.2637 3.2769 3.4803 3.4845 3.5434 3.5526 3.6154 3.6176 3.7027 3.7090 4.0998 4.1043 4.2144 4.2156 4.3317 4.3332 4.9166 4.9246 4.9484 4.9683 5.1220 5.1223 5.1539 5.1592 5.2436 5.2662 5.2764 5.2900 5.4997 5.5070 6.4800 6.4824 6.5167 6.5171 6.9939 6.9952 8.5868 8.6027 8.8294 8.8358 9.1653 9.1660 9.8136 9.8317 9.8610 9.8638 12.5496 12.5504 12.5562 12.5583 k = 0.5000 0.5000-0.0000 ( 12464 PWs) bands (ev): -67.2293 -67.2293 -38.6592 -38.6592 -28.9347 -28.9347 -28.8735 -28.8735 -22.7379 -22.7379 -22.6928 -22.6928 -22.6862 -22.6862 -20.5084 -20.5084 -20.4673 -20.4673 -20.4506 -20.4506 -20.4492 -20.4492 -5.3896 -5.3896 -5.2644 -5.2644 -5.1803 -5.1803 -5.0841 -5.0841 2.5041 2.5041 2.5057 2.5057 2.9705 2.9705 3.1816 3.1816 3.2708 3.2708 3.4988 3.4988 3.5359 3.5359 3.6106 3.6106 3.7042 3.7042 4.1015 4.1015 4.2151 4.2151 4.3323 4.3323 4.9201 4.9201 4.9575 4.9575 5.1243 5.1243 5.1551 5.1551 5.2547 5.2547 5.2823 5.2823 5.5027 5.5027 6.4810 6.4810 6.5166 6.5166 6.9964 6.9964 8.5952 8.5952 8.8332 8.8332 9.1662 9.1662 9.8250 9.8250 9.8621 9.8621 12.5491 12.5491 12.5553 12.5553 k = 0.5000 0.5000-0.0000 ( 12464 PWs) bands (ev): -67.2293 -67.2293 -38.6592 -38.6592 -28.9347 -28.9347 -28.8735 -28.8735 -22.7379 -22.7379 -22.6928 -22.6928 -22.6862 -22.6862 -20.5084 -20.5084 -20.4673 -20.4673 -20.4506 -20.4506 -20.4492 -20.4492 -5.3896 -5.3896 -5.2644 -5.2644 -5.1803 -5.1803 -5.0841 -5.0841 2.5041 2.5041 2.5057 2.5057 2.9705 2.9705 3.1816 3.1816 3.2708 3.2708 3.4988 3.4988 3.5359 3.5359 3.6106 3.6106 3.7042 3.7042 4.1015 4.1015 4.2151 4.2151 4.3323 4.3323 4.9201 4.9201 4.9575 4.9575 5.1243 5.1243 5.1551 5.1551 5.2547 5.2547 5.2823 5.2823 5.5027 5.5027 6.4810 6.4810 6.5166 6.5166 6.9964 6.9964 8.5952 8.5952 8.8332 8.8332 9.1662 9.1662 9.8250 9.8250 9.8621 9.8621 12.5491 12.5491 12.5553 12.5553 k = 0.4878 0.4878-0.0000 ( 12474 PWs) bands (ev): -67.2293 -67.2293 -38.6592 -38.6592 -28.9347 -28.9347 -28.8735 -28.8735 -22.7379 -22.7379 -22.6928 -22.6928 -22.6862 -22.6862 -20.5084 -20.5084 -20.4673 -20.4673 -20.4506 -20.4506 -20.4492 -20.4492 -5.3926 -5.3924 -5.2662 -5.2602 -5.1800 -5.1796 -5.0861 -5.0796 2.4989 2.5049 2.5054 2.5079 2.9684 2.9697 3.1777 3.1857 3.2637 3.2769 3.4820 3.4820 3.5446 3.5527 3.6152 3.6173 3.7026 3.7089 4.0998 4.1043 4.2144 4.2156 4.3318 4.3331 4.9166 4.9245 4.9485 4.9683 5.1218 5.1225 5.1541 5.1591 5.2436 5.2661 5.2764 5.2900 5.4997 5.5070 6.4800 6.4824 6.5167 6.5170 6.9939 6.9952 8.5868 8.6027 8.8294 8.8358 9.1653 9.1660 9.8131 9.8325 9.8604 9.8641 12.5481 12.5493 12.5579 12.5594 k = 0.4756 0.4756-0.0000 ( 12490 PWs) bands (ev): -67.2293 -67.2293 -38.6592 -38.6592 -28.9347 -28.9347 -28.8735 -28.8735 -22.7379 -22.7379 -22.6928 -22.6928 -22.6862 -22.6862 -20.5084 -20.5084 -20.4673 -20.4673 -20.4506 -20.4506 -20.4492 -20.4492 -5.4010 -5.4009 -5.2656 -5.2543 -5.1788 -5.1779 -5.0855 -5.0730 2.4891 2.5010 2.5063 2.5132 2.9631 2.9659 3.1741 3.1899 3.2564 3.2818 3.4519 3.4553 3.5596 3.5729 3.6280 3.6350 3.7040 3.7178 4.0992 4.1083 4.2136 4.2161 4.3320 4.3341 4.9138 4.9292 4.9416 4.9807 5.1144 5.1185 5.1564 5.1643 5.2336 5.2689 5.2811 5.2990 5.4980 5.5123 6.4793 6.4844 6.5175 6.5180 6.9877 6.9902 8.5778 8.6093 8.8243 8.8372 9.1631 9.1645 9.7969 9.8364 9.8590 9.8656 12.5405 12.5445 12.5729 12.5742 k = 0.4634 0.4634-0.0000 ( 12504 PWs) bands (ev): -67.2293 -67.2293 -38.6592 -38.6592 -28.9347 -28.9347 -28.8735 -28.8735 -22.7379 -22.7379 -22.6928 -22.6928 -22.6862 -22.6862 -20.5084 -20.5084 -20.4673 -20.4673 -20.4506 -20.4506 -20.4492 -20.4492 -5.4142 -5.4136 -5.2630 -5.2474 -5.1766 -5.1752 -5.0824 -5.0644 2.4750 2.4920 2.5100 2.5206 2.9541 2.9587 3.1713 3.1942 3.2494 3.2855 3.4207 3.4282 3.5732 3.5899 3.6440 3.6575 3.7098 3.7322 4.0997 4.1134 4.2124 4.2164 4.3337 4.3357 4.9117 4.9294 4.9413 4.9945 5.1039 5.1138 5.1607 5.1693 5.2249 5.2656 5.2937 5.3088 5.4977 5.5187 6.4786 6.4865 6.5193 6.5198 6.9779 6.9816 8.5680 8.6151 8.8181 8.8372 9.1600 9.1618 9.7767 9.8379 9.8579 9.8653 12.5279 12.5344 12.5982 12.5998 k = 0.4512 0.4512-0.0000 ( 12494 PWs) bands (ev): -67.2293 -67.2293 -38.6592 -38.6592 -28.9346 -28.9346 -28.8735 -28.8735 -22.7379 -22.7379 -22.6928 -22.6928 -22.6862 -22.6862 -20.5084 -20.5084 -20.4673 -20.4673 -20.4506 -20.4506 -20.4492 -20.4492 -5.4312 -5.4298 -5.2590 -5.2402 -5.1736 -5.1716 -5.0771 -5.0544 2.4569 2.4783 2.5159 2.5301 2.9406 2.9475 3.1696 3.1986 3.2439 3.2882 3.3912 3.4029 3.5876 3.6048 3.6591 3.6757 3.7241 3.7521 4.1009 4.1196 4.2109 4.2164 4.3379 4.3383 4.9101 4.9242 4.9479 5.0090 5.0917 5.1095 5.1657 5.1735 5.2180 5.2635 5.3069 5.3193 5.4988 5.5259 6.4776 6.4884 6.5224 6.5227 6.9649 6.9696 8.5578 8.6199 8.8108 8.8359 9.1561 9.1583 9.7529 9.8377 9.8566 9.8624 12.5108 12.5193 12.6328 12.6350 k = 0.4390 0.4390-0.0000 ( 12492 PWs) bands (ev): -67.2293 -67.2293 -38.6591 -38.6591 -28.9346 -28.9346 -28.8735 -28.8735 -22.7379 -22.7379 -22.6928 -22.6928 -22.6862 -22.6862 -20.5084 -20.5084 -20.4673 -20.4673 -20.4506 -20.4506 -20.4492 -20.4492 -5.4509 -5.4487 -5.2541 -5.2330 -5.1699 -5.1673 -5.0699 -5.0433 2.4351 2.4603 2.5238 2.5416 2.9220 2.9315 3.1691 3.2032 3.2407 3.2905 3.3646 3.3798 3.6041 3.6178 3.6732 3.6857 3.7477 3.7753 4.1028 4.1267 4.2095 4.2161 4.3430 4.3452 4.9089 4.9179 4.9561 5.0225 5.0797 5.1064 5.1706 5.1767 5.2135 5.2631 5.3200 5.3302 5.5011 5.5339 6.4757 6.4896 6.5271 6.5271 6.9488 6.9544 8.5472 8.6237 8.8023 8.8332 9.1516 9.1541 9.7261 9.8363 9.8550 9.8567 12.4893 12.4995 12.6756 12.6788 k = 0.4268 0.4268-0.0000 ( 12520 PWs) bands (ev): -67.2293 -67.2293 -38.6591 -38.6591 -28.9346 -28.9346 -28.8735 -28.8735 -22.7379 -22.7379 -22.6928 -22.6928 -22.6862 -22.6862 -20.5084 -20.5084 -20.4673 -20.4673 -20.4506 -20.4506 -20.4492 -20.4492 -5.4727 -5.4697 -5.2486 -5.2257 -5.1654 -5.1622 -5.0613 -5.0316 2.4100 2.4383 2.5337 2.5549 2.8979 2.9104 3.1699 3.2079 3.2407 3.2932 3.3414 3.3591 3.6229 3.6288 3.6879 3.6916 3.7746 3.7990 4.1053 4.1344 4.2086 4.2160 4.3504 4.3562 4.9079 4.9108 4.9647 5.0303 5.0727 5.1054 5.1743 5.1787 5.2123 5.2644 5.3328 5.3413 5.5048 5.5426 6.4728 6.4897 6.5334 6.5336 6.9301 6.9363 8.5364 8.6267 8.7930 8.8291 9.1468 9.1494 9.6966 9.8334 9.8485 9.8529 12.4634 12.4749 12.7254 12.7298 k = 0.4146 0.4146-0.0000 ( 12530 PWs) bands (ev): -67.2293 -67.2293 -38.6591 -38.6591 -28.9345 -28.9345 -28.8734 -28.8734 -22.7379 -22.7379 -22.6928 -22.6928 -22.6862 -22.6862 -20.5084 -20.5084 -20.4673 -20.4673 -20.4506 -20.4506 -20.4492 -20.4492 -5.4959 -5.4924 -5.2425 -5.2185 -5.1603 -5.1566 -5.0515 -5.0194 2.3820 2.4127 2.5453 2.5699 2.8689 2.8840 3.1718 3.2124 3.2445 3.2974 3.3217 3.3404 3.6373 3.6433 3.6967 3.7043 3.8006 3.8209 4.1085 4.1426 4.2092 4.2167 4.3609 4.3711 4.9029 4.9072 4.9729 5.0250 5.0777 5.1071 5.1759 5.1796 5.2156 5.2673 5.3451 5.3523 5.5097 5.5519 6.4687 6.4884 6.5416 6.5418 6.9093 6.9158 8.5256 8.6289 8.7828 8.8237 9.1419 9.1446 9.6650 9.8273 9.8395 9.8501 12.4332 12.4457 12.7805 12.7867 k = 0.4024 0.4024-0.0000 ( 12524 PWs) bands (ev): -67.2293 -67.2293 -38.6591 -38.6591 -28.9345 -28.9345 -28.8734 -28.8734 -22.7379 -22.7379 -22.6928 -22.6928 -22.6862 -22.6862 -20.5084 -20.5084 -20.4673 -20.4673 -20.4506 -20.4506 -20.4492 -20.4492 -5.5204 -5.5164 -5.2360 -5.2110 -5.1545 -5.1504 -5.0411 -5.0072 2.3515 2.3840 2.5584 2.5863 2.8355 2.8527 3.1745 3.2164 3.2525 3.3033 3.3057 3.3234 3.6440 3.6643 3.7026 3.7223 3.8234 3.8393 4.1129 4.1512 4.2119 4.2192 4.3749 4.3898 4.8937 4.9067 4.9803 5.0106 5.0903 5.1120 5.1758 5.1795 5.2229 5.2718 5.3569 5.3631 5.5158 5.5618 6.4632 6.4858 6.5516 6.5518 6.8868 6.8934 8.5150 8.6302 8.7719 8.8169 9.1371 9.1398 9.6315 9.8149 9.8331 9.8464 12.3989 12.4119 12.8394 12.8476 k = 0.3902 0.3902-0.0000 ( 12520 PWs) bands (ev): -67.2293 -67.2293 -38.6591 -38.6591 -28.9344 -28.9344 -28.8734 -28.8734 -22.7379 -22.7379 -22.6928 -22.6928 -22.6862 -22.6862 -20.5084 -20.5084 -20.4673 -20.4673 -20.4506 -20.4506 -20.4492 -20.4492 -5.5457 -5.5414 -5.2291 -5.2034 -5.1481 -5.1436 -5.0303 -4.9951 2.3188 2.3525 2.5730 2.6038 2.7988 2.8172 3.1777 3.2197 3.2644 3.2906 3.3077 3.3137 3.6495 3.6832 3.7122 3.7407 3.8419 3.8538 4.1191 4.1602 4.2171 4.2243 4.3924 4.4122 4.8831 4.9064 4.9867 4.9928 5.1042 5.1200 5.1756 5.1787 5.2332 5.2774 5.3679 5.3735 5.5230 5.5722 6.4563 6.4818 6.5631 6.5633 6.8633 6.8694 8.5049 8.6308 8.7606 8.8089 9.1325 9.1353 9.5966 9.7975 9.8279 9.8418 12.3605 12.3735 12.8999 12.9106 k = 0.3780 0.3780-0.0000 ( 12520 PWs) bands (ev): -67.2293 -67.2293 -38.6591 -38.6591 -28.9344 -28.9344 -28.8734 -28.8734 -22.7379 -22.7379 -22.6928 -22.6928 -22.6862 -22.6862 -20.5084 -20.5084 -20.4673 -20.4673 -20.4506 -20.4506 -20.4492 -20.4492 -5.5717 -5.5673 -5.2217 -5.1954 -5.1411 -5.1363 -5.0195 -4.9832 2.2842 2.3186 2.5886 2.6216 2.7601 2.7783 3.1812 3.2222 3.2782 3.2797 3.2934 3.3262 3.6544 3.6959 3.7287 3.7581 3.8555 3.8648 4.1276 4.1700 4.2247 4.2325 4.4133 4.4379 4.8712 4.9063 4.9735 4.9922 5.1170 5.1308 5.1764 5.1775 5.2455 5.2838 5.3782 5.3834 5.5313 5.5833 6.4478 6.4764 6.5759 6.5763 6.8392 6.8446 8.4953 8.6308 8.7490 8.7999 9.1282 9.1311 9.5608 9.7770 9.8226 9.8361 12.3180 12.3305 12.9599 12.9735 k = 0.3659 0.3659-0.0000 ( 12512 PWs) bands (ev): -67.2293 -67.2293 -38.6591 -38.6591 -28.9343 -28.9343 -28.8734 -28.8734 -22.7379 -22.7379 -22.6928 -22.6928 -22.6862 -22.6862 -20.5084 -20.5084 -20.4673 -20.4673 -20.4506 -20.4506 -20.4492 -20.4492 -5.5982 -5.5937 -5.2139 -5.1871 -5.1335 -5.1285 -5.0088 -4.9718 2.2481 2.2827 2.6052 2.6378 2.7218 2.7369 3.1848 3.2241 3.2672 3.2786 3.2993 3.3413 3.6591 3.7040 3.7505 3.7728 3.8646 3.8737 4.1388 4.1810 4.2348 4.2436 4.4374 4.4666 4.8578 4.9065 4.9532 4.9971 5.1271 5.1436 5.1764 5.1797 5.2591 5.2908 5.3878 5.3926 5.5407 5.5951 6.4375 6.4693 6.5900 6.5905 6.8153 6.8194 8.4865 8.6302 8.7373 8.7899 9.1241 9.1272 9.5243 9.7540 9.8164 9.8292 12.2716 12.2832 13.0171 13.0339 k = 0.3537 0.3537-0.0000 ( 12518 PWs) bands (ev): -67.2293 -67.2293 -38.6591 -38.6591 -28.9343 -28.9343 -28.8733 -28.8733 -22.7379 -22.7379 -22.6928 -22.6928 -22.6862 -22.6862 -20.5084 -20.5084 -20.4673 -20.4673 -20.4506 -20.4506 -20.4492 -20.4492 -5.6250 -5.6205 -5.2056 -5.1785 -5.1254 -5.1203 -4.9983 -4.9610 2.2107 2.2452 2.6223 2.6423 2.6938 2.6946 3.1886 3.2254 3.2575 3.2656 3.3203 3.3581 3.6641 3.7106 3.7736 3.7827 3.8703 3.8831 4.1523 4.1935 4.2472 4.2573 4.4645 4.4979 4.8433 4.9068 4.9322 5.0017 5.1339 5.1576 5.1755 5.1860 5.2736 5.2980 5.3966 5.4009 5.5513 5.6077 6.4254 6.4606 6.6050 6.6058 6.7920 6.7945 8.4788 8.6291 8.7260 8.7793 9.1203 9.1236 9.4877 9.7289 9.8094 9.8210 12.2213 12.2316 13.0694 13.0897 k = 0.3415 0.3415-0.0000 ( 12524 PWs) bands (ev): -67.2293 -67.2293 -38.6591 -38.6591 -28.9342 -28.9342 -28.8733 -28.8733 -22.7379 -22.7379 -22.6928 -22.6928 -22.6862 -22.6862 -20.5084 -20.5084 -20.4673 -20.4673 -20.4506 -20.4506 -20.4492 -20.4492 -5.6519 -5.6476 -5.1970 -5.1695 -5.1168 -5.1116 -4.9882 -4.9507 2.1722 2.2065 2.6154 2.6375 2.6518 2.6984 3.1925 3.2260 3.2492 3.2530 3.3431 3.3758 3.6694 3.7170 3.7870 3.7958 3.8743 3.8948 4.1680 4.2074 4.2615 4.2731 4.4942 4.5313 4.8277 4.9071 4.9112 5.0063 5.1378 5.1721 5.1750 5.1948 5.2883 5.3054 5.4047 5.4085 5.5631 5.6214 6.4112 6.4499 6.6209 6.6219 6.7700 6.7704 8.4723 8.6274 8.7150 8.7682 9.1167 9.1202 9.4512 9.7021 9.8013 9.8115 12.1673 12.1758 13.1148 13.1387 k = 0.3293 0.3293-0.0000 ( 12526 PWs) bands (ev): -67.2293 -67.2293 -38.6591 -38.6591 -28.9341 -28.9341 -28.8733 -28.8733 -22.7379 -22.7379 -22.6928 -22.6928 -22.6862 -22.6862 -20.5084 -20.5084 -20.4673 -20.4673 -20.4506 -20.4506 -20.4492 -20.4492 -5.6789 -5.6748 -5.1880 -5.1602 -5.1077 -5.1024 -4.9786 -4.9411 2.1329 2.1667 2.5748 2.6030 2.6589 2.7155 3.1965 3.2256 3.2410 3.2428 3.3668 3.3934 3.6752 3.7237 3.7866 3.8150 3.8796 3.9091 4.1853 4.2225 4.2779 4.2907 4.5260 4.5664 4.8113 4.8888 4.9087 5.0109 5.1399 5.1752 5.1864 5.2053 5.3028 5.3128 5.4123 5.4152 5.5763 5.6364 6.3950 6.4371 6.6374 6.6386 6.7477 6.7497 8.4671 8.6253 8.7048 8.7568 9.1131 9.1168 9.4151 9.6739 9.7921 9.8007 12.1096 12.1161 13.1517 13.1794 k = 0.3171 0.3171-0.0000 ( 12523 PWs) bands (ev): -67.2293 -67.2293 -38.6591 -38.6590 -28.9340 -28.9340 -28.8733 -28.8733 -22.7379 -22.7379 -22.6928 -22.6928 -22.6862 -22.6862 -20.5084 -20.5084 -20.4673 -20.4673 -20.4506 -20.4506 -20.4492 -20.4492 -5.7059 -5.7019 -5.1786 -5.1506 -5.0982 -5.0929 -4.9694 -4.9321 2.0931 2.1262 2.5316 2.5579 2.6762 2.7350 3.2004 3.2232 3.2295 3.2393 3.3904 3.4098 3.6816 3.7307 3.7839 3.8297 3.8890 3.9250 4.2038 4.2386 4.2961 4.3098 4.5596 4.6025 4.7943 4.8670 4.9099 5.0156 5.1413 5.1762 5.1998 5.2164 5.3167 5.3202 5.4195 5.4211 5.5910 5.6528 6.3767 6.4220 6.6542 6.6554 6.7268 6.7319 8.4634 8.6228 8.6955 8.7453 9.1095 9.1133 9.3800 9.6447 9.7817 9.7884 12.0484 12.0526 13.1793 13.2111 k = 0.3049 0.3049-0.0000 ( 12523 PWs) bands (ev): -67.2293 -67.2293 -38.6590 -38.6590 -28.9340 -28.9340 -28.8732 -28.8732 -22.7379 -22.7379 -22.6928 -22.6928 -22.6862 -22.6862 -20.5084 -20.5084 -20.4673 -20.4673 -20.4506 -20.4506 -20.4492 -20.4492 -5.7326 -5.7289 -5.1689 -5.1408 -5.0883 -5.0831 -4.9608 -4.9239 2.0530 2.0852 2.4878 2.5127 2.6932 2.7547 3.2044 3.2188 3.2190 3.2386 3.4127 3.4240 3.6884 3.7382 3.7813 3.8401 3.9034 3.9412 4.2233 4.2556 4.3161 4.3301 4.5941 4.6389 4.7772 4.8454 4.9116 5.0205 5.1425 5.1780 5.2117 5.2278 5.3276 5.3296 5.4264 5.4265 5.6075 5.6708 6.3565 6.4048 6.6706 6.6707 6.7088 6.7178 8.4613 8.6197 8.6873 8.7339 9.1057 9.1096 9.3460 9.6146 9.7702 9.7747 11.9838 11.9855 13.1971 13.2336 k = 0.2927 0.2927-0.0000 ( 12519 PWs) bands (ev): -67.2293 -67.2293 -38.6590 -38.6590 -28.9339 -28.9339 -28.8732 -28.8732 -22.7379 -22.7379 -22.6928 -22.6928 -22.6862 -22.6862 -20.5084 -20.5084 -20.4673 -20.4673 -20.4506 -20.4506 -20.4492 -20.4492 -5.7591 -5.7556 -5.1589 -5.1307 -5.0781 -5.0730 -4.9527 -4.9163 2.0126 2.0439 2.4442 2.4677 2.7096 2.7739 3.2081 3.2091 3.2144 3.2395 3.4323 3.4350 3.6957 3.7462 3.7811 3.8493 3.9207 3.9572 4.2434 4.2733 4.3379 4.3512 4.6281 4.6742 4.7612 4.8253 4.9135 5.0254 5.1439 5.1809 5.2217 5.2390 5.3350 5.3410 5.4312 5.4336 5.6260 5.6908 6.3346 6.3854 6.6788 6.6802 6.6997 6.7130 8.4608 8.6163 8.6802 8.7228 9.1015 9.1054 9.3136 9.5841 9.7574 9.7597 11.9150 11.9158 13.2052 13.2475 k = 0.2805 0.2805-0.0000 ( 12523 PWs) bands (ev): -67.2293 -67.2293 -38.6590 -38.6590 -28.9338 -28.9338 -28.8732 -28.8732 -22.7379 -22.7379 -22.6928 -22.6928 -22.6862 -22.6862 -20.5083 -20.5083 -20.4673 -20.4673 -20.4506 -20.4506 -20.4492 -20.4492 -5.7852 -5.7820 -5.1487 -5.1206 -5.0676 -5.0626 -4.9452 -4.9094 1.9724 2.0026 2.4012 2.4234 2.7249 2.7920 3.2000 3.2103 3.2122 3.2411 3.4421 3.4479 3.7033 3.7546 3.7853 3.8600 3.9390 3.9722 4.2640 4.2917 4.3616 4.3732 4.6582 4.7047 4.7492 4.8100 4.9156 5.0304 5.1457 5.1848 5.2295 5.2499 5.3424 5.3506 5.4360 5.4408 5.6468 5.7128 6.3112 6.3641 6.6707 6.6742 6.7117 6.7228 8.4620 8.6125 8.6743 8.7121 9.0967 9.1006 9.2832 9.5534 9.7434 9.7434 11.8414 11.8448 13.2044 13.2506 k = 0.2683 0.2683-0.0000 ( 12529 PWs) bands (ev): -67.2293 -67.2293 -38.6590 -38.6590 -28.9337 -28.9337 -28.8732 -28.8732 -22.7379 -22.7379 -22.6928 -22.6928 -22.6862 -22.6862 -20.5083 -20.5083 -20.4673 -20.4673 -20.4506 -20.4506 -20.4492 -20.4492 -5.8108 -5.8079 -5.1383 -5.1103 -5.0569 -5.0520 -4.9381 -4.9031 1.9323 1.9615 2.3590 2.3800 2.7391 2.8087 3.1923 3.2071 3.2159 3.2431 3.4451 3.4584 3.7116 3.7635 3.7950 3.8737 3.9570 3.9863 4.2849 4.3108 4.3870 4.3958 4.6747 4.7209 4.7510 4.8087 4.9178 5.0353 5.1480 5.1897 5.2350 5.2603 5.3496 5.3583 5.4411 5.4483 5.6700 5.7369 6.2867 6.3412 6.6580 6.6647 6.7287 6.7390 8.4648 8.6085 8.6692 8.7020 9.0912 9.0951 9.2552 9.5228 9.7258 9.7284 11.7648 11.7707 13.1963 13.2298 k = 0.2561 0.2561-0.0000 ( 12535 PWs) bands (ev): -67.2293 -67.2293 -38.6590 -38.6590 -28.9336 -28.9336 -28.8731 -28.8731 -22.7379 -22.7379 -22.6928 -22.6928 -22.6862 -22.6862 -20.5083 -20.5083 -20.4673 -20.4673 -20.4506 -20.4506 -20.4492 -20.4492 -5.8359 -5.8333 -5.1277 -5.1000 -5.0460 -5.0414 -4.9316 -4.8975 1.8926 1.9207 2.3177 2.3375 2.7517 2.8236 3.1859 3.2049 3.2195 3.2454 3.4440 3.4634 3.7206 3.7727 3.8103 3.8906 3.9742 3.9992 4.3058 4.3305 4.4141 4.4189 4.6702 4.7153 4.7733 4.8286 4.9201 5.0401 5.1511 5.1958 5.2382 5.2702 5.3568 5.3639 5.4467 5.4562 5.6961 5.7634 6.2612 6.3169 6.6460 6.6547 6.7462 6.7567 8.4690 8.6044 8.6648 8.6924 9.0848 9.0888 9.2301 9.4927 9.7071 9.7122 11.6855 11.6939 13.1832 13.2123 k = 0.2439 0.2439-0.0000 ( 12543 PWs) bands (ev): -67.2293 -67.2293 -38.6590 -38.6590 -28.9335 -28.9335 -28.8731 -28.8731 -22.7379 -22.7379 -22.6928 -22.6928 -22.6862 -22.6862 -20.5083 -20.5083 -20.4673 -20.4673 -20.4506 -20.4506 -20.4492 -20.4492 -5.8603 -5.8580 -5.1171 -5.0898 -5.0350 -5.0306 -4.9255 -4.8925 1.8536 1.8804 2.2776 2.2962 2.7628 2.8365 3.1810 3.2038 3.2230 3.2479 3.4393 3.4633 3.7305 3.7822 3.8305 3.9104 3.9905 4.0111 4.3267 4.3508 4.4424 4.4428 4.6551 4.6976 4.8059 4.8599 4.9223 5.0446 5.1549 5.2029 5.2394 5.2791 5.3638 5.3679 5.4532 5.4645 5.7251 5.7922 6.2352 6.2917 6.6350 6.6451 6.7635 6.7745 8.4747 8.6005 8.6606 8.6834 9.0772 9.0815 9.2083 9.4634 9.6873 9.6951 11.6037 11.6145 13.1675 13.1964 k = 0.2317 0.2317-0.0000 ( 12551 PWs) bands (ev): -67.2293 -67.2293 -38.6589 -38.6589 -28.9335 -28.9335 -28.8731 -28.8731 -22.7379 -22.7379 -22.6928 -22.6928 -22.6862 -22.6862 -20.5083 -20.5083 -20.4673 -20.4673 -20.4506 -20.4506 -20.4492 -20.4492 -5.8841 -5.8820 -5.1064 -5.0796 -5.0240 -5.0198 -4.9199 -4.8880 1.8152 1.8408 2.2388 2.2562 2.7721 2.8470 3.1779 3.2039 3.2263 3.2506 3.4317 3.4590 3.7412 3.7920 3.8543 3.9322 4.0059 4.0222 4.3475 4.3715 4.4659 4.4729 4.6368 4.6757 4.8411 4.8944 4.9244 5.0490 5.1596 5.2110 5.2388 5.2868 5.3705 5.3709 5.4605 5.4732 5.7571 5.8234 6.2088 6.2657 6.6248 6.6360 6.7804 6.7921 8.4815 8.5969 8.6564 8.6751 9.0682 9.0732 9.1903 9.4352 9.6668 9.6770 11.5199 11.5328 13.1506 13.1822 k = 0.2195 0.2195-0.0000 ( 12545 PWs) bands (ev): -67.2293 -67.2293 -38.6589 -38.6589 -28.9334 -28.9334 -28.8730 -28.8730 -22.7379 -22.7378 -22.6928 -22.6928 -22.6862 -22.6862 -20.5083 -20.5083 -20.4673 -20.4673 -20.4506 -20.4505 -20.4492 -20.4492 -5.9070 -5.9052 -5.0958 -5.0696 -5.0130 -5.0091 -4.9146 -4.8841 1.7778 1.8021 2.2014 2.2176 2.7797 2.8549 3.1765 3.2051 3.2294 3.2536 3.4219 3.4516 3.7526 3.8020 3.8804 3.9547 4.0208 4.0329 4.3680 4.3926 4.4888 4.5040 4.6181 4.6524 4.8765 4.9260 4.9292 5.0532 5.1653 5.2200 5.2367 5.2926 5.3738 5.3771 5.4685 5.4823 5.7922 5.8569 6.1821 6.2393 6.6152 6.6273 6.7969 6.8092 8.4892 8.5938 8.6518 8.6675 9.0578 9.0637 9.1764 9.4085 9.6455 9.6582 11.4342 11.4491 13.1335 13.1694 k = 0.2073 0.2073-0.0000 ( 12549 PWs) bands (ev): -67.2293 -67.2293 -38.6589 -38.6589 -28.9333 -28.9333 -28.8730 -28.8730 -22.7378 -22.7378 -22.6928 -22.6928 -22.6862 -22.6862 -20.5083 -20.5083 -20.4673 -20.4673 -20.4506 -20.4505 -20.4492 -20.4492 -5.9291 -5.9275 -5.0853 -5.0599 -5.0022 -4.9985 -4.9098 -4.8807 1.7413 1.7645 2.1655 2.1805 2.7857 2.8603 3.1769 3.2073 3.2323 3.2566 3.4108 3.4422 3.7646 3.8122 3.9072 3.9765 4.0359 4.0434 4.3882 4.4137 4.5095 4.5358 4.6018 4.6293 4.9108 4.9276 4.9626 5.0572 5.1719 5.2298 5.2336 5.2960 5.3777 5.3837 5.4773 5.4918 5.8303 5.8929 6.1554 6.2125 6.6061 6.6188 6.8126 6.8256 8.4976 8.5911 8.6466 8.6604 9.0461 9.0532 9.1667 9.3836 9.6237 9.6388 11.3471 11.3638 13.1168 13.1580 k = 0.1951 0.1951-0.0000 ( 12567 PWs) bands (ev): -67.2293 -67.2293 -38.6589 -38.6589 -28.9332 -28.9332 -28.8730 -28.8730 -22.7378 -22.7378 -22.6928 -22.6928 -22.6862 -22.6862 -20.5083 -20.5083 -20.4673 -20.4673 -20.4506 -20.4505 -20.4492 -20.4492 -5.9503 -5.9489 -5.0750 -5.0505 -4.9914 -4.9880 -4.9053 -4.8777 1.7061 1.7280 2.1312 2.1451 2.7900 2.8633 3.1790 3.2103 3.2351 3.2598 3.3988 3.4316 3.7768 3.8223 3.9334 3.9965 4.0517 4.0543 4.4076 4.4340 4.5233 4.5669 4.5931 4.6082 4.9288 4.9430 4.9939 5.0614 5.1796 5.2291 5.2406 5.2967 5.3837 5.3905 5.4865 5.5017 5.8712 5.9312 6.1289 6.1856 6.5972 6.6103 6.8276 6.8411 8.5064 8.5890 8.6406 8.6540 9.0331 9.0415 9.1613 9.3611 9.6016 9.6189 11.2590 11.2771 13.1009 13.1476 k = 0.1829 0.1829-0.0000 ( 12561 PWs) bands (ev): -67.2293 -67.2293 -38.6589 -38.6589 -28.9331 -28.9331 -28.8729 -28.8729 -22.7378 -22.7378 -22.6928 -22.6928 -22.6862 -22.6862 -20.5083 -20.5083 -20.4673 -20.4673 -20.4506 -20.4505 -20.4492 -20.4492 -5.9705 -5.9693 -5.0649 -5.0414 -4.9809 -4.9778 -4.9010 -4.8752 1.6723 1.6928 2.0986 2.1113 2.7928 2.8639 3.1825 3.2139 3.2376 3.2630 3.3866 3.4206 3.7893 3.8323 3.9577 4.0135 4.0661 4.0688 4.4251 4.4517 4.5254 4.5804 4.5994 4.6073 4.9298 4.9725 5.0225 5.0659 5.1881 5.2242 5.2516 5.2946 5.3921 5.3975 5.4962 5.5121 5.9148 5.9716 6.1025 6.1588 6.5885 6.6019 6.8417 6.8557 8.5153 8.5873 8.6337 8.6481 9.0192 9.0287 9.1598 9.3412 9.5793 9.5987 11.1702 11.1896 13.0861 13.1379 k = 0.1707 0.1707-0.0000 ( 12557 PWs) bands (ev): -67.2293 -67.2293 -38.6589 -38.6589 -28.9331 -28.9331 -28.8729 -28.8729 -22.7378 -22.7378 -22.6928 -22.6928 -22.6862 -22.6862 -20.5083 -20.5083 -20.4673 -20.4673 -20.4506 -20.4505 -20.4492 -20.4492 -5.9897 -5.9887 -5.0551 -5.0328 -4.9707 -4.9678 -4.8971 -4.8730 1.6399 1.6591 2.0678 2.0794 2.7944 2.8626 3.1871 3.2180 3.2398 3.2662 3.3746 3.4096 3.8018 3.8421 3.9792 4.0276 4.0791 4.0869 4.4384 4.4609 4.5244 4.5683 4.6172 4.6366 4.9309 4.9983 5.0477 5.0714 5.1974 5.2188 5.2627 5.2902 5.4031 5.4052 5.5062 5.5230 5.9603 6.0138 6.0768 6.1321 6.5800 6.5935 6.8548 6.8691 8.5239 8.5861 8.6260 8.6425 9.0046 9.0148 9.1623 9.3243 9.5572 9.5783 11.0814 11.1018 13.0726 13.1286 k = 0.1585 0.1585-0.0000 ( 12573 PWs) bands (ev): -67.2293 -67.2293 -38.6589 -38.6589 -28.9330 -28.9330 -28.8729 -28.8729 -22.7378 -22.7378 -22.6928 -22.6928 -22.6862 -22.6862 -20.5083 -20.5083 -20.4673 -20.4673 -20.4505 -20.4505 -20.4492 -20.4492 -6.0078 -6.0069 -5.0456 -5.0247 -4.9608 -4.9582 -4.8934 -4.8711 1.6091 1.6270 2.0387 2.0494 2.7950 2.8596 3.1926 3.2222 3.2418 3.2691 3.3633 3.3990 3.8141 3.8515 3.9974 4.0394 4.0935 4.1052 4.4435 4.4551 4.5339 4.5628 4.6396 4.6678 4.9324 5.0195 5.0691 5.0786 5.2070 5.2131 5.2734 5.2843 5.4137 5.4166 5.5163 5.5344 6.0057 6.0537 6.0572 6.1062 6.5715 6.5849 6.8668 6.8814 8.5318 8.5850 8.6177 8.6373 8.9893 9.0000 9.1684 9.3109 9.5354 9.5579 10.9930 11.0141 13.0607 13.1194 k = 0.1463 0.1463-0.0000 ( 12561 PWs) bands (ev): -67.2293 -67.2293 -38.6589 -38.6589 -28.9329 -28.9329 -28.8729 -28.8729 -22.7378 -22.7378 -22.6928 -22.6928 -22.6862 -22.6862 -20.5083 -20.5083 -20.4673 -20.4673 -20.4505 -20.4505 -20.4492 -20.4492 -6.0247 -6.0240 -5.0366 -5.0171 -4.9513 -4.9490 -4.8899 -4.8696 1.5801 1.5967 2.0116 2.0212 2.7947 2.8552 3.1986 3.2265 3.2434 3.2715 3.3531 3.3892 3.8261 3.8605 4.0126 4.0497 4.1089 4.1227 4.4379 4.4389 4.5522 4.5687 4.6632 4.6977 4.9348 5.0354 5.0867 5.0881 5.2072 5.2165 5.2775 5.2834 5.4235 5.4321 5.5265 5.5462 6.0189 6.0648 6.0761 6.1063 6.5632 6.5763 6.8778 6.8925 8.5389 8.5840 8.6094 8.6323 8.9735 8.9843 9.1778 9.3012 9.5142 9.5378 10.9057 10.9272 13.0504 13.1096 k = 0.1341 0.1341-0.0000 ( 12549 PWs) bands (ev): -67.2293 -67.2293 -38.6588 -38.6588 -28.9329 -28.9329 -28.8729 -28.8728 -22.7378 -22.7378 -22.6928 -22.6928 -22.6862 -22.6862 -20.5083 -20.5083 -20.4673 -20.4673 -20.4505 -20.4505 -20.4492 -20.4492 -6.0405 -6.0399 -5.0280 -5.0101 -4.9424 -4.9403 -4.8867 -4.8682 1.5530 1.5682 1.9865 1.9951 2.7937 2.8499 3.2049 3.2307 3.2447 3.2730 3.3446 3.3804 3.8377 3.8688 4.0255 4.0593 4.1246 4.1389 4.4185 4.4237 4.5740 4.5842 4.6870 4.7255 4.9388 5.0464 5.0995 5.1007 5.2011 5.2247 5.2708 5.2921 5.4346 5.4495 5.5365 5.5583 5.9971 6.0518 6.1124 6.1509 6.5551 6.5677 6.8876 6.9022 8.5449 8.5823 8.6016 8.6273 8.9573 8.9681 9.1904 9.2954 9.4937 9.5182 10.8200 10.8417 13.0418 13.0986 k = 0.1220 0.1220-0.0000 ( 12541 PWs) bands (ev): -67.2293 -67.2293 -38.6588 -38.6588 -28.9328 -28.9328 -28.8728 -28.8728 -22.7378 -22.7378 -22.6928 -22.6928 -22.6862 -22.6862 -20.5083 -20.5083 -20.4673 -20.4673 -20.4505 -20.4505 -20.4492 -20.4492 -6.0550 -6.0546 -5.0200 -5.0038 -4.9339 -4.9321 -4.8836 -4.8671 1.5279 1.5417 1.9634 1.9711 2.7924 2.8439 3.2111 3.2346 3.2455 3.2732 3.3382 3.3727 3.8487 3.8765 4.0370 4.0686 4.1397 4.1534 4.3967 4.4049 4.5969 4.6052 4.7101 4.7500 4.9451 5.0542 5.1114 5.1116 5.1949 5.2298 5.2661 5.2992 5.4471 5.4682 5.5461 5.5706 5.9738 6.0267 6.1626 6.1970 6.5472 6.5590 6.8963 6.9107 8.5496 8.5790 8.5956 8.6223 8.9409 8.9514 9.2058 9.2935 9.4742 9.4992 10.7367 10.7583 13.0349 13.0858 k = 0.1098 0.1098-0.0000 ( 12541 PWs) bands (ev): -67.2293 -67.2293 -38.6588 -38.6588 -28.9327 -28.9327 -28.8728 -28.8728 -22.7378 -22.7378 -22.6928 -22.6928 -22.6862 -22.6862 -20.5083 -20.5083 -20.4673 -20.4673 -20.4505 -20.4505 -20.4492 -20.4492 -6.0683 -6.0679 -5.0126 -4.9980 -4.9261 -4.9245 -4.8808 -4.8662 1.5048 1.5173 1.9423 1.9491 2.7908 2.8375 3.2171 3.2382 3.2460 3.2719 3.3341 3.3661 3.8588 3.8833 4.0478 4.0779 4.1538 4.1661 4.3745 4.3840 4.6197 4.6289 4.7322 4.7702 4.9545 5.0600 5.1194 5.1233 5.1886 5.2296 5.2656 5.3046 5.4607 5.4877 5.5551 5.5829 5.9512 6.0023 6.2126 6.2428 6.5398 6.5506 6.9038 6.9178 8.5528 8.5735 8.5920 8.6173 8.9247 8.9347 9.2235 9.2954 9.4559 9.4811 10.6566 10.6777 13.0293 13.0705 k = 0.0976 0.0976-0.0000 ( 12551 PWs) bands (ev): -67.2293 -67.2293 -38.6588 -38.6588 -28.9327 -28.9327 -28.8728 -28.8728 -22.7378 -22.7378 -22.6928 -22.6928 -22.6862 -22.6862 -20.5083 -20.5083 -20.4673 -20.4673 -20.4505 -20.4505 -20.4492 -20.4492 -6.0803 -6.0800 -5.0058 -4.9930 -4.9189 -4.9175 -4.8781 -4.8655 1.4840 1.4951 1.9234 1.9293 2.7893 2.8309 3.2227 3.2415 3.2461 3.2692 3.3322 3.3608 3.8681 3.8893 4.0585 4.0877 4.1665 4.1768 4.3523 4.3624 4.6418 4.6536 4.7529 4.7856 4.9675 5.0649 5.1251 5.1340 5.1820 5.2241 5.2692 5.3085 5.4749 5.5073 5.5632 5.5947 5.9300 5.9788 6.2614 6.2872 6.5330 6.5424 6.9102 6.9236 8.5546 8.5669 8.5901 8.6123 8.9088 8.9183 9.2430 9.3006 9.4391 9.4643 10.5804 10.6008 13.0244 13.0527 k = 0.0854 0.0854-0.0000 ( 12565 PWs) bands (ev): -67.2293 -67.2293 -38.6588 -38.6588 -28.9326 -28.9326 -28.8728 -28.8728 -22.7378 -22.7378 -22.6928 -22.6928 -22.6862 -22.6862 -20.5083 -20.5083 -20.4673 -20.4673 -20.4505 -20.4505 -20.4492 -20.4492 -6.0909 -6.0907 -4.9997 -4.9886 -4.9124 -4.9112 -4.8757 -4.8649 1.4655 1.4752 1.9066 1.9117 2.7878 2.8243 3.2276 3.2443 3.2460 3.2654 3.3321 3.3566 3.8764 3.8944 4.0695 4.0979 4.1777 4.1855 4.3306 4.3408 4.6628 4.6783 4.7719 4.7962 4.9838 5.0692 5.1290 5.1434 5.1751 5.2159 5.2746 5.3109 5.4892 5.5266 5.5703 5.6058 5.9105 5.9565 6.3079 6.3291 6.5270 6.5347 6.9156 6.9282 8.5551 8.5602 8.5886 8.6073 8.8939 8.9026 9.2637 9.3086 9.4239 9.4489 10.5090 10.5284 13.0189 13.0327 k = 0.0732 0.0732-0.0000 ( 12563 PWs) bands (ev): -67.2293 -67.2293 -38.6588 -38.6588 -28.9326 -28.9326 -28.8728 -28.8728 -22.7378 -22.7378 -22.6928 -22.6928 -22.6862 -22.6862 -20.5083 -20.5083 -20.4673 -20.4673 -20.4505 -20.4505 -20.4492 -20.4492 -6.1002 -6.1000 -4.9943 -4.9849 -4.9066 -4.9057 -4.8734 -4.8645 1.4493 1.4577 1.8920 1.8964 2.7866 2.8180 3.2318 3.2460 3.2466 3.2612 3.3332 3.3533 3.8836 3.8986 4.0811 4.1088 4.1872 4.1921 4.3098 4.3197 4.6822 4.7018 4.7890 4.8029 5.0023 5.0735 5.1313 5.1510 5.1686 5.2067 5.2803 5.3122 5.5032 5.5446 5.5763 5.6156 5.8934 5.9358 6.3510 6.3676 6.5221 6.5277 6.9201 6.9316 8.5543 8.5543 8.5871 8.6024 8.8801 8.8879 9.2850 9.3184 9.4108 9.4353 10.4436 10.4615 13.0105 13.0117 k = 0.0610 0.0610-0.0000 ( 12565 PWs) bands (ev): -67.2293 -67.2293 -38.6588 -38.6588 -28.9326 -28.9326 -28.8727 -28.8727 -22.7378 -22.7378 -22.6928 -22.6928 -22.6862 -22.6862 -20.5083 -20.5083 -20.4673 -20.4673 -20.4505 -20.4505 -20.4492 -20.4492 -6.1081 -6.1080 -4.9896 -4.9819 -4.9017 -4.9009 -4.8715 -4.8642 1.4357 1.4426 1.8797 1.8833 2.7858 2.8119 3.2350 3.2462 3.2483 3.2571 3.3349 3.3509 3.8897 3.9018 4.0934 4.1204 4.1949 4.1965 4.2903 4.2994 4.6999 4.7233 4.8035 4.8068 5.0220 5.0779 5.1323 5.1531 5.1658 5.1976 5.2857 5.3126 5.5163 5.5602 5.5818 5.6238 5.8789 5.9168 6.3895 6.4013 6.5188 6.5217 6.9237 6.9339 8.5493 8.5526 8.5855 8.5975 8.8680 8.8748 9.3057 9.3288 9.4000 9.4240 10.3851 10.4011 12.9911 12.9972 k = 0.0488 0.0488-0.0000 ( 12573 PWs) bands (ev): -67.2293 -67.2293 -38.6588 -38.6588 -28.9325 -28.9325 -28.8727 -28.8727 -22.7378 -22.7378 -22.6928 -22.6928 -22.6862 -22.6862 -20.5083 -20.5083 -20.4673 -20.4673 -20.4505 -20.4505 -20.4492 -20.4492 -6.1146 -6.1145 -4.9856 -4.9795 -4.8976 -4.8970 -4.8697 -4.8641 1.4245 1.4301 1.8696 1.8725 2.7854 2.8064 3.2371 3.2471 3.2489 3.2539 3.3369 3.3490 3.8947 3.9042 4.1064 4.1326 4.1982 4.2008 4.2728 4.2805 4.7157 4.7414 4.8095 4.8153 5.0415 5.0828 5.1318 5.1470 5.1691 5.1895 5.2907 5.3123 5.5285 5.5708 5.5889 5.6297 5.8676 5.9000 6.4221 6.4289 6.5174 6.5175 6.9267 6.9353 8.5454 8.5502 8.5838 8.5930 8.8579 8.8635 9.3246 9.3384 9.3921 9.4153 10.3349 10.3486 12.9722 12.9806 k = 0.0366 0.0366-0.0000 ( 12567 PWs) bands (ev): -67.2293 -67.2293 -38.6588 -38.6588 -28.9325 -28.9325 -28.8727 -28.8727 -22.7378 -22.7378 -22.6928 -22.6928 -22.6862 -22.6862 -20.5083 -20.5083 -20.4673 -20.4673 -20.4505 -20.4505 -20.4492 -20.4492 -6.1196 -6.1196 -4.9824 -4.9778 -4.8943 -4.8939 -4.8682 -4.8641 1.4159 1.4201 1.8619 1.8639 2.7857 2.8014 3.2383 3.2475 3.2484 3.2528 3.3388 3.3475 3.8988 3.9058 4.1202 4.1453 4.1964 4.2043 4.2583 4.2635 4.7295 4.7544 4.8126 4.8238 5.0600 5.0885 5.1293 5.1381 5.1731 5.1833 5.2951 5.3113 5.5394 5.5743 5.5992 5.6331 5.8598 5.8855 6.4471 6.4491 6.5155 6.5185 6.9291 6.9359 8.5427 8.5476 8.5822 8.5889 8.8501 8.8544 9.3397 9.3459 9.3882 9.4095 10.2943 10.3052 12.9564 12.9640 k = 0.0244 0.0244-0.0000 ( 12589 PWs) bands (ev): -67.2293 -67.2293 -38.6588 -38.6588 -28.9325 -28.9325 -28.8727 -28.8727 -22.7378 -22.7378 -22.6928 -22.6928 -22.6862 -22.6862 -20.5083 -20.5083 -20.4673 -20.4673 -20.4505 -20.4505 -20.4492 -20.4492 -6.1233 -6.1232 -4.9798 -4.9769 -4.8919 -4.8916 -4.8670 -4.8643 1.4100 1.4127 1.8564 1.8578 2.7866 2.7970 3.2391 3.2451 3.2499 3.2528 3.3407 3.3463 3.9020 3.9065 4.1345 4.1581 4.1907 4.2042 4.2481 4.2501 4.7413 4.7612 4.8172 4.8287 5.0769 5.0949 5.1245 5.1282 5.1758 5.1796 5.2991 5.3098 5.5491 5.5734 5.6100 5.6337 5.8557 5.8736 6.4619 6.4629 6.5169 6.5214 6.9311 6.9358 8.5413 8.5451 8.5811 8.5854 8.8446 8.8475 9.3489 9.3505 9.3894 9.4060 10.2647 10.2723 12.9448 12.9503 k = 0.0122 0.0122-0.0000 ( 12589 PWs) bands (ev): -67.2293 -67.2293 -38.6588 -38.6588 -28.9325 -28.9325 -28.8727 -28.8727 -22.7378 -22.7378 -22.6928 -22.6928 -22.6862 -22.6862 -20.5083 -20.5083 -20.4673 -20.4673 -20.4505 -20.4505 -20.4492 -20.4492 -6.1254 -6.1254 -4.9780 -4.9766 -4.8905 -4.8903 -4.8660 -4.8646 1.4066 1.4080 1.8532 1.8539 2.7881 2.7934 3.2400 3.2429 3.2512 3.2526 3.3423 3.3451 3.9043 3.9066 4.1488 4.1678 4.1841 4.1989 4.2423 4.2423 4.7508 4.7618 4.8229 4.8299 5.0920 5.1022 5.1174 5.1178 5.1772 5.1780 5.3025 5.3079 5.5576 5.5700 5.6194 5.6315 5.8553 5.8644 6.4686 6.4701 6.5208 6.5239 6.9327 6.9351 8.5409 8.5430 8.5807 8.5828 8.8416 8.8431 9.3525 9.3526 9.3943 9.4032 10.2472 10.2511 12.9381 12.9410 k = 0.0000 0.0000 0.0000 ( 12589 PWs) bands (ev): -67.2293 -67.2293 -38.6588 -38.6588 -28.9325 -28.9325 -28.8727 -28.8727 -22.7378 -22.7378 -22.6928 -22.6928 -22.6862 -22.6862 -20.5083 -20.5083 -20.4673 -20.4673 -20.4505 -20.4505 -20.4492 -20.4492 -6.1261 -6.1261 -4.9769 -4.9769 -4.8899 -4.8899 -4.8652 -4.8652 1.4060 1.4060 1.8524 1.8524 2.7904 2.7904 3.2412 3.2412 3.2521 3.2521 3.3438 3.3438 3.9058 3.9058 4.1621 4.1621 4.1895 4.1895 4.2402 4.2402 4.7579 4.7579 4.8276 4.8276 5.1051 5.1051 5.1103 5.1103 5.1776 5.1776 5.3054 5.3054 5.5646 5.5646 5.6267 5.6267 5.8582 5.8582 6.4713 6.4713 6.5238 6.5238 6.9341 6.9341 8.5415 8.5415 8.5812 8.5812 8.8411 8.8411 9.3532 9.3532 9.3995 9.3995 10.2426 10.2426 12.9368 12.9368 k = 0.0000 0.0000 0.0000 ( 12589 PWs) bands (ev): -67.2293 -67.2293 -38.6588 -38.6588 -28.9325 -28.9325 -28.8727 -28.8727 -22.7378 -22.7378 -22.6928 -22.6928 -22.6862 -22.6862 -20.5083 -20.5083 -20.4673 -20.4673 -20.4505 -20.4505 -20.4492 -20.4492 -6.1261 -6.1261 -4.9769 -4.9769 -4.8899 -4.8899 -4.8652 -4.8652 1.4060 1.4060 1.8524 1.8524 2.7904 2.7904 3.2412 3.2412 3.2521 3.2521 3.3438 3.3438 3.9058 3.9058 4.1621 4.1621 4.1895 4.1895 4.2402 4.2402 4.7579 4.7579 4.8276 4.8276 5.1051 5.1051 5.1103 5.1103 5.1776 5.1776 5.3054 5.3054 5.5646 5.5646 5.6267 5.6267 5.8582 5.8582 6.4713 6.4713 6.5238 6.5238 6.9341 6.9341 8.5415 8.5415 8.5812 8.5812 8.8411 8.8411 9.3532 9.3532 9.3995 9.3995 10.2426 10.2426 12.9368 12.9368 k = 0.0000 0.0000 0.0167 ( 12573 PWs) bands (ev): -67.2293 -67.2293 -38.6588 -38.6588 -28.9325 -28.9325 -28.8727 -28.8727 -22.7378 -22.7378 -22.6928 -22.6928 -22.6862 -22.6862 -20.5083 -20.5083 -20.4673 -20.4673 -20.4505 -20.4505 -20.4492 -20.4492 -6.1255 -6.1255 -4.9771 -4.9771 -4.8899 -4.8899 -4.8658 -4.8658 1.4066 1.4066 1.8531 1.8531 2.7911 2.7911 3.2405 3.2405 3.2520 3.2520 3.3433 3.3433 3.9045 3.9045 4.1628 4.1628 4.1899 4.1899 4.2407 4.2407 4.7581 4.7581 4.8279 4.8279 5.0947 5.0947 5.1192 5.1192 5.1784 5.1784 5.3060 5.3060 5.5635 5.5635 5.6255 5.6255 5.8568 5.8568 6.4717 6.4717 6.5242 6.5242 6.9317 6.9317 8.5417 8.5417 8.5820 8.5820 8.8417 8.8417 9.3534 9.3534 9.3996 9.3996 10.2471 10.2471 12.9379 12.9379 k = 0.0000 0.0000 0.0334 ( 12581 PWs) bands (ev): -67.2293 -67.2293 -38.6588 -38.6588 -28.9325 -28.9325 -28.8727 -28.8727 -22.7378 -22.7378 -22.6928 -22.6928 -22.6862 -22.6862 -20.5083 -20.5083 -20.4673 -20.4673 -20.4505 -20.4505 -20.4492 -20.4492 -6.1237 -6.1237 -4.9775 -4.9775 -4.8899 -4.8899 -4.8677 -4.8677 1.4083 1.4083 1.8551 1.8551 2.7931 2.7931 3.2385 3.2385 3.2515 3.2515 3.3417 3.3417 3.9005 3.9005 4.1646 4.1646 4.1912 4.1912 4.2421 4.2421 4.7586 4.7586 4.8285 4.8285 5.0808 5.0808 5.1284 5.1284 5.1807 5.1807 5.3077 5.3077 5.5603 5.5603 5.6221 5.6221 5.8523 5.8523 6.4729 6.4729 6.5253 6.5253 6.9246 6.9246 8.5419 8.5419 8.5844 8.5844 8.8437 8.8437 9.3538 9.3538 9.3998 9.3998 10.2606 10.2606 12.9412 12.9412 k = 0.0000 0.0000 0.0502 ( 12569 PWs) bands (ev): -67.2293 -67.2293 -38.6588 -38.6588 -28.9325 -28.9325 -28.8727 -28.8727 -22.7378 -22.7378 -22.6928 -22.6928 -22.6862 -22.6862 -20.5083 -20.5083 -20.4673 -20.4673 -20.4505 -20.4505 -20.4492 -20.4492 -6.1207 -6.1207 -4.9783 -4.9783 -4.8900 -4.8900 -4.8709 -4.8709 1.4111 1.4111 1.8584 1.8584 2.7964 2.7964 3.2352 3.2352 3.2506 3.2506 3.3393 3.3393 3.8940 3.8940 4.1675 4.1675 4.1933 4.1933 4.2445 4.2445 4.7595 4.7595 4.8297 4.8297 5.0658 5.0658 5.1355 5.1355 5.1847 5.1847 5.3104 5.3104 5.5551 5.5551 5.6165 5.6165 5.8450 5.8450 6.4748 6.4748 6.5271 6.5271 6.9130 6.9130 8.5420 8.5420 8.5885 8.5885 8.8472 8.8472 9.3546 9.3546 9.4002 9.4002 10.2829 10.2829 12.9467 12.9467 k = 0.0000 0.0000 0.0669 ( 12573 PWs) bands (ev): -67.2293 -67.2293 -38.6588 -38.6588 -28.9325 -28.9325 -28.8727 -28.8727 -22.7378 -22.7378 -22.6928 -22.6928 -22.6862 -22.6862 -20.5083 -20.5083 -20.4673 -20.4673 -20.4505 -20.4505 -20.4492 -20.4492 -6.1165 -6.1165 -4.9795 -4.9795 -4.8900 -4.8900 -4.8751 -4.8751 1.4151 1.4151 1.8631 1.8631 2.8009 2.8009 3.2307 3.2307 3.2494 3.2494 3.3360 3.3360 3.8852 3.8852 4.1713 4.1713 4.1962 4.1962 4.2478 4.2478 4.7607 4.7607 4.8312 4.8312 5.0500 5.0500 5.1405 5.1405 5.1900 5.1900 5.3143 5.3143 5.5479 5.5479 5.6088 5.6088 5.8350 5.8350 6.4775 6.4775 6.5295 6.5295 6.8972 6.8972 8.5416 8.5416 8.5943 8.5943 8.8525 8.8525 9.3557 9.3557 9.4007 9.4007 10.3134 10.3134 12.9543 12.9543 k = 0.0000 0.0000 0.0836 ( 12572 PWs) bands (ev): -67.2293 -67.2293 -38.6588 -38.6588 -28.9325 -28.9325 -28.8727 -28.8727 -22.7378 -22.7378 -22.6928 -22.6928 -22.6862 -22.6862 -20.5083 -20.5083 -20.4673 -20.4673 -20.4505 -20.4505 -20.4492 -20.4492 -6.1111 -6.1111 -4.9812 -4.9812 -4.8900 -4.8900 -4.8804 -4.8804 1.4201 1.4201 1.8691 1.8691 2.8066 2.8066 3.2250 3.2250 3.2478 3.2478 3.3319 3.3319 3.8743 3.8743 4.1758 4.1758 4.1998 4.1998 4.2520 4.2520 4.7621 4.7621 4.8332 4.8332 5.0334 5.0334 5.1438 5.1438 5.1962 5.1962 5.3192 5.3192 5.5388 5.5388 5.5990 5.5990 5.8225 5.8225 6.4809 6.4809 6.5326 6.5326 6.8774 6.8774 8.5404 8.5404 8.6018 8.6018 8.8600 8.8600 9.3570 9.3570 9.4012 9.4012 10.3517 10.3517 12.9641 12.9641 k = 0.0000 0.0000 0.1003 ( 12584 PWs) bands (ev): -67.2293 -67.2293 -38.6588 -38.6588 -28.9325 -28.9325 -28.8727 -28.8727 -22.7378 -22.7378 -22.6928 -22.6928 -22.6862 -22.6862 -20.5083 -20.5083 -20.4673 -20.4673 -20.4505 -20.4505 -20.4492 -20.4492 -6.1046 -6.1046 -4.9835 -4.9835 -4.8901 -4.8901 -4.8866 -4.8866 1.4262 1.4262 1.8764 1.8764 2.8132 2.8132 3.2183 3.2183 3.2458 3.2458 3.3273 3.3273 3.8615 3.8615 4.1809 4.1809 4.2042 4.2042 4.2569 4.2569 4.7636 4.7636 4.8355 4.8355 5.0163 5.0163 5.1459 5.1459 5.2028 5.2028 5.3250 5.3250 5.5280 5.5280 5.5874 5.5874 5.8077 5.8077 6.4849 6.4849 6.5361 6.5361 6.8543 6.8543 8.5382 8.5382 8.6108 8.6108 8.8698 8.8698 9.3585 9.3585 9.4018 9.4018 10.3972 10.3972 12.9760 12.9760 k = 0.0000 0.0000 0.1170 ( 12588 PWs) bands (ev): -67.2293 -67.2293 -38.6588 -38.6588 -28.9325 -28.9325 -28.8728 -28.8728 -22.7378 -22.7378 -22.6928 -22.6928 -22.6862 -22.6862 -20.5083 -20.5083 -20.4673 -20.4673 -20.4505 -20.4505 -20.4492 -20.4492 -6.0969 -6.0969 -4.9865 -4.9865 -4.8935 -4.8935 -4.8901 -4.8901 1.4333 1.4333 1.8851 1.8851 2.8205 2.8205 3.2106 3.2106 3.2435 3.2435 3.3223 3.3223 3.8471 3.8471 4.1865 4.1865 4.2092 4.2092 4.2627 4.2627 4.7653 4.7653 4.8381 4.8381 4.9987 4.9987 5.1471 5.1471 5.2093 5.2093 5.3317 5.3317 5.5155 5.5155 5.5739 5.5739 5.7910 5.7910 6.4895 6.4895 6.5399 6.5399 6.8281 6.8281 8.5350 8.5350 8.6212 8.6212 8.8821 8.8821 9.3602 9.3602 9.4025 9.4025 10.4491 10.4491 12.9898 12.9898 k = 0.0000 0.0000 0.1337 ( 12584 PWs) bands (ev): -67.2293 -67.2293 -38.6588 -38.6588 -28.9325 -28.9325 -28.8728 -28.8728 -22.7378 -22.7378 -22.6928 -22.6928 -22.6862 -22.6862 -20.5083 -20.5083 -20.4673 -20.4673 -20.4505 -20.4505 -20.4492 -20.4492 -6.0881 -6.0881 -4.9906 -4.9906 -4.9007 -4.9007 -4.8901 -4.8901 1.4414 1.4414 1.8950 1.8950 2.8283 2.8283 3.2023 3.2023 3.2409 3.2409 3.3170 3.3170 3.8312 3.8312 4.1923 4.1923 4.2147 4.2147 4.2691 4.2691 4.7668 4.7668 4.8409 4.8409 4.9808 4.9808 5.1478 5.1478 5.2155 5.2155 5.3390 5.3390 5.5015 5.5015 5.5589 5.5589 5.7725 5.7725 6.4946 6.4946 6.5440 6.5440 6.7996 6.7996 8.5309 8.5309 8.6327 8.6327 8.8967 8.8967 9.3621 9.3621 9.4031 9.4031 10.5068 10.5068 13.0055 13.0055 k = 0.0000 0.0000 0.1505 ( 12576 PWs) bands (ev): -67.2293 -67.2293 -38.6588 -38.6588 -28.9325 -28.9325 -28.8728 -28.8728 -22.7378 -22.7378 -22.6928 -22.6928 -22.6862 -22.6862 -20.5083 -20.5083 -20.4673 -20.4673 -20.4505 -20.4505 -20.4492 -20.4492 -6.0782 -6.0782 -4.9959 -4.9959 -4.9079 -4.9079 -4.8902 -4.8902 1.4504 1.4504 1.9062 1.9062 2.8361 2.8361 3.1935 3.1935 3.2381 3.2381 3.3115 3.3115 3.8141 3.8141 4.1984 4.1984 4.2206 4.2206 4.2762 4.2762 4.7681 4.7681 4.8438 4.8438 4.9630 4.9630 5.1481 5.1481 5.2213 5.2213 5.3469 5.3469 5.4863 5.4863 5.5425 5.5425 5.7526 5.7526 6.5002 6.5002 6.5482 6.5482 6.7693 6.7693 8.5262 8.5262 8.6450 8.6450 8.9135 8.9135 9.3641 9.3641 9.4038 9.4038 10.5696 10.5696 13.0228 13.0228 k = 0.0000 0.0000 0.1672 ( 12584 PWs) bands (ev): -67.2293 -67.2293 -38.6588 -38.6588 -28.9325 -28.9325 -28.8728 -28.8728 -22.7378 -22.7378 -22.6928 -22.6928 -22.6862 -22.6862 -20.5083 -20.5083 -20.4673 -20.4673 -20.4505 -20.4505 -20.4492 -20.4492 -6.0672 -6.0672 -5.0029 -5.0029 -4.9149 -4.9149 -4.8902 -4.8902 1.4602 1.4602 1.9188 1.9188 2.8435 2.8435 3.1848 3.1848 3.2352 3.2352 3.3060 3.3060 3.7958 3.7958 4.2047 4.2047 4.2268 4.2268 4.2838 4.2838 4.7686 4.7686 4.8466 4.8466 4.9457 4.9457 5.1481 5.1481 5.2267 5.2267 5.3550 5.3550 5.4700 5.4700 5.5248 5.5248 5.7316 5.7316 6.5061 6.5061 6.5522 6.5522 6.7378 6.7378 8.5211 8.5211 8.6579 8.6579 8.9321 8.9321 9.3661 9.3661 9.4044 9.4044 10.6368 10.6368 13.0414 13.0414 k = 0.0000 0.0000 0.1839 ( 12596 PWs) bands (ev): -67.2293 -67.2293 -38.6588 -38.6588 -28.9325 -28.9325 -28.8728 -28.8728 -22.7378 -22.7378 -22.6928 -22.6928 -22.6862 -22.6862 -20.5083 -20.5083 -20.4673 -20.4673 -20.4505 -20.4505 -20.4492 -20.4492 -6.0552 -6.0552 -5.0117 -5.0117 -4.9212 -4.9212 -4.8903 -4.8903 1.4709 1.4709 1.9326 1.9326 2.8497 2.8497 3.1768 3.1768 3.2322 3.2322 3.3004 3.3004 3.7767 3.7767 4.2111 4.2111 4.2332 4.2332 4.2919 4.2919 4.7681 4.7681 4.8491 4.8491 4.9295 4.9295 5.1478 5.1478 5.2316 5.2316 5.3632 5.3632 5.4527 5.4527 5.5061 5.5061 5.7099 5.7099 6.5123 6.5123 6.5556 6.5556 6.7061 6.7061 8.5159 8.5159 8.6711 8.6711 8.9522 8.9522 9.3682 9.3682 9.4050 9.4050 10.7076 10.7076 13.0610 13.0610 k = 0.0000 0.0000 0.2006 ( 12584 PWs) bands (ev): -67.2293 -67.2293 -38.6588 -38.6588 -28.9325 -28.9325 -28.8728 -28.8728 -22.7378 -22.7378 -22.6928 -22.6928 -22.6862 -22.6862 -20.5083 -20.5083 -20.4673 -20.4673 -20.4505 -20.4505 -20.4492 -20.4492 -6.0423 -6.0423 -5.0225 -5.0225 -4.9266 -4.9266 -4.8904 -4.8904 1.4822 1.4822 1.9476 1.9476 2.8542 2.8542 3.1702 3.1702 3.2291 3.2291 3.2950 3.2950 3.7567 3.7567 4.2177 4.2177 4.2397 4.2397 4.3004 4.3004 4.7656 4.7656 4.8509 4.8509 4.9155 4.9155 5.1474 5.1474 5.2360 5.2360 5.3713 5.3713 5.4347 5.4347 5.4866 5.4866 5.6877 5.6877 6.5186 6.5186 6.5576 6.5576 6.6753 6.6753 8.5108 8.5108 8.6845 8.6845 8.9734 8.9734 9.3701 9.3701 9.4055 9.4055 10.7815 10.7815 13.0809 13.0809 k = 0.0000 0.0000 0.2173 ( 12560 PWs) bands (ev): -67.2293 -67.2293 -38.6588 -38.6588 -28.9325 -28.9325 -28.8728 -28.8728 -22.7378 -22.7378 -22.6928 -22.6928 -22.6862 -22.6862 -20.5083 -20.5083 -20.4673 -20.4673 -20.4505 -20.4505 -20.4492 -20.4492 -6.0284 -6.0284 -5.0353 -5.0353 -4.9311 -4.9311 -4.8904 -4.8904 1.4942 1.4942 1.9639 1.9639 2.8560 2.8560 3.1658 3.1658 3.2262 3.2262 3.2897 3.2897 3.7361 3.7361 4.2244 4.2244 4.2461 4.2461 4.3093 4.3093 4.7604 4.7604 4.8517 4.8517 4.9050 4.9050 5.1469 5.1469 5.2401 5.2401 5.3791 5.3791 5.4163 5.4163 5.4665 5.4665 5.6655 5.6655 6.5248 6.5248 6.5566 6.5566 6.6476 6.6476 8.5062 8.5062 8.6977 8.6977 8.9954 8.9954 9.3719 9.3719 9.4061 9.4061 10.8578 10.8578 13.1004 13.1004 k = 0.0000 0.0000 0.2340 ( 12584 PWs) bands (ev): -67.2293 -67.2293 -38.6588 -38.6588 -28.9325 -28.9325 -28.8728 -28.8728 -22.7378 -22.7378 -22.6928 -22.6928 -22.6862 -22.6862 -20.5083 -20.5083 -20.4673 -20.4673 -20.4505 -20.4505 -20.4492 -20.4492 -6.0136 -6.0136 -5.0499 -5.0499 -4.9347 -4.9347 -4.8905 -4.8905 1.5067 1.5067 1.9814 1.9814 2.8543 2.8543 3.1641 3.1641 3.2236 3.2236 3.2846 3.2846 3.7150 3.7150 4.2312 4.2312 4.2524 4.2524 4.3184 4.3184 4.7515 4.7515 4.8513 4.8513 4.8987 4.8987 5.1462 5.1462 5.2438 5.2438 5.3857 5.3857 5.3980 5.3980 5.4462 5.4462 5.6435 5.6435 6.5301 6.5301 6.5500 6.5500 6.6268 6.6268 8.5022 8.5022 8.7106 8.7106 9.0176 9.0176 9.3735 9.3735 9.4067 9.4067 10.9358 10.9358 13.1187 13.1187 k = 0.0000 0.0000 0.2508 ( 12564 PWs) bands (ev): -67.2293 -67.2293 -38.6588 -38.6588 -28.9325 -28.9325 -28.8728 -28.8728 -22.7378 -22.7378 -22.6928 -22.6928 -22.6862 -22.6862 -20.5083 -20.5083 -20.4673 -20.4673 -20.4505 -20.4505 -20.4492 -20.4492 -5.9981 -5.9981 -5.0661 -5.0661 -4.9376 -4.9376 -4.8906 -4.8906 1.5196 1.5196 2.0001 2.0001 2.8487 2.8487 3.1656 3.1656 3.2214 3.2214 3.2798 3.2798 3.6936 3.6936 4.2380 4.2380 4.2586 4.2586 4.3277 4.3277 4.7384 4.7384 4.8506 4.8506 4.8965 4.8965 5.1453 5.1453 5.2470 5.2470 5.3774 5.3774 5.3934 5.3934 5.4262 5.4262 5.6220 5.6220 6.5259 6.5259 6.5435 6.5435 6.6158 6.6158 8.4989 8.4989 8.7231 8.7231 9.0399 9.0399 9.3748 9.3748 9.4074 9.4074 11.0150 11.0150 13.1346 13.1346 k = 0.0000 0.0000 0.2675 ( 12564 PWs) bands (ev): -67.2293 -67.2293 -38.6588 -38.6588 -28.9325 -28.9325 -28.8729 -28.8729 -22.7378 -22.7378 -22.6928 -22.6928 -22.6862 -22.6862 -20.5083 -20.5083 -20.4673 -20.4673 -20.4505 -20.4505 -20.4492 -20.4492 -5.9818 -5.9818 -5.0837 -5.0837 -4.9399 -4.9399 -4.8906 -4.8906 1.5329 1.5329 2.0200 2.0200 2.8389 2.8389 3.1699 3.1699 3.2203 3.2203 3.2753 3.2753 3.6721 3.6721 4.2447 4.2447 4.2645 4.2645 4.3372 4.3372 4.7214 4.7214 4.8505 4.8505 4.8970 4.8970 5.1442 5.1442 5.2499 5.2499 5.3588 5.3588 5.3948 5.3948 5.4098 5.4098 5.6015 5.6015 6.5040 6.5040 6.5476 6.5476 6.6127 6.6127 8.4964 8.4964 8.7351 8.7351 9.0619 9.0619 9.3757 9.3757 9.4084 9.4084 11.0948 11.0948 13.1469 13.1469 k = 0.0000 0.0000 0.2842 ( 12588 PWs) bands (ev): -67.2293 -67.2293 -38.6588 -38.6588 -28.9325 -28.9325 -28.8729 -28.8729 -22.7378 -22.7378 -22.6928 -22.6928 -22.6862 -22.6862 -20.5083 -20.5083 -20.4673 -20.4673 -20.4505 -20.4505 -20.4492 -20.4492 -5.9649 -5.9649 -5.1023 -5.1023 -4.9416 -4.9416 -4.8907 -4.8907 1.5463 1.5463 2.0410 2.0410 2.8250 2.8250 3.1760 3.1760 3.2210 3.2210 3.2712 3.2712 3.6506 3.6506 4.2513 4.2513 4.2701 4.2701 4.3467 4.3467 4.7013 4.7013 4.8514 4.8514 4.8992 4.8992 5.1430 5.1430 5.2523 5.2523 5.3401 5.3401 5.3810 5.3810 5.4083 5.4083 5.5821 5.5821 6.4771 6.4771 6.5536 6.5536 6.6137 6.6137 8.4946 8.4946 8.7463 8.7463 9.0833 9.0833 9.3763 9.3763 9.4095 9.4095 11.1744 11.1744 13.1545 13.1545 k = 0.0000 0.0000 0.3009 ( 12612 PWs) bands (ev): -67.2293 -67.2293 -38.6588 -38.6588 -28.9325 -28.9325 -28.8729 -28.8729 -22.7378 -22.7378 -22.6928 -22.6928 -22.6862 -22.6862 -20.5083 -20.5083 -20.4673 -20.4673 -20.4505 -20.4505 -20.4492 -20.4492 -5.9475 -5.9475 -5.1218 -5.1218 -4.9431 -4.9431 -4.8908 -4.8908 1.5598 1.5598 2.0631 2.0631 2.8075 2.8075 3.1819 3.1819 3.2249 3.2249 3.2678 3.2678 3.6293 3.6293 4.2577 4.2577 4.2753 4.2753 4.3562 4.3562 4.6790 4.6790 4.8533 4.8533 4.9023 4.9023 5.1415 5.1415 5.2542 5.2542 5.3219 5.3219 5.3622 5.3622 5.4112 5.4112 5.5643 5.5643 6.4493 6.4493 6.5598 6.5598 6.6165 6.6165 8.4937 8.4937 8.7569 8.7569 9.1039 9.1039 9.3764 9.3764 9.4109 9.4109 11.2534 11.2534 13.1566 13.1566 k = 0.0000 0.0000 0.3176 ( 12628 PWs) bands (ev): -67.2293 -67.2293 -38.6588 -38.6588 -28.9325 -28.9325 -28.8729 -28.8729 -22.7378 -22.7378 -22.6928 -22.6928 -22.6862 -22.6862 -20.5083 -20.5083 -20.4673 -20.4673 -20.4505 -20.4505 -20.4492 -20.4492 -5.9296 -5.9296 -5.1419 -5.1419 -4.9442 -4.9442 -4.8908 -4.8908 1.5731 1.5731 2.0862 2.0862 2.7867 2.7867 3.1855 3.1855 3.2327 3.2327 3.2658 3.2658 3.6084 3.6084 4.2638 4.2638 4.2802 4.2802 4.3656 4.3656 4.6554 4.6554 4.8559 4.8559 4.9058 4.9058 5.1398 5.1398 5.2553 5.2553 5.3044 5.3044 5.3437 5.3437 5.4135 5.4135 5.5484 5.5484 6.4220 6.4220 6.5659 6.5659 6.6200 6.6200 8.4935 8.4935 8.7666 8.7666 9.1234 9.1234 9.3761 9.3761 9.4126 9.4126 11.3312 11.3312 13.1529 13.1529 k = 0.0000 0.0000 0.3343 ( 12600 PWs) bands (ev): -67.2293 -67.2293 -38.6588 -38.6588 -28.9325 -28.9325 -28.8729 -28.8729 -22.7378 -22.7378 -22.6928 -22.6928 -22.6862 -22.6862 -20.5083 -20.5083 -20.4673 -20.4673 -20.4505 -20.4505 -20.4492 -20.4492 -5.9115 -5.9115 -5.1623 -5.1623 -4.9451 -4.9451 -4.8909 -4.8909 1.5863 1.5863 2.1104 2.1104 2.7632 2.7632 3.1867 3.1867 3.2415 3.2415 3.2677 3.2677 3.5880 3.5880 4.2694 4.2694 4.2846 4.2846 4.3749 4.3749 4.6311 4.6311 4.8589 4.8589 4.9095 4.9095 5.1378 5.1378 5.2553 5.2553 5.2878 5.2878 5.3266 5.3266 5.4142 5.4142 5.5349 5.5349 6.3960 6.3960 6.5717 6.5717 6.6238 6.6238 8.4939 8.4939 8.7756 8.7756 9.1417 9.1417 9.3754 9.3754 9.4146 9.4146 11.4071 11.4071 13.1439 13.1439 k = 0.0000 0.0000 0.3511 ( 12600 PWs) bands (ev): -67.2293 -67.2293 -38.6588 -38.6588 -28.9325 -28.9325 -28.8729 -28.8729 -22.7378 -22.7378 -22.6928 -22.6928 -22.6862 -22.6862 -20.5083 -20.5083 -20.4673 -20.4673 -20.4505 -20.4505 -20.4492 -20.4492 -5.8932 -5.8932 -5.1829 -5.1829 -4.9459 -4.9459 -4.8909 -4.8909 1.5990 1.5990 2.1356 2.1356 2.7376 2.7376 3.1863 3.1863 3.2456 3.2456 3.2779 3.2779 3.5685 3.5685 4.2745 4.2745 4.2886 4.2886 4.3838 4.3838 4.6068 4.6068 4.8623 4.8623 4.9131 4.9131 5.1354 5.1354 5.2535 5.2535 5.2724 5.2724 5.3118 5.3118 5.4132 5.4132 5.5239 5.5239 6.3717 6.3717 6.5773 6.5773 6.6277 6.6277 8.4949 8.4949 8.7837 8.7837 9.1585 9.1585 9.3744 9.3744 9.4168 9.4168 11.4805 11.4805 13.1303 13.1303 k = 0.0000 0.0000 0.3678 ( 12600 PWs) bands (ev): -67.2293 -67.2293 -38.6588 -38.6588 -28.9324 -28.9324 -28.8729 -28.8729 -22.7378 -22.7378 -22.6928 -22.6928 -22.6862 -22.6862 -20.5083 -20.5083 -20.4673 -20.4673 -20.4505 -20.4505 -20.4492 -20.4492 -5.8751 -5.8751 -5.2033 -5.2033 -4.9465 -4.9465 -4.8910 -4.8910 1.6112 1.6112 2.1617 2.1617 2.7103 2.7103 3.1852 3.1852 3.2453 3.2453 3.2945 3.2945 3.5500 3.5500 4.2786 4.2786 4.2923 4.2923 4.3924 4.3924 4.5831 4.5831 4.8658 4.8658 4.9165 4.9165 5.1327 5.1327 5.2487 5.2487 5.2589 5.2589 5.3002 5.3002 5.4105 5.4105 5.5156 5.5156 6.3493 6.3493 6.5825 6.5825 6.6314 6.6314 8.4964 8.4964 8.7909 8.7909 9.1739 9.1739 9.3732 9.3732 9.4192 9.4192 11.5508 11.5508 13.1129 13.1129 k = 0.0000 0.0000 0.3845 ( 12616 PWs) bands (ev): -67.2293 -67.2293 -38.6588 -38.6588 -28.9324 -28.9324 -28.8729 -28.8729 -22.7378 -22.7378 -22.6928 -22.6928 -22.6862 -22.6862 -20.5083 -20.5083 -20.4673 -20.4673 -20.4505 -20.4505 -20.4492 -20.4492 -5.8572 -5.8572 -5.2234 -5.2234 -4.9470 -4.9470 -4.8910 -4.8910 1.6227 1.6227 2.1888 2.1888 2.6815 2.6815 3.1838 3.1838 3.2436 3.2436 3.3134 3.3134 3.5328 3.5328 4.2817 4.2817 4.2957 4.2957 4.4005 4.4005 4.5604 4.5604 4.8693 4.8693 4.9196 4.9196 5.1297 5.1297 5.2396 5.2396 5.2482 5.2482 5.2926 5.2926 5.4063 5.4063 5.5097 5.5097 6.3289 6.3289 6.5873 6.5873 6.6350 6.6350 8.4981 8.4981 8.7973 8.7973 9.1876 9.1876 9.3718 9.3718 9.4217 9.4217 11.6173 11.6173 13.0928 13.0928 k = 0.0000 0.0000 0.4012 ( 12616 PWs) bands (ev): -67.2293 -67.2293 -38.6588 -38.6588 -28.9324 -28.9324 -28.8729 -28.8729 -22.7378 -22.7378 -22.6928 -22.6928 -22.6862 -22.6862 -20.5083 -20.5083 -20.4673 -20.4673 -20.4505 -20.4505 -20.4492 -20.4492 -5.8400 -5.8400 -5.2426 -5.2426 -4.9474 -4.9474 -4.8911 -4.8911 1.6333 1.6333 2.2166 2.2166 2.6517 2.6517 3.1823 3.1823 3.2416 3.2416 3.3328 3.3328 3.5169 3.5169 4.2835 4.2835 4.2990 4.2990 4.4080 4.4080 4.5395 4.5395 4.8727 4.8727 4.9224 4.9224 5.1264 5.1264 5.2283 5.2283 5.2393 5.2393 5.2883 5.2883 5.4010 5.4010 5.5059 5.5059 6.3108 6.3108 6.5916 6.5916 6.6382 6.6382 8.5000 8.5000 8.8029 8.8029 9.1997 9.1997 9.3704 9.3704 9.4242 9.4242 11.6792 11.6792 13.0710 13.0710 k = 0.0000 0.0000 0.4179 ( 12588 PWs) bands (ev): -67.2293 -67.2293 -38.6588 -38.6588 -28.9324 -28.9324 -28.8730 -28.8730 -22.7378 -22.7378 -22.6928 -22.6928 -22.6862 -22.6862 -20.5083 -20.5083 -20.4673 -20.4673 -20.4505 -20.4505 -20.4492 -20.4492 -5.8237 -5.8237 -5.2608 -5.2608 -4.9477 -4.9477 -4.8911 -4.8911 1.6428 1.6428 2.2453 2.2453 2.6210 2.6210 3.1808 3.1808 3.2397 3.2397 3.3517 3.3517 3.5027 3.5027 4.2840 4.2840 4.3021 4.3021 4.4148 4.4148 4.5207 4.5207 4.8759 4.8759 4.9247 4.9247 5.1230 5.1230 5.2171 5.2171 5.2312 5.2312 5.2861 5.2861 5.3954 5.3954 5.5036 5.5036 6.2949 6.2949 6.5954 6.5954 6.6411 6.6411 8.5020 8.5020 8.8077 8.8077 9.2101 9.2101 9.3689 9.3689 9.4267 9.4267 11.7358 11.7358 13.0487 13.0487 k = 0.0000 0.0000 0.4346 ( 12572 PWs) bands (ev): -67.2293 -67.2293 -38.6588 -38.6588 -28.9324 -28.9324 -28.8730 -28.8730 -22.7378 -22.7378 -22.6928 -22.6928 -22.6862 -22.6862 -20.5083 -20.5083 -20.4673 -20.4673 -20.4505 -20.4505 -20.4492 -20.4492 -5.8087 -5.8087 -5.2774 -5.2774 -4.9479 -4.9479 -4.8912 -4.8912 1.6512 1.6512 2.2746 2.2746 2.5897 2.5897 3.1795 3.1795 3.2380 3.2380 3.3691 3.3691 3.4904 3.4904 4.2832 4.2832 4.3049 4.3049 4.4208 4.4208 4.5045 4.5045 4.8789 4.8789 4.9266 4.9266 5.1197 5.1197 5.2068 5.2068 5.2242 5.2242 5.2851 5.2851 5.3899 5.3899 5.5023 5.5023 6.2815 6.2815 6.5987 6.5987 6.6437 6.6437 8.5039 8.5039 8.8117 8.8117 9.2188 9.2188 9.3676 9.3676 9.4290 9.4290 11.7861 11.7861 13.0269 13.0269 k = 0.0000 0.0000 0.4514 ( 12572 PWs) bands (ev): -67.2293 -67.2293 -38.6588 -38.6588 -28.9324 -28.9324 -28.8730 -28.8730 -22.7378 -22.7378 -22.6928 -22.6928 -22.6862 -22.6862 -20.5083 -20.5083 -20.4673 -20.4673 -20.4505 -20.4505 -20.4492 -20.4492 -5.7955 -5.7955 -5.2920 -5.2920 -4.9481 -4.9481 -4.8912 -4.8912 1.6583 1.6583 2.3046 2.3046 2.5579 2.5579 3.1784 3.1784 3.2365 3.2365 3.3845 3.3845 3.4800 3.4800 4.2817 4.2817 4.3073 4.3073 4.4259 4.4259 4.4912 4.4912 4.8815 4.8815 4.9281 4.9281 5.1165 5.1165 5.1978 5.1978 5.2186 5.2186 5.2845 5.2845 5.3850 5.3850 5.5016 5.5016 6.2704 6.2704 6.6015 6.6015 6.6458 6.6458 8.5057 8.5057 8.8149 8.8149 9.2259 9.2259 9.3663 9.3663 9.4311 9.4311 11.8293 11.8293 13.0069 13.0069 k = 0.0000 0.0000 0.4681 ( 12564 PWs) bands (ev): -67.2293 -67.2293 -38.6588 -38.6588 -28.9324 -28.9324 -28.8730 -28.8730 -22.7378 -22.7378 -22.6928 -22.6928 -22.6862 -22.6862 -20.5083 -20.5083 -20.4673 -20.4673 -20.4505 -20.4505 -20.4492 -20.4492 -5.7845 -5.7845 -5.3040 -5.3040 -4.9483 -4.9483 -4.8912 -4.8912 1.6639 1.6639 2.3352 2.3352 2.5259 2.5259 3.1775 3.1775 3.2354 3.2354 3.3972 3.3972 3.4718 3.4718 4.2796 4.2796 4.3093 4.3093 4.4300 4.4300 4.4810 4.4810 4.8837 4.8837 4.9292 4.9292 5.1139 5.1139 5.1904 5.1904 5.2144 5.2144 5.2843 5.2843 5.3809 5.3809 5.5013 5.5013 6.2618 6.2618 6.6036 6.6036 6.6475 6.6475 8.5071 8.5071 8.8174 8.8174 9.2314 9.2314 9.3653 9.3653 9.4328 9.4328 11.8643 11.8643 12.9897 12.9897 k = 0.0000 0.0000 0.4848 ( 12556 PWs) bands (ev): -67.2293 -67.2293 -38.6588 -38.6588 -28.9324 -28.9324 -28.8730 -28.8730 -22.7378 -22.7378 -22.6928 -22.6928 -22.6862 -22.6862 -20.5083 -20.5083 -20.4673 -20.4673 -20.4505 -20.4505 -20.4492 -20.4492 -5.7762 -5.7762 -5.3131 -5.3131 -4.9484 -4.9484 -4.8912 -4.8912 1.6680 1.6680 2.3663 2.3663 2.4938 2.4938 3.1768 3.1768 3.2346 3.2346 3.4067 3.4067 3.4659 3.4659 4.2777 4.2777 4.3107 4.3107 4.4329 4.4329 4.4738 4.4738 4.8853 4.8853 4.9299 4.9299 5.1119 5.1119 5.1850 5.1850 5.2115 5.2115 5.2842 5.2842 5.3779 5.3779 5.5013 5.5013 6.2556 6.2556 6.6052 6.6052 6.6487 6.6487 8.5082 8.5082 8.8192 8.8192 9.2353 9.2353 9.3645 9.3645 9.4341 9.4341 11.8901 11.8901 12.9764 12.9764 k = 0.0000 0.0000 0.5015 ( 12532 PWs) bands (ev): -67.2293 -67.2293 -38.6588 -38.6588 -28.9324 -28.9324 -28.8730 -28.8730 -22.7378 -22.7378 -22.6928 -22.6928 -22.6862 -22.6862 -20.5083 -20.5083 -20.4673 -20.4673 -20.4505 -20.4505 -20.4492 -20.4492 -5.7710 -5.7710 -5.3188 -5.3188 -4.9484 -4.9484 -4.8913 -4.8913 1.6705 1.6705 2.3978 2.3978 2.4616 2.4616 3.1765 3.1765 3.2341 3.2341 3.4125 3.4125 3.4623 3.4623 4.2763 4.2763 4.3116 4.3116 4.4347 4.4347 4.4695 4.4695 4.8864 4.8864 4.9303 4.9303 5.1106 5.1106 5.1816 5.1816 5.2098 5.2098 5.2841 5.2841 5.3761 5.3761 5.5012 5.5012 6.2519 6.2519 6.6061 6.6061 6.6494 6.6494 8.5089 8.5089 8.8202 8.8202 9.2376 9.2376 9.3641 9.3641 9.4349 9.4349 11.9060 11.9060 12.9681 12.9681 k = 0.0000 0.0000 0.5182 ( 12540 PWs) bands (ev): -67.2293 -67.2293 -38.6588 -38.6588 -28.9324 -28.9324 -28.8730 -28.8730 -22.7378 -22.7378 -22.6928 -22.6928 -22.6862 -22.6862 -20.5083 -20.5083 -20.4673 -20.4673 -20.4505 -20.4505 -20.4492 -20.4492 -5.7692 -5.7692 -5.3207 -5.3207 -4.9484 -4.9484 -4.8913 -4.8913 1.6713 1.6713 2.4294 2.4294 2.4298 2.4298 3.1763 3.1763 3.2339 3.2339 3.4145 3.4145 3.4611 3.4611 4.2757 4.2757 4.3119 4.3119 4.4354 4.4354 4.4681 4.4681 4.8867 4.8867 4.9304 4.9304 5.1102 5.1102 5.1805 5.1805 5.2092 5.2092 5.2841 5.2841 5.3754 5.3754 5.5012 5.5012 6.2506 6.2506 6.6065 6.6065 6.6497 6.6497 8.5091 8.5091 8.8206 8.8206 9.2384 9.2384 9.3639 9.3639 9.4352 9.4352 11.9114 11.9114 12.9652 12.9652 k = 0.0000 0.0000 0.5182 ( 12540 PWs) bands (ev): -67.2293 -67.2293 -38.6588 -38.6588 -28.9324 -28.9324 -28.8730 -28.8730 -22.7378 -22.7378 -22.6928 -22.6928 -22.6862 -22.6862 -20.5083 -20.5083 -20.4673 -20.4673 -20.4505 -20.4505 -20.4492 -20.4492 -5.7692 -5.7692 -5.3207 -5.3207 -4.9484 -4.9484 -4.8913 -4.8913 1.6713 1.6713 2.4294 2.4294 2.4298 2.4298 3.1763 3.1763 3.2339 3.2339 3.4145 3.4145 3.4611 3.4611 4.2757 4.2757 4.3119 4.3119 4.4354 4.4354 4.4681 4.4681 4.8867 4.8867 4.9304 4.9304 5.1102 5.1102 5.1805 5.1805 5.2092 5.2092 5.2841 5.2841 5.3754 5.3754 5.5012 5.5012 6.2506 6.2506 6.6065 6.6065 6.6497 6.6497 8.5091 8.5091 8.8206 8.8206 9.2384 9.2384 9.3639 9.3639 9.4352 9.4352 11.9114 11.9114 12.9652 12.9652 k = 0.0000 0.0172 0.5182 ( 12548 PWs) bands (ev): -67.2293 -67.2293 -38.6588 -38.6588 -28.9324 -28.9324 -28.8730 -28.8730 -22.7378 -22.7378 -22.6928 -22.6928 -22.6862 -22.6862 -20.5083 -20.5083 -20.4673 -20.4673 -20.4505 -20.4505 -20.4492 -20.4492 -5.7687 -5.7686 -5.3218 -5.3191 -4.9505 -4.9472 -4.8917 -4.8916 1.6715 1.6730 2.4296 2.4297 2.4302 2.4303 3.1715 3.1784 3.2322 3.2324 3.4163 3.4187 3.4599 3.4621 4.2570 4.2913 4.3069 4.3164 4.4258 4.4318 4.4682 4.4803 4.8837 4.8851 4.9267 4.9333 5.0830 5.1248 5.1656 5.1927 5.1939 5.2287 5.2808 5.2860 5.3792 5.3869 5.5005 5.5057 6.2445 6.2562 6.6050 6.6065 6.6455 6.6523 8.5017 8.5188 8.8158 8.8275 9.2312 9.2450 9.3571 9.3688 9.4255 9.4480 11.9121 11.9134 12.9658 12.9696 k = 0.0000 0.0345 0.5182 ( 12552 PWs) bands (ev): -67.2293 -67.2293 -38.6588 -38.6588 -28.9325 -28.9325 -28.8730 -28.8730 -22.7378 -22.7378 -22.6928 -22.6928 -22.6862 -22.6862 -20.5083 -20.5083 -20.4673 -20.4673 -20.4505 -20.4505 -20.4492 -20.4492 -5.7670 -5.7669 -5.3223 -5.3169 -4.9533 -4.9467 -4.8930 -4.8928 1.6736 1.6765 2.4295 2.4297 2.4324 2.4327 3.1635 3.1777 3.2281 3.2288 3.4239 3.4281 3.4587 3.4629 4.2361 4.2933 4.3119 4.3189 4.4061 4.4249 4.4775 4.4957 4.8762 4.8790 4.9223 4.9342 5.0526 5.1090 5.1623 5.1901 5.1931 5.2521 5.2792 5.2853 5.3959 5.4091 5.5043 5.5142 6.2378 6.2609 6.6024 6.6048 6.6398 6.6538 8.4966 8.5307 8.8130 8.8365 9.2248 9.2495 9.3516 9.3698 9.4175 9.4648 11.9154 11.9181 12.9712 12.9788 k = 0.0000 0.0517 0.5182 ( 12540 PWs) bands (ev): -67.2293 -67.2293 -38.6588 -38.6588 -28.9325 -28.9325 -28.8730 -28.8730 -22.7378 -22.7378 -22.6928 -22.6928 -22.6862 -22.6862 -20.5083 -20.5083 -20.4673 -20.4673 -20.4505 -20.4505 -20.4492 -20.4492 -5.7641 -5.7641 -5.3223 -5.3142 -4.9570 -4.9471 -4.8951 -4.8948 1.6776 1.6820 2.4292 2.4297 2.4362 2.4366 3.1517 3.1732 3.2228 3.2254 3.4363 3.4414 3.4575 3.4636 4.2129 4.2842 4.3189 4.3249 4.3826 4.4190 4.4893 4.5105 4.8649 4.8691 4.9172 4.9311 5.0208 5.0841 5.1461 5.1843 5.2106 5.2740 5.2810 5.2827 5.4194 5.4350 5.5145 5.5283 6.2307 6.2646 6.5988 6.6012 6.6327 6.6543 8.4938 8.5446 8.8123 8.8474 9.2198 9.2501 9.3508 9.3669 9.4099 9.4849 11.9215 11.9254 12.9816 12.9930 k = 0.0000 0.0690 0.5182 ( 12562 PWs) bands (ev): -67.2293 -67.2293 -38.6588 -38.6588 -28.9325 -28.9325 -28.8730 -28.8730 -22.7378 -22.7378 -22.6928 -22.6928 -22.6862 -22.6862 -20.5083 -20.5083 -20.4673 -20.4673 -20.4505 -20.4505 -20.4492 -20.4492 -5.7602 -5.7601 -5.3217 -5.3110 -4.9613 -4.9484 -4.8979 -4.8976 1.6834 1.6892 2.4290 2.4297 2.4415 2.4421 3.1364 3.1638 3.2191 3.2232 3.4502 3.4572 3.4582 3.4643 4.1874 4.2719 4.3160 4.3370 4.3579 4.4152 4.5019 4.5239 4.8504 4.8559 4.9110 4.9215 4.9884 5.0626 5.1286 5.1737 5.2345 5.2789 5.2791 5.2979 5.4431 5.4588 5.5335 5.5500 6.2233 6.2672 6.5939 6.5954 6.6250 6.6545 8.4933 8.5606 8.8134 8.8598 9.2169 9.2460 9.3559 9.3606 9.4020 9.5075 11.9301 11.9354 12.9969 13.0119 k = 0.0000 0.0862 0.5182 ( 12574 PWs) bands (ev): -67.2293 -67.2293 -38.6588 -38.6588 -28.9325 -28.9325 -28.8730 -28.8730 -22.7378 -22.7378 -22.6928 -22.6928 -22.6862 -22.6862 -20.5083 -20.5083 -20.4673 -20.4673 -20.4505 -20.4505 -20.4492 -20.4492 -5.7551 -5.7550 -5.3206 -5.3072 -4.9664 -4.9506 -4.9013 -4.9013 1.6909 1.6982 2.4289 2.4297 2.4484 2.4490 3.1182 3.1497 3.2179 3.2224 3.4524 3.4638 3.4731 3.4759 4.1597 4.2565 4.3102 4.3290 4.3519 4.4137 4.5145 4.5358 4.8330 4.8397 4.9039 4.9041 4.9560 5.0475 5.1138 5.1641 5.2564 5.2764 5.2799 5.3150 5.4643 5.4779 5.5618 5.5793 6.2159 6.2684 6.5870 6.5875 6.6179 6.6548 8.4952 8.5784 8.8160 8.8735 9.2163 9.2388 9.3514 9.3659 9.3940 9.5315 11.9415 11.9480 13.0170 13.0356 k = 0.0000 0.1034 0.5182 ( 12574 PWs) bands (ev): -67.2293 -67.2293 -38.6588 -38.6588 -28.9326 -28.9326 -28.8730 -28.8730 -22.7378 -22.7378 -22.6928 -22.6928 -22.6862 -22.6862 -20.5083 -20.5083 -20.4673 -20.4673 -20.4505 -20.4505 -20.4492 -20.4492 -5.7490 -5.7488 -5.3189 -5.3030 -4.9722 -4.9538 -4.9057 -4.9054 1.7001 1.7088 2.4289 2.4299 2.4568 2.4574 3.0979 3.1322 3.2188 3.2228 3.4507 3.4639 3.4934 3.4950 4.1299 4.2369 4.3016 4.3041 4.3627 4.4143 4.5268 4.5460 4.8134 4.8210 4.8802 4.8959 4.9242 5.0372 5.1033 5.1566 5.2638 5.2806 5.2860 5.3275 5.4842 5.4934 5.5967 5.6135 6.2087 6.2680 6.5771 6.5773 6.6135 6.6558 8.4993 8.5979 8.8199 8.8879 9.2184 9.2303 9.3399 9.3754 9.3895 9.5565 11.9554 11.9632 13.0419 13.0640 k = 0.0000 0.1207 0.5182 ( 12582 PWs) bands (ev): -67.2293 -67.2293 -38.6588 -38.6588 -28.9326 -28.9326 -28.8730 -28.8730 -22.7378 -22.7378 -22.6928 -22.6928 -22.6862 -22.6862 -20.5083 -20.5083 -20.4673 -20.4673 -20.4505 -20.4505 -20.4492 -20.4492 -5.7418 -5.7416 -5.3168 -5.2982 -4.9788 -4.9580 -4.9109 -4.9100 1.7107 1.7209 2.4290 2.4303 2.4667 2.4672 3.0764 3.1127 3.2210 3.2243 3.4487 3.4635 3.5152 3.5154 4.0981 4.2119 4.2806 4.2907 4.3736 4.4163 4.5386 4.5544 4.7921 4.8002 4.8529 4.8842 4.8962 5.0287 5.0983 5.1513 5.2590 5.2813 5.3052 5.3354 5.5046 5.5072 5.6345 5.6493 6.2020 6.2661 6.5640 6.5652 6.6125 6.6577 8.5057 8.6190 8.8248 8.9024 9.2218 9.2232 9.3267 9.3713 9.4009 9.5818 11.9719 11.9809 13.0715 13.0969 k = 0.0000 0.1379 0.5182 ( 12592 PWs) bands (ev): -67.2293 -67.2293 -38.6588 -38.6588 -28.9326 -28.9326 -28.8730 -28.8730 -22.7378 -22.7378 -22.6928 -22.6928 -22.6862 -22.6862 -20.5083 -20.5083 -20.4673 -20.4673 -20.4505 -20.4505 -20.4492 -20.4492 -5.7336 -5.7334 -5.3141 -5.2929 -4.9861 -4.9631 -4.9169 -4.9151 1.7228 1.7345 2.4295 2.4311 2.4782 2.4785 3.0542 3.0920 3.2242 3.2265 3.4463 3.4629 3.5361 3.5383 4.0647 4.1816 4.2592 4.2777 4.3840 4.4193 4.5496 4.5609 4.7700 4.7773 4.8248 4.8577 4.8834 5.0200 5.0987 5.1480 5.2522 5.2822 5.3236 5.3390 5.5207 5.5263 5.6724 5.6839 6.1965 6.2626 6.5484 6.5514 6.6151 6.6610 8.5143 8.6414 8.8304 8.9163 9.2141 9.2309 9.3122 9.3632 9.4184 9.6070 11.9909 12.0012 13.1058 13.1344 k = 0.0000 0.1552 0.5182 ( 12602 PWs) bands (ev): -67.2293 -67.2293 -38.6588 -38.6588 -28.9327 -28.9327 -28.8731 -28.8731 -22.7378 -22.7378 -22.6928 -22.6928 -22.6862 -22.6862 -20.5083 -20.5083 -20.4673 -20.4673 -20.4505 -20.4505 -20.4492 -20.4492 -5.7244 -5.7241 -5.3108 -5.2872 -4.9940 -4.9694 -4.9235 -4.9206 1.7361 1.7492 2.4304 2.4322 2.4910 2.4911 3.0318 3.0708 3.2280 3.2294 3.4437 3.4619 3.5575 3.5621 4.0297 4.1470 4.2390 4.2627 4.3939 4.4226 4.5594 4.5651 4.7479 4.7527 4.7981 4.8269 4.8753 5.0110 5.1035 5.1467 5.2445 5.2832 5.3391 5.3397 5.5347 5.5489 5.7086 5.7153 6.1926 6.2577 6.5312 6.5363 6.6212 6.6659 8.5251 8.6650 8.8362 8.9291 9.2075 9.2415 9.2968 9.3559 9.4374 9.6319 12.0124 12.0238 13.1445 13.1760 k = 0.0000 0.1724 0.5182 ( 12598 PWs) bands (ev): -67.2293 -67.2293 -38.6588 -38.6588 -28.9327 -28.9327 -28.8731 -28.8731 -22.7378 -22.7378 -22.6928 -22.6928 -22.6862 -22.6862 -20.5083 -20.5083 -20.4673 -20.4673 -20.4505 -20.4505 -20.4492 -20.4492 -5.7143 -5.7140 -5.3071 -5.2810 -5.0027 -4.9767 -4.9308 -4.9265 1.7504 1.7649 2.4316 2.4337 2.5050 2.5054 3.0097 3.0496 3.2324 3.2327 3.4409 3.4605 3.5795 3.5866 3.9936 4.1095 4.2191 4.2458 4.4032 4.4259 4.5668 4.5677 4.7264 4.7268 4.7744 4.7956 4.8682 5.0023 5.1113 5.1471 5.2363 5.2845 5.3366 5.3533 5.5493 5.5719 5.7417 5.7418 6.1912 6.2521 6.5129 6.5202 6.6306 6.6728 8.5378 8.6894 8.8420 8.9398 9.2017 9.2545 9.2812 9.3511 9.4571 9.6560 12.0363 12.0489 13.1876 13.2218 k = 0.0000 0.1897 0.5182 ( 12592 PWs) bands (ev): -67.2293 -67.2293 -38.6589 -38.6589 -28.9328 -28.9328 -28.8731 -28.8731 -22.7378 -22.7378 -22.6928 -22.6928 -22.6862 -22.6862 -20.5083 -20.5083 -20.4673 -20.4673 -20.4505 -20.4505 -20.4492 -20.4492 -5.7032 -5.7029 -5.3030 -5.2744 -5.0120 -4.9851 -4.9387 -4.9327 1.7656 1.7815 2.4334 2.4357 2.5202 2.5211 2.9882 3.0289 3.2365 3.2371 3.4378 3.4587 3.6018 3.6117 3.9565 4.0699 4.1986 4.2269 4.4119 4.4287 4.5656 4.5738 4.6989 4.7079 4.7546 4.7640 4.8620 4.9943 5.1210 5.1492 5.2276 5.2859 5.3319 5.3644 5.5645 5.5946 5.7621 5.7703 6.1927 6.2463 6.4941 6.5035 6.6434 6.6819 8.5523 8.7143 8.8476 8.9482 9.1963 9.2618 9.2741 9.3499 9.4770 9.6792 12.0626 12.0763 13.2347 13.2713 k = 0.0000 0.2069 0.5182 ( 12588 PWs) bands (ev): -67.2293 -67.2293 -38.6589 -38.6589 -28.9328 -28.9328 -28.8731 -28.8731 -22.7378 -22.7378 -22.6928 -22.6928 -22.6862 -22.6862 -20.5083 -20.5083 -20.4673 -20.4673 -20.4505 -20.4505 -20.4492 -20.4492 -5.6913 -5.6909 -5.2984 -5.2674 -5.0221 -4.9944 -4.9471 -4.9393 1.7814 1.7986 2.4356 2.4382 2.5366 2.5381 2.9678 3.0090 3.2405 3.2422 3.4344 3.4564 3.6245 3.6372 3.9189 4.0292 4.1770 4.2060 4.4197 4.4306 4.5613 4.5767 4.6709 4.6925 4.7321 4.7392 4.8567 4.9874 5.1318 5.1527 5.2190 5.2875 5.3257 5.3732 5.5800 5.6165 5.7752 5.7935 6.1975 6.2413 6.4753 6.4866 6.6593 6.6933 8.5686 8.7393 8.8526 8.9538 9.1907 9.2480 9.2909 9.3535 9.4969 9.7012 12.0912 12.1059 13.2856 13.3241 k = 0.0000 0.2241 0.5182 ( 12592 PWs) bands (ev): -67.2293 -67.2293 -38.6589 -38.6589 -28.9329 -28.9329 -28.8731 -28.8731 -22.7378 -22.7378 -22.6928 -22.6928 -22.6862 -22.6862 -20.5083 -20.5083 -20.4673 -20.4673 -20.4505 -20.4505 -20.4492 -20.4492 -5.6786 -5.6782 -5.2933 -5.2600 -5.0327 -5.0046 -4.9560 -4.9461 1.7978 1.8161 2.4383 2.4411 2.5541 2.5565 2.9489 2.9903 3.2448 3.2474 3.4307 3.4536 3.6476 3.6633 3.8811 3.9878 4.1540 4.1828 4.4266 4.4310 4.5541 4.5756 4.6431 4.6818 4.6999 4.7282 4.8526 4.9819 5.1427 5.1577 5.2108 5.2889 5.3184 5.3798 5.5955 5.6370 5.7810 5.8102 6.2055 6.2380 6.4567 6.4699 6.6781 6.7072 8.5863 8.7640 8.8569 8.9567 9.1849 9.2335 9.3115 9.3620 9.5165 9.7217 12.1220 12.1378 13.3399 13.3797 k = 0.0000 0.2414 0.5182 ( 12586 PWs) bands (ev): -67.2293 -67.2293 -38.6589 -38.6589 -28.9330 -28.9330 -28.8732 -28.8732 -22.7378 -22.7378 -22.6928 -22.6928 -22.6862 -22.6862 -20.5083 -20.5083 -20.4673 -20.4673 -20.4505 -20.4505 -20.4492 -20.4492 -5.6652 -5.6648 -5.2879 -5.2522 -5.0440 -5.0157 -4.9654 -4.9533 1.8143 1.8337 2.4414 2.4443 2.5726 2.5760 2.9320 2.9733 3.2492 3.2527 3.4265 3.4502 3.6708 3.6898 3.8435 3.9464 4.1295 4.1574 4.4291 4.4323 4.5449 4.5703 4.6161 4.6669 4.6768 4.7213 4.8499 4.9777 5.1523 5.1641 5.2047 5.2898 5.3108 5.3846 5.6104 5.6560 5.7799 5.8200 6.2161 6.2369 6.4389 6.4537 6.6993 6.7236 8.6054 8.7878 8.8602 8.9571 9.1791 9.2201 9.3340 9.3754 9.5357 9.7406 12.1551 12.1719 13.3971 13.4374 k = 0.0000 0.2586 0.5182 ( 12582 PWs) bands (ev): -67.2293 -67.2293 -38.6589 -38.6589 -28.9330 -28.9330 -28.8732 -28.8732 -22.7378 -22.7378 -22.6928 -22.6928 -22.6862 -22.6862 -20.5083 -20.5083 -20.4673 -20.4673 -20.4505 -20.4505 -20.4492 -20.4492 -5.6512 -5.6507 -5.2821 -5.2442 -5.0558 -5.0274 -4.9751 -4.9608 1.8309 1.8511 2.4447 2.4477 2.5921 2.5966 2.9176 2.9584 3.2536 3.2580 3.4219 3.4461 3.6940 3.7165 3.8067 3.9054 4.1033 4.1297 4.4241 4.4364 4.5349 4.5618 4.5905 4.6343 4.6758 4.7175 4.8486 4.9751 5.1573 5.1718 5.2036 5.2882 5.3049 5.3879 5.6246 5.6730 5.7726 5.8227 6.2283 6.2384 6.4220 6.4384 6.7227 6.7422 8.6255 8.8102 8.8624 8.9552 9.1740 9.2083 9.3581 9.3927 9.5544 9.7575 12.1902 12.2080 13.4563 13.4958 k = 0.0000 0.2759 0.5182 ( 12578 PWs) bands (ev): -67.2293 -67.2293 -38.6589 -38.6589 -28.9331 -28.9331 -28.8732 -28.8732 -22.7378 -22.7378 -22.6928 -22.6928 -22.6862 -22.6862 -20.5083 -20.5083 -20.4673 -20.4673 -20.4505 -20.4505 -20.4492 -20.4492 -5.6366 -5.6361 -5.2760 -5.2358 -5.0681 -5.0398 -4.9851 -4.9685 1.8472 1.8681 2.4479 2.4511 2.6123 2.6183 2.9062 2.9461 3.2579 3.2631 3.4168 3.4413 3.7169 3.7420 3.7723 3.8658 4.0756 4.0998 4.4152 4.4386 4.5251 4.5517 4.5673 4.6016 4.6779 4.7162 4.8489 4.9739 5.1552 5.1808 5.2101 5.2817 5.3032 5.3898 5.6376 5.6878 5.7602 5.8187 6.2412 6.2424 6.4065 6.4240 6.7475 6.7628 8.6464 8.8302 8.8635 8.9517 9.1705 9.1987 9.3832 9.4130 9.5723 9.7724 12.2273 12.2461 13.5167 13.5514 k = 0.0000 0.2931 0.5182 ( 12570 PWs) bands (ev): -67.2293 -67.2293 -38.6589 -38.6589 -28.9331 -28.9331 -28.8732 -28.8732 -22.7378 -22.7378 -22.6928 -22.6928 -22.6862 -22.6862 -20.5083 -20.5083 -20.4673 -20.4673 -20.4505 -20.4505 -20.4492 -20.4492 -5.6216 -5.6211 -5.2696 -5.2273 -5.0809 -5.0526 -4.9953 -4.9766 1.8632 1.8845 2.4507 2.4541 2.6332 2.6407 2.8984 2.9369 3.2620 3.2679 3.4110 3.4356 3.7327 3.7380 3.7747 3.8290 4.0465 4.0677 4.4019 4.4386 4.5153 4.5406 4.5477 4.5704 4.6818 4.7165 4.8508 4.9741 5.1479 5.1908 5.2223 5.2720 5.3045 5.3907 5.6491 5.7005 5.7441 5.8087 6.2486 6.2540 6.3924 6.4109 6.7734 6.7849 8.6677 8.8470 8.8633 8.9470 9.1692 9.1914 9.4090 9.4353 9.5894 9.7851 12.2663 12.2861 13.5219 13.5413 k = 0.0000 0.3103 0.5182 ( 12558 PWs) bands (ev): -67.2293 -67.2293 -38.6589 -38.6589 -28.9332 -28.9332 -28.8732 -28.8732 -22.7378 -22.7378 -22.6928 -22.6928 -22.6862 -22.6862 -20.5083 -20.5083 -20.4673 -20.4673 -20.4505 -20.4505 -20.4492 -20.4492 -5.6062 -5.6056 -5.2631 -5.2186 -5.0939 -5.0656 -5.0058 -4.9850 1.8787 1.9000 2.4530 2.4565 2.6546 2.6639 2.8945 2.9310 3.2658 3.2721 3.4046 3.4290 3.7009 3.7507 3.8018 3.8023 4.0163 4.0337 4.3849 4.4362 4.5033 4.5235 4.5341 4.5467 4.6867 4.7179 4.8544 4.9757 5.1382 5.2016 5.2373 5.2610 5.3068 5.3907 5.6587 5.7108 5.7253 5.7938 6.2564 6.2661 6.3800 6.3992 6.7997 6.8081 8.6892 8.8598 8.8620 8.9421 9.1705 9.1865 9.4350 9.4589 9.6057 9.7954 12.3072 12.3280 13.4646 13.4852 k = 0.0000 0.3276 0.5182 ( 12570 PWs) bands (ev): -67.2293 -67.2293 -38.6589 -38.6589 -28.9333 -28.9333 -28.8733 -28.8733 -22.7378 -22.7378 -22.6928 -22.6928 -22.6862 -22.6862 -20.5083 -20.5083 -20.4673 -20.4673 -20.4505 -20.4505 -20.4492 -20.4492 -5.5906 -5.5900 -5.2565 -5.2099 -5.1070 -5.0787 -5.0163 -4.9937 1.8935 1.9146 2.4543 2.4580 2.6764 2.6875 2.8950 2.9288 3.2690 3.2755 3.3976 3.4215 3.6705 3.7362 3.8042 3.8300 3.9857 3.9983 4.3648 4.4314 4.4885 4.4953 4.5270 4.5364 4.6920 4.7200 4.8595 4.9785 5.1276 5.2123 5.2504 5.2539 5.3097 5.3901 5.6650 5.7062 5.7189 5.7750 6.2650 6.2771 6.3693 6.3890 6.8258 6.8317 8.7106 8.8598 8.8675 8.9379 9.1746 9.1842 9.4609 9.4830 9.6210 9.8032 12.3499 12.3716 13.4075 13.4294 k = 0.0000 0.3448 0.5182 ( 12566 PWs) bands (ev): -67.2293 -67.2293 -38.6589 -38.6589 -28.9333 -28.9333 -28.8733 -28.8733 -22.7378 -22.7378 -22.6928 -22.6928 -22.6862 -22.6862 -20.5083 -20.5083 -20.4673 -20.4673 -20.4505 -20.4505 -20.4492 -20.4492 -5.5749 -5.5744 -5.2500 -5.2015 -5.1198 -5.0915 -5.0269 -5.0026 1.9075 1.9279 2.4545 2.4585 2.6983 2.7113 2.8998 2.9304 3.2714 3.2776 3.3901 3.4130 3.6430 3.7074 3.8213 3.8584 3.9560 3.9621 4.3426 4.4244 4.4641 4.4727 4.5239 4.5316 4.6974 4.7224 4.8660 4.9823 5.1166 5.2186 5.2448 5.2714 5.3130 5.3890 5.6618 5.6936 5.7249 5.7533 6.2741 6.2868 6.3603 6.3802 6.8512 6.8552 8.7314 8.8571 8.8701 8.9349 9.1810 9.1843 9.4862 9.5070 9.6353 9.8084 12.3941 12.4167 13.3508 13.3740 k = 0.0000 0.3621 0.5182 ( 12570 PWs) bands (ev): -67.2293 -67.2293 -38.6590 -38.6590 -28.9334 -28.9334 -28.8733 -28.8733 -22.7379 -22.7378 -22.6928 -22.6928 -22.6862 -22.6862 -20.5083 -20.5083 -20.4673 -20.4673 -20.4505 -20.4505 -20.4492 -20.4492 -5.5594 -5.5589 -5.2438 -5.1939 -5.1318 -5.1038 -5.0374 -5.0118 1.9205 1.9400 2.4536 2.4579 2.7203 2.7349 2.9088 2.9357 3.2726 3.2779 3.3825 3.4038 3.6187 3.6782 3.8371 3.8858 3.9267 3.9308 4.3190 4.4135 4.4353 4.4577 4.5226 4.5289 4.7028 4.7249 4.8739 4.9867 5.1057 5.2130 5.2518 5.2893 5.3165 5.3879 5.6442 5.6932 5.7264 5.7318 6.2830 6.2951 6.3530 6.3729 6.8754 6.8779 8.7513 8.8542 8.8681 8.9331 9.1865 9.1892 9.5106 9.5305 9.6487 9.8110 12.4399 12.4633 13.2946 13.3191 k = 0.0000 0.3793 0.5182 ( 12564 PWs) bands (ev): -67.2293 -67.2293 -38.6590 -38.6590 -28.9334 -28.9334 -28.8733 -28.8733 -22.7379 -22.7379 -22.6928 -22.6928 -22.6862 -22.6862 -20.5083 -20.5083 -20.4673 -20.4673 -20.4505 -20.4505 -20.4492 -20.4492 -5.5443 -5.5438 -5.2381 -5.1883 -5.1414 -5.1149 -5.0479 -5.0212 1.9325 1.9507 2.4517 2.4561 2.7420 2.7580 2.9212 2.9441 3.2724 3.2760 3.3753 3.3942 3.5981 3.6514 3.8405 3.8844 3.9193 3.9204 4.2948 4.3909 4.4180 4.4438 4.5223 4.5275 4.7079 4.7272 4.8830 4.9914 5.0956 5.2012 5.2655 5.3070 5.3205 5.3871 5.6207 5.6970 5.7032 5.7319 6.2916 6.3020 6.3472 6.3668 6.8978 6.8992 8.7697 8.8517 8.8630 8.9316 9.1904 9.1983 9.5337 9.5529 9.6613 9.8110 12.4869 12.5113 13.2388 13.2644 k = 0.0000 0.3966 0.5182 ( 12568 PWs) bands (ev): -67.2293 -67.2293 -38.6590 -38.6590 -28.9334 -28.9334 -28.8733 -28.8733 -22.7379 -22.7379 -22.6928 -22.6928 -22.6862 -22.6862 -20.5083 -20.5083 -20.4673 -20.4673 -20.4505 -20.4505 -20.4492 -20.4492 -5.5298 -5.5293 -5.2333 -5.1872 -5.1463 -5.1244 -5.0581 -5.0308 1.9434 1.9598 2.4492 2.4536 2.7633 2.7801 2.9363 2.9550 3.2702 3.2714 3.3692 3.3848 3.5814 3.6276 3.8254 3.8508 3.9277 3.9474 4.2703 4.3606 4.4091 4.4315 4.5224 4.5267 4.7128 4.7294 4.8930 4.9955 5.0869 5.1877 5.2814 5.3235 5.3249 5.3876 5.5959 5.6768 5.7013 5.7327 6.2995 6.3076 6.3429 6.3618 6.9180 6.9188 8.7860 8.8505 8.8565 8.9295 9.1958 9.2074 9.5551 9.5737 9.6732 9.8084 12.5352 12.5603 13.1835 13.2100 k = 0.0000 0.4138 0.5182 ( 12564 PWs) bands (ev): -67.2293 -67.2293 -38.6590 -38.6590 -28.9335 -28.9335 -28.8733 -28.8733 -22.7379 -22.7379 -22.6928 -22.6928 -22.6862 -22.6862 -20.5083 -20.5083 -20.4673 -20.4673 -20.4505 -20.4505 -20.4492 -20.4492 -5.5163 -5.5159 -5.2298 -5.1918 -5.1449 -5.1317 -5.0679 -5.0404 1.9531 1.9675 2.4462 2.4504 2.7838 2.8005 2.9529 2.9675 3.2645 3.2659 3.3646 3.3763 3.5684 3.6072 3.8018 3.8180 3.9469 3.9754 4.2462 4.3292 4.4024 4.4207 4.5228 4.5263 4.7173 4.7311 4.9039 4.9978 5.0808 5.1738 5.2978 5.3304 5.3368 5.3910 5.5712 5.6499 5.7053 5.7325 6.3064 6.3120 6.3400 6.3578 6.9358 6.9361 8.7993 8.8494 8.8517 8.9264 9.2020 9.2157 9.5745 9.5924 9.6848 9.8034 12.5845 12.6102 13.1287 13.1559 k = 0.0000 0.4310 0.5182 ( 12572 PWs) bands (ev): -67.2293 -67.2293 -38.6590 -38.6590 -28.9335 -28.9335 -28.8733 -28.8733 -22.7379 -22.7379 -22.6928 -22.6928 -22.6862 -22.6862 -20.5083 -20.5083 -20.4673 -20.4673 -20.4505 -20.4505 -20.4492 -20.4492 -5.5042 -5.5038 -5.2278 -5.1997 -5.1395 -5.1360 -5.0769 -5.0502 1.9615 1.9735 2.4433 2.4471 2.8029 2.8186 2.9696 2.9803 3.2561 3.2595 3.3615 3.3695 3.5591 3.5902 3.7776 3.7883 3.9694 4.0024 4.2233 4.2981 4.3972 4.4116 4.5233 4.5260 4.7214 4.7324 4.9154 4.9971 5.0785 5.1597 5.3129 5.3382 5.3447 5.3989 5.5480 5.6230 5.7090 5.7313 6.3122 6.3154 6.3384 6.3545 6.9507 6.9507 8.8085 8.8425 8.8562 8.9222 9.2086 9.2225 9.5916 9.6081 9.6964 9.7960 12.6345 12.6608 13.0745 13.1021 k = 0.0000 0.4483 0.5182 ( 12562 PWs) bands (ev): -67.2293 -67.2293 -38.6590 -38.6590 -28.9335 -28.9335 -28.8733 -28.8733 -22.7379 -22.7379 -22.6928 -22.6928 -22.6862 -22.6862 -20.5083 -20.5083 -20.4673 -20.4673 -20.4505 -20.4505 -20.4492 -20.4492 -5.4939 -5.4937 -5.2271 -5.2081 -5.1372 -5.1331 -5.0846 -5.0598 1.9685 1.9778 2.4407 2.4438 2.8200 2.8334 2.9849 2.9922 3.2475 3.2518 3.3596 3.3645 3.5530 3.5764 3.7562 3.7631 3.9926 4.0268 4.2031 4.2678 4.3935 4.4040 4.5238 4.5258 4.7249 4.7332 4.9273 4.9926 5.0807 5.1458 5.3240 5.3473 5.3509 5.4094 5.5282 5.5965 5.7124 5.7295 6.3166 6.3178 6.3381 6.3516 6.9624 6.9625 8.8140 8.8363 8.8641 8.9167 9.2152 9.2275 9.6060 9.6202 9.7086 9.7866 12.6849 12.7113 13.0213 13.0489 k = 0.0000 0.4655 0.5182 ( 12558 PWs) bands (ev): -67.2293 -67.2293 -38.6590 -38.6590 -28.9335 -28.9335 -28.8734 -28.8733 -22.7379 -22.7379 -22.6928 -22.6928 -22.6862 -22.6862 -20.5083 -20.5083 -20.4673 -20.4673 -20.4505 -20.4505 -20.4492 -20.4492 -5.4861 -5.4859 -5.2271 -5.2155 -5.1357 -5.1280 -5.0897 -5.0693 1.9741 1.9804 2.4389 2.4411 2.8341 2.8440 2.9973 3.0017 3.2405 3.2442 3.3586 3.3612 3.5500 3.5656 3.7397 3.7438 4.0152 4.0458 4.1885 4.2392 4.3912 4.3982 4.5242 4.5256 4.7279 4.7334 4.9395 4.9849 5.0868 5.1321 5.3312 5.3466 5.3679 5.4170 5.5157 5.5711 5.7156 5.7272 6.3193 6.3195 6.3391 6.3489 6.9710 6.9711 8.8172 8.8309 8.8737 8.9101 9.2211 9.2302 9.6176 9.6280 9.7216 9.7754 12.7348 12.7606 12.9703 12.9968 k = 0.0000 0.4828 0.5182 ( 12538 PWs) bands (ev): -67.2293 -67.2293 -38.6590 -38.6590 -28.9336 -28.9336 -28.8734 -28.8734 -22.7379 -22.7379 -22.6928 -22.6928 -22.6862 -22.6862 -20.5083 -20.5083 -20.4673 -20.4673 -20.4505 -20.4505 -20.4492 -20.4492 -5.4811 -5.4810 -5.2266 -5.2212 -5.1325 -5.1265 -5.0901 -5.0781 1.9782 1.9814 2.4379 2.4391 2.8443 2.8495 3.0057 3.0077 3.2362 3.2383 3.3582 3.3593 3.5499 3.5577 3.7295 3.7314 4.0353 4.0545 4.1844 4.2135 4.3905 4.3940 4.5247 4.5254 4.7302 4.7330 4.9518 4.9750 5.0958 5.1190 5.3364 5.3441 5.3863 5.4152 5.5156 5.5476 5.7187 5.7246 6.3205 6.3206 6.3412 6.3463 6.9762 6.9763 8.8199 8.8264 8.8838 8.9023 9.2260 9.2308 9.6259 9.6314 9.7353 9.7628 12.7822 12.8035 12.9265 12.9483 k = 0.0000 0.5000 0.5182 ( 12544 PWs) bands (ev): -67.2293 -67.2293 -38.6590 -38.6590 -28.9336 -28.9336 -28.8734 -28.8734 -22.7379 -22.7379 -22.6928 -22.6928 -22.6862 -22.6862 -20.5083 -20.5083 -20.4673 -20.4673 -20.4505 -20.4505 -20.4492 -20.4492 -5.4794 -5.4794 -5.2249 -5.2249 -5.1287 -5.1287 -5.0856 -5.0856 1.9806 1.9806 2.4380 2.4380 2.8496 2.8496 3.0092 3.0092 3.2354 3.2354 3.3584 3.3584 3.5525 3.5525 3.7266 3.7266 4.0500 4.0500 4.1937 4.1937 4.3914 4.3914 4.5250 4.5250 4.7320 4.7320 4.9637 4.9637 5.1068 5.1068 5.3406 5.3406 5.4034 5.4034 5.5279 5.5279 5.7217 5.7217 6.3209 6.3209 6.3437 6.3437 6.9780 6.9780 8.8228 8.8228 8.8935 8.8935 9.2293 9.2293 9.6306 9.6306 9.7492 9.7492 12.8157 12.8157 12.9141 12.9141 k = 0.0000 0.5000 0.5182 ( 12544 PWs) bands (ev): -67.2293 -67.2293 -38.6590 -38.6590 -28.9336 -28.9336 -28.8734 -28.8734 -22.7379 -22.7379 -22.6928 -22.6928 -22.6862 -22.6862 -20.5083 -20.5083 -20.4673 -20.4673 -20.4505 -20.4505 -20.4492 -20.4492 -5.4794 -5.4794 -5.2249 -5.2249 -5.1287 -5.1287 -5.0856 -5.0856 1.9806 1.9806 2.4380 2.4380 2.8496 2.8496 3.0092 3.0092 3.2354 3.2354 3.3584 3.3584 3.5525 3.5525 3.7266 3.7266 4.0500 4.0500 4.1937 4.1937 4.3914 4.3914 4.5250 4.5250 4.7320 4.7320 4.9637 4.9637 5.1068 5.1068 5.3406 5.3406 5.4034 5.4034 5.5279 5.5279 5.7217 5.7217 6.3209 6.3209 6.3437 6.3437 6.9780 6.9780 8.8228 8.8228 8.8935 8.8935 9.2293 9.2293 9.6306 9.6306 9.7492 9.7492 12.8157 12.8157 12.9141 12.9141 k = 0.0172 0.5000 0.5182 ( 12540 PWs) bands (ev): -67.2293 -67.2293 -38.6590 -38.6590 -28.9336 -28.9336 -28.8734 -28.8734 -22.7379 -22.7379 -22.6928 -22.6928 -22.6862 -22.6862 -20.5083 -20.5083 -20.4673 -20.4673 -20.4505 -20.4505 -20.4492 -20.4492 -5.4790 -5.4790 -5.2256 -5.2242 -5.1294 -5.1278 -5.0858 -5.0856 1.9807 1.9811 2.4353 2.4387 2.8470 2.8536 3.0010 3.0058 3.2350 3.2463 3.3561 3.3590 3.5509 3.5540 3.7271 3.7272 4.0470 4.0545 4.1915 4.1942 4.3874 4.3930 4.5226 4.5313 4.7275 4.7331 4.9573 4.9693 5.0996 5.1130 5.3351 5.3446 5.3961 5.4095 5.5282 5.5291 5.7176 5.7248 6.3115 6.3297 6.3381 6.3587 6.9782 6.9786 8.8150 8.8181 8.8981 8.9032 9.2283 9.2316 9.6294 9.6340 9.7480 9.7520 12.8111 12.8126 12.9082 12.9086 k = 0.0345 0.5000 0.5182 ( 12560 PWs) bands (ev): -67.2293 -67.2293 -38.6590 -38.6590 -28.9336 -28.9336 -28.8734 -28.8734 -22.7379 -22.7379 -22.6928 -22.6928 -22.6862 -22.6862 -20.5083 -20.5083 -20.4673 -20.4673 -20.4505 -20.4505 -20.4492 -20.4492 -5.4780 -5.4779 -5.2262 -5.2235 -5.1301 -5.1270 -5.0862 -5.0858 1.9813 1.9822 2.4308 2.4375 2.8456 2.8591 2.9840 2.9911 3.2448 3.2653 3.3521 3.3579 3.5493 3.5554 3.7286 3.7289 4.0455 4.0605 4.1877 4.1929 4.3816 4.3919 4.5242 4.5407 4.7197 4.7308 4.9502 4.9735 5.0919 5.1180 5.3281 5.3471 5.3877 5.4144 5.5302 5.5320 5.7123 5.7267 6.3067 6.3249 6.3549 6.3779 6.9793 6.9800 8.8005 8.8046 8.9134 8.9216 9.2288 9.2354 9.6305 9.6397 9.7484 9.7563 12.7987 12.8017 12.8910 12.8918 k = 0.0517 0.5000 0.5182 ( 12556 PWs) bands (ev): -67.2293 -67.2293 -38.6590 -38.6590 -28.9336 -28.9336 -28.8734 -28.8734 -22.7379 -22.7379 -22.6928 -22.6928 -22.6862 -22.6862 -20.5083 -20.5083 -20.4673 -20.4673 -20.4505 -20.4505 -20.4492 -20.4492 -5.4762 -5.4761 -5.2269 -5.2229 -5.1307 -5.1261 -5.0869 -5.0862 1.9826 1.9839 2.4246 2.4343 2.8445 2.8657 2.9619 2.9682 3.2620 3.2891 3.3467 3.3551 3.5478 3.5567 3.7312 3.7317 4.0456 4.0678 4.1823 4.1897 4.3745 4.3883 4.5297 4.5525 4.7091 4.7253 4.9428 4.9761 5.0839 5.1217 5.3197 5.3480 5.3782 5.4181 5.5333 5.5361 5.7061 5.7276 6.3067 6.3233 6.3774 6.4008 6.9813 6.9823 8.7844 8.7885 8.9329 8.9434 9.2308 9.2409 9.6338 9.6474 9.7504 9.7620 12.7787 12.7831 12.8632 12.8644 k = 0.0690 0.5000 0.5182 ( 12544 PWs) bands (ev): -67.2293 -67.2293 -38.6590 -38.6590 -28.9336 -28.9336 -28.8734 -28.8734 -22.7379 -22.7379 -22.6928 -22.6928 -22.6862 -22.6862 -20.5083 -20.5083 -20.4673 -20.4673 -20.4506 -20.4505 -20.4492 -20.4492 -5.4737 -5.4736 -5.2275 -5.2223 -5.1313 -5.1252 -5.0877 -5.0869 1.9844 1.9862 2.4169 2.4293 2.8422 2.8723 2.9390 2.9413 3.2835 3.3146 3.3407 3.3507 3.5464 3.5579 3.7347 3.7355 4.0471 4.0763 4.1754 4.1848 4.3667 4.3828 4.5385 4.5658 4.6958 4.7170 4.9353 4.9768 5.0760 5.1240 5.3100 5.3474 5.3678 5.4204 5.5374 5.5409 5.6988 5.7274 6.3118 6.3265 6.4037 6.4270 6.9841 6.9853 8.7686 8.7725 8.9533 8.9659 9.2350 9.2485 9.6394 9.6571 9.7539 9.7691 12.7510 12.7569 12.8259 12.8273 k = 0.0862 0.5000 0.5182 ( 12540 PWs) bands (ev): -67.2293 -67.2293 -38.6590 -38.6590 -28.9336 -28.9336 -28.8734 -28.8734 -22.7379 -22.7379 -22.6928 -22.6928 -22.6862 -22.6862 -20.5083 -20.5083 -20.4673 -20.4673 -20.4506 -20.4505 -20.4492 -20.4492 -5.4705 -5.4704 -5.2282 -5.2218 -5.1317 -5.1242 -5.0887 -5.0878 1.9867 1.9890 2.4077 2.4227 2.8349 2.8733 2.9180 2.9202 3.3071 3.3276 3.3450 3.3471 3.5455 3.5591 3.7391 3.7402 4.0501 4.0859 4.1671 4.1782 4.3586 4.3760 4.5497 4.5800 4.6805 4.7066 4.9278 4.9755 5.0687 5.1251 5.2990 5.3450 5.3566 5.4213 5.5419 5.5460 5.6906 5.7262 6.3219 6.3347 6.4333 6.4563 6.9877 6.9892 8.7542 8.7578 8.9730 8.9877 9.2420 9.2590 9.6471 9.6686 9.7590 9.7775 12.7158 12.7233 12.7804 12.7817 k = 0.1034 0.5000 0.5182 ( 12544 PWs) bands (ev): -67.2293 -67.2293 -38.6590 -38.6590 -28.9337 -28.9337 -28.8734 -28.8734 -22.7379 -22.7379 -22.6928 -22.6928 -22.6862 -22.6862 -20.5083 -20.5083 -20.4673 -20.4673 -20.4506 -20.4505 -20.4492 -20.4492 -5.4667 -5.4665 -5.2288 -5.2213 -5.1320 -5.1234 -5.0900 -5.0888 1.9896 1.9922 2.3973 2.4144 2.8184 2.8547 2.9107 2.9134 3.3203 3.3313 3.3384 3.3730 3.5450 3.5604 3.7442 3.7458 4.0543 4.0960 4.1574 4.1699 4.3504 4.3686 4.5628 4.5941 4.6634 4.6950 4.9204 4.9723 5.0620 5.1249 5.2870 5.3401 5.3455 5.4205 5.5463 5.5510 5.6815 5.7239 6.3369 6.3480 6.4660 6.4883 6.9922 6.9938 8.7417 8.7449 8.9910 9.0073 9.2527 9.2727 9.6570 9.6818 9.7656 9.7869 12.6734 12.6824 12.7280 12.7290 k = 0.1207 0.5000 0.5182 ( 12544 PWs) bands (ev): -67.2293 -67.2293 -38.6590 -38.6590 -28.9337 -28.9337 -28.8734 -28.8734 -22.7379 -22.7379 -22.6928 -22.6928 -22.6862 -22.6862 -20.5083 -20.5083 -20.4673 -20.4673 -20.4506 -20.4505 -20.4492 -20.4492 -5.4622 -5.4620 -5.2293 -5.2209 -5.1323 -5.1226 -5.0913 -5.0901 1.9929 1.9959 2.3859 2.4048 2.7929 2.8225 2.9108 2.9225 3.3107 3.3301 3.3563 3.4000 3.5451 3.5618 3.7501 3.7522 4.0597 4.1059 4.1464 4.1608 4.3423 4.3608 4.5771 4.6062 4.6453 4.6843 4.9132 4.9673 5.0562 5.1237 5.2741 5.3292 5.3377 5.4179 5.5502 5.5553 5.6717 5.7207 6.3567 6.3663 6.5012 6.5227 6.9974 6.9991 8.7312 8.7340 9.0063 9.0238 9.2679 9.2903 9.6688 9.6965 9.7736 9.7972 12.6241 12.6348 12.6701 12.6704 k = 0.1379 0.5000 0.5182 ( 12540 PWs) bands (ev): -67.2293 -67.2293 -38.6590 -38.6590 -28.9337 -28.9337 -28.8734 -28.8734 -22.7379 -22.7379 -22.6928 -22.6928 -22.6862 -22.6862 -20.5083 -20.5083 -20.4673 -20.4673 -20.4506 -20.4505 -20.4492 -20.4492 -5.4571 -5.4568 -5.2298 -5.2206 -5.1325 -5.1219 -5.0928 -5.0915 1.9966 1.9999 2.3736 2.3939 2.7622 2.7866 2.9169 2.9359 3.3004 3.3216 3.3804 3.4265 3.5459 3.5635 3.7566 3.7593 4.0661 4.1134 4.1341 4.1529 4.3344 4.3530 4.5916 4.6126 4.6268 4.6785 4.9061 4.9609 5.0511 5.1217 5.2604 5.3154 5.3306 5.4131 5.5531 5.5587 5.6612 5.7165 6.3811 6.3894 6.5387 6.5591 7.0034 7.0052 8.7231 8.7254 9.0184 9.0363 9.2881 9.3121 9.6824 9.7123 9.7829 9.8083 12.5685 12.5810 12.6071 12.6081 k = 0.1552 0.5000 0.5182 ( 12552 PWs) bands (ev): -67.2293 -67.2293 -38.6590 -38.6590 -28.9338 -28.9338 -28.8734 -28.8734 -22.7379 -22.7379 -22.6928 -22.6928 -22.6862 -22.6862 -20.5084 -20.5084 -20.4673 -20.4673 -20.4506 -20.4506 -20.4492 -20.4492 -5.4514 -5.4511 -5.2303 -5.2204 -5.1327 -5.1214 -5.0944 -5.0931 2.0007 2.0043 2.3606 2.3821 2.7289 2.7495 2.9267 2.9511 3.2900 3.3126 3.4036 3.4519 3.5476 3.5655 3.7636 3.7672 4.0733 4.1128 4.1207 4.1516 4.3267 4.3455 4.5991 4.6089 4.6155 4.6821 4.8993 4.9537 5.0465 5.1191 5.2463 5.3005 5.3223 5.4060 5.5547 5.5608 5.6503 5.7115 6.4096 6.4169 6.5780 6.5972 7.0102 7.0119 8.7174 8.7192 9.0272 9.0447 9.3133 9.3381 9.6977 9.7289 9.7935 9.8199 12.5074 12.5220 12.5403 12.5430 k = 0.1724 0.5000 0.5182 ( 12552 PWs) bands (ev): -67.2293 -67.2293 -38.6590 -38.6590 -28.9338 -28.9338 -28.8735 -28.8735 -22.7379 -22.7379 -22.6928 -22.6928 -22.6862 -22.6862 -20.5084 -20.5084 -20.4673 -20.4673 -20.4506 -20.4506 -20.4492 -20.4492 -5.4451 -5.4448 -5.2308 -5.2203 -5.1328 -5.1211 -5.0960 -5.0949 2.0051 2.0089 2.3472 2.3694 2.6943 2.7119 2.9388 2.9677 3.2796 3.3034 3.4258 3.4761 3.5504 3.5680 3.7711 3.7756 4.0809 4.1021 4.1064 4.1589 4.3193 4.3383 4.5832 4.5966 4.6277 4.6937 4.8928 4.9460 5.0424 5.1159 5.2318 5.2848 5.3127 5.3967 5.5545 5.5612 5.6391 5.7057 6.4419 6.4484 6.6187 6.6367 7.0176 7.0193 8.7144 8.7156 9.0329 9.0492 9.3431 9.3677 9.7145 9.7462 9.8052 9.8318 12.4422 12.4588 12.4710 12.4757 k = 0.1897 0.5000 0.5182 ( 12552 PWs) bands (ev): -67.2293 -67.2293 -38.6591 -38.6591 -28.9339 -28.9339 -28.8735 -28.8735 -22.7379 -22.7379 -22.6928 -22.6928 -22.6862 -22.6862 -20.5084 -20.5084 -20.4673 -20.4673 -20.4506 -20.4506 -20.4492 -20.4492 -5.4384 -5.4381 -5.2312 -5.2204 -5.1330 -5.1212 -5.0975 -5.0967 2.0097 2.0138 2.3334 2.3561 2.6594 2.6744 2.9527 2.9854 3.2696 3.2943 3.4466 3.4988 3.5544 3.5711 3.7789 3.7848 4.0853 4.0862 4.0947 4.1698 4.3124 4.3316 4.5634 4.5799 4.6438 4.7094 4.8867 4.9384 5.0386 5.1124 5.2173 5.2686 5.3020 5.3851 5.5524 5.5595 5.6280 5.6992 6.4775 6.4835 6.6604 6.6771 7.0257 7.0272 8.7141 8.7145 9.0357 9.0504 9.3766 9.4006 9.7325 9.7635 9.8180 9.8438 12.3741 12.3927 12.4001 12.4070 k = 0.2069 0.5000 0.5182 ( 12552 PWs) bands (ev): -67.2293 -67.2293 -38.6591 -38.6591 -28.9340 -28.9340 -28.8735 -28.8735 -22.7379 -22.7379 -22.6928 -22.6928 -22.6862 -22.6862 -20.5084 -20.5084 -20.4673 -20.4673 -20.4506 -20.4506 -20.4492 -20.4492 -5.4311 -5.4308 -5.2316 -5.2206 -5.1332 -5.1218 -5.0989 -5.0986 2.0146 2.0188 2.3195 2.3424 2.6244 2.6373 2.9678 3.0038 3.2602 3.2855 3.4659 3.5194 3.5598 3.5752 3.7871 3.7946 4.0677 4.0721 4.0999 4.1814 4.3060 4.3257 4.5432 4.5611 4.6603 4.7267 4.8811 4.9311 5.0350 5.1085 5.2029 5.2521 5.2904 5.3716 5.5480 5.5551 5.6174 5.6920 6.5159 6.5215 6.7027 6.7181 7.0343 7.0357 8.7161 8.7165 9.0363 9.0491 9.4130 9.4359 9.7516 9.7806 9.8319 9.8556 12.3045 12.3249 12.3285 12.3376 k = 0.2241 0.5000 0.5182 ( 12552 PWs) bands (ev): -67.2293 -67.2293 -38.6591 -38.6591 -28.9340 -28.9340 -28.8735 -28.8735 -22.7379 -22.7379 -22.6928 -22.6928 -22.6862 -22.6862 -20.5084 -20.5084 -20.4673 -20.4673 -20.4506 -20.4506 -20.4492 -20.4492 -5.4234 -5.4231 -5.2320 -5.2209 -5.1335 -5.1228 -5.1005 -5.1000 2.0197 2.0240 2.3055 2.3283 2.5897 2.6007 2.9840 3.0229 3.2516 3.2771 3.4834 3.5372 3.5667 3.5811 3.7955 3.8051 4.0476 4.0548 4.1084 4.1927 4.3002 4.3209 4.5229 4.5413 4.6768 4.7447 4.8762 4.9244 5.0315 5.1043 5.1891 5.2355 5.2780 5.3562 5.5413 5.5478 5.6076 5.6841 6.5567 6.5620 6.7453 6.7593 7.0435 7.0447 8.7203 8.7215 9.0350 9.0457 9.4515 9.4731 9.7716 9.7970 9.8468 9.8670 12.2346 12.2564 12.2571 12.2682 k = 0.2414 0.5000 0.5182 ( 12552 PWs) bands (ev): -67.2293 -67.2293 -38.6591 -38.6591 -28.9341 -28.9341 -28.8735 -28.8735 -22.7379 -22.7379 -22.6928 -22.6928 -22.6862 -22.6862 -20.5084 -20.5084 -20.4673 -20.4673 -20.4506 -20.4506 -20.4492 -20.4492 -5.4154 -5.4150 -5.2325 -5.2214 -5.1341 -5.1245 -5.1023 -5.1008 2.0250 2.0293 2.2917 2.3141 2.5556 2.5648 3.0011 3.0425 3.2440 3.2693 3.4989 3.5509 3.5753 3.5900 3.8039 3.8163 4.0268 4.0364 4.1169 4.2028 4.2949 4.3174 4.5025 4.5210 4.6930 4.7626 4.8721 4.9186 5.0282 5.0996 5.1761 5.2191 5.2651 5.3393 5.5322 5.5375 5.5988 5.6757 6.5992 6.6043 6.7876 6.8003 7.0532 7.0542 8.7269 8.7291 9.0323 9.0409 9.4913 9.5115 9.7921 9.8124 9.8625 9.8777 12.1655 12.1859 12.1893 12.1997 k = 0.2586 0.5000 0.5182 ( 12556 PWs) bands (ev): -67.2293 -67.2293 -38.6591 -38.6591 -28.9341 -28.9341 -28.8736 -28.8736 -22.7379 -22.7379 -22.6928 -22.6928 -22.6862 -22.6862 -20.5084 -20.5084 -20.4673 -20.4673 -20.4506 -20.4506 -20.4492 -20.4492 -5.4070 -5.4066 -5.2329 -5.2220 -5.1350 -5.1268 -5.1039 -5.1012 2.0305 2.0348 2.2781 2.2999 2.5222 2.5299 3.0187 3.0624 3.2375 3.2623 3.5125 3.5601 3.5855 3.6022 3.8120 3.8282 4.0059 4.0172 4.1252 4.2109 4.2903 4.3157 4.4822 4.5005 4.7089 4.7801 4.8692 4.9139 5.0249 5.0942 5.1645 5.2032 5.2520 5.3212 5.5208 5.5243 5.5906 5.6667 6.6430 6.6479 6.8293 6.8408 7.0631 7.0639 8.7358 8.7392 9.0285 9.0349 9.5316 9.5504 9.8129 9.8265 9.8788 9.8875 12.0979 12.1167 12.1234 12.1330 k = 0.2759 0.5000 0.5182 ( 12560 PWs) bands (ev): -67.2293 -67.2293 -38.6591 -38.6591 -28.9342 -28.9342 -28.8736 -28.8736 -22.7379 -22.7379 -22.6928 -22.6928 -22.6862 -22.6862 -20.5084 -20.5084 -20.4673 -20.4673 -20.4506 -20.4506 -20.4492 -20.4492 -5.3983 -5.3980 -5.2334 -5.2229 -5.1363 -5.1295 -5.1053 -5.1015 2.0362 2.0404 2.2649 2.2859 2.4896 2.4959 3.0368 3.0824 3.2323 3.2562 3.5244 3.5660 3.5970 3.6164 3.8192 3.8408 3.9858 3.9976 4.1328 4.2165 4.2862 4.3162 4.4619 4.4802 4.7242 4.7965 4.8680 4.9105 5.0216 5.0879 5.1547 5.1880 5.2389 5.3022 5.5070 5.5088 5.5829 5.6571 6.6874 6.6923 6.8699 6.8803 7.0733 7.0739 8.7469 8.7515 9.0240 9.0281 9.5720 9.5892 9.8338 9.8393 9.8954 9.8962 12.0327 12.0499 12.0600 12.0687 k = 0.2931 0.5000 0.5182 ( 12560 PWs) bands (ev): -67.2293 -67.2293 -38.6591 -38.6591 -28.9342 -28.9342 -28.8736 -28.8736 -22.7379 -22.7379 -22.6928 -22.6928 -22.6862 -22.6862 -20.5084 -20.5084 -20.4673 -20.4673 -20.4506 -20.4506 -20.4492 -20.4492 -5.3895 -5.3891 -5.2339 -5.2239 -5.1379 -5.1327 -5.1063 -5.1015 2.0421 2.0461 2.2522 2.2722 2.4581 2.4631 3.0552 3.1023 3.2284 3.2509 3.5350 3.5702 3.6095 3.6311 3.8244 3.8538 3.9679 3.9779 4.1395 4.2193 4.2827 4.3187 4.4416 4.4603 4.7388 4.8106 4.8694 4.9084 5.0182 5.0802 5.1472 5.1740 5.2261 5.2825 5.4912 5.4915 5.5753 5.6471 6.7320 6.7367 6.9092 6.9185 7.0836 7.0840 8.7599 8.7658 9.0189 9.0209 9.6118 9.6275 9.8506 9.8543 9.9037 9.9117 11.9707 11.9861 11.9996 12.0077 k = 0.3103 0.5000 0.5182 ( 12568 PWs) bands (ev): -67.2293 -67.2293 -38.6591 -38.6591 -28.9343 -28.9343 -28.8736 -28.8736 -22.7379 -22.7379 -22.6928 -22.6928 -22.6862 -22.6862 -20.5084 -20.5084 -20.4673 -20.4673 -20.4506 -20.4506 -20.4492 -20.4492 -5.3804 -5.3801 -5.2346 -5.2252 -5.1401 -5.1362 -5.1069 -5.1014 2.0482 2.0521 2.2402 2.2589 2.4277 2.4316 3.0736 3.1217 3.2259 3.2467 3.5447 3.5735 3.6225 3.6454 3.8260 3.8667 3.9541 3.9589 4.1452 4.2195 4.2795 4.3227 4.4216 4.4412 4.7527 4.8211 4.8749 4.9077 5.0147 5.0713 5.1421 5.1614 5.2138 5.2626 5.4727 5.4734 5.5679 5.6367 6.7762 6.7808 6.9466 6.9549 7.0939 7.0941 8.7743 8.7817 9.0133 9.0136 9.6505 9.6647 9.8606 9.8743 9.9097 9.9275 11.9123 11.9262 11.9429 11.9504 k = 0.3276 0.5000 0.5182 ( 12576 PWs) bands (ev): -67.2293 -67.2293 -38.6591 -38.6591 -28.9344 -28.9344 -28.8736 -28.8736 -22.7379 -22.7379 -22.6928 -22.6928 -22.6862 -22.6862 -20.5084 -20.5084 -20.4673 -20.4673 -20.4506 -20.4506 -20.4492 -20.4492 -5.3713 -5.3710 -5.2353 -5.2267 -5.1426 -5.1399 -5.1072 -5.1013 2.0546 2.0583 2.2289 2.2461 2.3986 2.4014 3.0917 3.1403 3.2248 3.2437 3.5540 3.5763 3.6355 3.6589 3.8222 3.8774 3.9426 3.9467 4.1498 4.2174 4.2762 4.3272 4.4022 4.4235 4.7657 4.8274 4.8847 4.9085 5.0108 5.0612 5.1392 5.1505 5.2024 5.2427 5.4527 5.4540 5.5605 5.6260 6.8194 6.8239 6.9819 6.9893 7.1040 7.1041 8.7899 8.7988 9.0057 9.0083 9.6875 9.7002 9.8692 9.8934 9.9144 9.9423 11.8583 11.8707 11.8905 11.8974 k = 0.3448 0.5000 0.5182 ( 12584 PWs) bands (ev): -67.2293 -67.2293 -38.6591 -38.6591 -28.9344 -28.9344 -28.8737 -28.8737 -22.7379 -22.7379 -22.6928 -22.6928 -22.6862 -22.6862 -20.5084 -20.5084 -20.4673 -20.4673 -20.4506 -20.4506 -20.4492 -20.4492 -5.3622 -5.3619 -5.2363 -5.2285 -5.1454 -5.1437 -5.1072 -5.1011 2.0613 2.0649 2.2183 2.2339 2.3709 2.3728 3.1092 3.1576 3.2252 3.2419 3.5631 3.5789 3.6481 3.6712 3.8123 3.8802 3.9350 3.9464 4.1531 4.2137 4.2723 4.3301 4.3848 4.4077 4.7779 4.8308 4.8978 4.9106 5.0067 5.0504 5.1384 5.1415 5.1921 5.2230 5.4318 5.4332 5.5535 5.6151 6.8610 6.8655 7.0147 7.0212 7.1137 7.1140 8.8062 8.8168 8.9982 9.0032 9.7223 9.7337 9.8766 9.9106 9.9183 9.9558 11.8090 11.8200 11.8425 11.8491 k = 0.3621 0.5000 0.5182 ( 12568 PWs) bands (ev): -67.2293 -67.2293 -38.6591 -38.6591 -28.9345 -28.9345 -28.8737 -28.8737 -22.7379 -22.7379 -22.6928 -22.6928 -22.6862 -22.6862 -20.5084 -20.5084 -20.4673 -20.4673 -20.4506 -20.4506 -20.4492 -20.4492 -5.3532 -5.3529 -5.2374 -5.2305 -5.1484 -5.1475 -5.1070 -5.1010 2.0685 2.0718 2.2086 2.2223 2.3446 2.3457 3.1258 3.1729 3.2270 3.2417 3.5723 3.5816 3.6603 3.6823 3.7975 3.8700 3.9412 3.9524 4.1550 4.2087 4.2671 4.3278 4.3726 4.3947 4.7892 4.8326 4.9125 4.9139 5.0025 5.0392 5.1344 5.1394 5.1834 5.2038 5.4103 5.4113 5.5471 5.6042 6.9006 6.9049 7.0447 7.0502 7.1228 7.1234 8.8227 8.8350 8.9910 8.9984 9.7544 9.7648 9.8828 9.9174 9.9296 9.9678 11.7649 11.7745 11.7996 11.8058 k = 0.3793 0.5000 0.5182 ( 12556 PWs) bands (ev): -67.2293 -67.2293 -38.6592 -38.6592 -28.9345 -28.9345 -28.8737 -28.8737 -22.7379 -22.7379 -22.6928 -22.6928 -22.6862 -22.6862 -20.5084 -20.5084 -20.4673 -20.4673 -20.4506 -20.4506 -20.4492 -20.4492 -5.3444 -5.3441 -5.2388 -5.2328 -5.1515 -5.1512 -5.1066 -5.1009 2.0761 2.0792 2.1998 2.2115 2.3200 2.3204 3.1411 3.1854 3.2305 3.2435 3.5817 3.5844 3.6717 3.6920 3.7800 3.8524 3.9558 3.9628 4.1555 4.2028 4.2601 4.3169 4.3685 4.3849 4.7996 4.8338 4.9179 4.9275 4.9985 5.0278 5.1288 5.1418 5.1768 5.1856 5.3885 5.3889 5.5414 5.5934 6.9375 6.9416 7.0714 7.0761 7.1314 7.1324 8.8389 8.8528 8.9844 8.9940 9.7835 9.7932 9.8880 9.9178 9.9443 9.9781 11.7262 11.7345 11.7617 11.7676 k = 0.3966 0.5000 0.5182 ( 12564 PWs) bands (ev): -67.2293 -67.2293 -38.6592 -38.6592 -28.9345 -28.9345 -28.8737 -28.8737 -22.7379 -22.7379 -22.6928 -22.6928 -22.6862 -22.6862 -20.5084 -20.5084 -20.4673 -20.4673 -20.4506 -20.4506 -20.4492 -20.4492 -5.3359 -5.3356 -5.2405 -5.2355 -5.1547 -5.1545 -5.1061 -5.1008 2.0843 2.0872 2.1919 2.2014 2.2969 2.2973 3.1546 3.1943 3.2354 3.2476 3.5876 3.5914 3.6822 3.7001 3.7616 3.8323 3.9738 3.9762 4.1543 4.1958 4.2516 4.3004 4.3697 4.3785 4.8091 4.8349 4.9225 4.9422 4.9950 5.0164 5.1242 5.1454 5.1688 5.1728 5.3662 5.3667 5.5366 5.5830 6.9713 6.9752 7.0948 7.0984 7.1393 7.1407 8.8543 8.8697 8.9785 8.9902 9.8091 9.8185 9.8923 9.9167 9.9576 9.9866 11.6930 11.7002 11.7293 11.7348 k = 0.4138 0.5000 0.5182 ( 12568 PWs) bands (ev): -67.2293 -67.2293 -38.6592 -38.6592 -28.9346 -28.9346 -28.8737 -28.8737 -22.7379 -22.7379 -22.6928 -22.6928 -22.6862 -22.6862 -20.5084 -20.5084 -20.4673 -20.4673 -20.4506 -20.4506 -20.4492 -20.4492 -5.3278 -5.3275 -5.2424 -5.2383 -5.1578 -5.1573 -5.1055 -5.1009 2.0930 2.0957 2.1846 2.1919 2.2756 2.2766 3.1661 3.1996 3.2416 3.2535 3.5914 3.6012 3.6917 3.7067 3.7437 3.8116 3.9915 3.9935 4.1512 4.1876 4.2422 4.2825 4.3724 4.3751 4.8177 4.8361 4.9272 4.9560 4.9925 5.0051 5.1200 5.1471 5.1567 5.1718 5.3438 5.3453 5.5330 5.5730 7.0013 7.0048 7.1145 7.1169 7.1464 7.1484 8.8684 8.8848 8.9736 8.9869 9.8312 9.8406 9.8959 9.9144 9.9691 9.9932 11.6654 11.6714 11.7022 11.7072 k = 0.4310 0.5000 0.5182 ( 12568 PWs) bands (ev): -67.2293 -67.2293 -38.6592 -38.6592 -28.9346 -28.9346 -28.8737 -28.8737 -22.7379 -22.7379 -22.6928 -22.6928 -22.6862 -22.6862 -20.5084 -20.5084 -20.4673 -20.4673 -20.4506 -20.4506 -20.4492 -20.4492 -5.3204 -5.3201 -5.2445 -5.2413 -5.1605 -5.1598 -5.1048 -5.1010 2.1022 2.1048 2.1780 2.1828 2.2568 2.2583 3.1755 3.2021 3.2487 3.2599 3.5959 3.6106 3.7000 3.7115 3.7277 3.7911 4.0081 4.0140 4.1458 4.1778 4.2334 4.2652 4.3740 4.3750 4.8251 4.8373 4.9320 4.9684 4.9914 4.9941 5.1160 5.1367 5.1597 5.1738 5.3224 5.3248 5.5308 5.5637 7.0270 7.0301 7.1302 7.1313 7.1527 7.1554 8.8808 8.8973 8.9702 8.9842 9.8495 9.8593 9.8989 9.9111 9.9788 9.9979 11.6432 11.6480 11.6806 11.6849 k = 0.4483 0.5000 0.5182 ( 12568 PWs) bands (ev): -67.2293 -67.2293 -38.6592 -38.6592 -28.9346 -28.9346 -28.8737 -28.8737 -22.7379 -22.7379 -22.6928 -22.6928 -22.6862 -22.6862 -20.5084 -20.5084 -20.4673 -20.4673 -20.4506 -20.4506 -20.4492 -20.4492 -5.3139 -5.3137 -5.2467 -5.2444 -5.1626 -5.1620 -5.1041 -5.1012 2.1120 2.1144 2.1714 2.1739 2.2411 2.2430 3.1831 3.2026 3.2559 3.2656 3.6012 3.6187 3.7064 3.7146 3.7160 3.7715 4.0253 4.0344 4.1378 4.1660 4.2266 4.2500 4.3744 4.3770 4.8312 4.8386 4.9368 4.9786 4.9836 4.9916 5.1122 5.1254 5.1671 5.1781 5.3028 5.3059 5.5299 5.5552 7.0479 7.0505 7.1417 7.1418 7.1585 7.1616 8.8913 8.9063 8.9687 8.9819 9.8641 9.8746 9.9012 9.9072 9.9866 10.0009 11.6264 11.6300 11.6642 11.6677 k = 0.4655 0.5000 0.5182 ( 12572 PWs) bands (ev): -67.2293 -67.2293 -38.6592 -38.6592 -28.9346 -28.9346 -28.8737 -28.8737 -22.7379 -22.7379 -22.6928 -22.6928 -22.6862 -22.6862 -20.5084 -20.5084 -20.4673 -20.4673 -20.4506 -20.4506 -20.4492 -20.4492 -5.3087 -5.3085 -5.2487 -5.2471 -5.1641 -5.1636 -5.1035 -5.1015 2.1222 2.1245 2.1644 2.1649 2.2293 2.2311 3.1890 3.2018 3.2624 3.2696 3.6073 3.6237 3.7058 3.7156 3.7157 3.7535 4.0424 4.0535 4.1284 4.1521 4.2227 4.2380 4.3755 4.3781 4.8357 4.8397 4.9421 4.9733 4.9866 4.9927 5.1091 5.1165 5.1752 5.1833 5.2864 5.2896 5.5306 5.5477 7.0635 7.0653 7.1485 7.1492 7.1636 7.1663 8.8998 8.9113 8.9693 8.9796 9.8756 9.8863 9.9026 9.9027 9.9927 10.0022 11.6147 11.6171 11.6529 11.6554 k = 0.4828 0.5000 0.5182 ( 12568 PWs) bands (ev): -67.2293 -67.2293 -38.6592 -38.6592 -28.9346 -28.9346 -28.8737 -28.8737 -22.7379 -22.7379 -22.6928 -22.6928 -22.6862 -22.6862 -20.5084 -20.5084 -20.4673 -20.4673 -20.4506 -20.4506 -20.4492 -20.4492 -5.3053 -5.3052 -5.2499 -5.2492 -5.1650 -5.1647 -5.1029 -5.1019 2.1323 2.1343 2.1558 2.1566 2.2222 2.2233 3.1937 3.2001 3.2675 3.2713 3.6139 3.6240 3.7057 3.7143 3.7210 3.7384 4.0579 4.0673 4.1214 4.1370 4.2218 4.2294 4.3768 4.3783 4.8386 4.8403 4.9483 4.9639 4.9915 4.9938 5.1073 5.1105 5.1827 5.1872 5.2753 5.2775 5.5327 5.5414 7.0733 7.0743 7.1524 7.1529 7.1675 7.1691 8.9063 8.9125 8.9714 8.9771 9.8844 9.8943 9.8981 9.9025 9.9972 10.0019 11.6080 11.6092 11.6466 11.6478 k = 0.5000 0.5000 0.5182 ( 12608 PWs) bands (ev): -67.2293 -67.2293 -38.6592 -38.6592 -28.9347 -28.9347 -28.8737 -28.8737 -22.7379 -22.7379 -22.6928 -22.6928 -22.6862 -22.6862 -20.5084 -20.5084 -20.4673 -20.4673 -20.4506 -20.4506 -20.4492 -20.4492 -5.3040 -5.3040 -5.2502 -5.2502 -5.1652 -5.1652 -5.1024 -5.1024 2.1397 2.1397 2.1503 2.1503 2.2203 2.2203 3.1974 3.1974 3.2706 3.2706 3.6201 3.6201 3.7101 3.7101 3.7278 3.7278 4.0687 4.0687 4.1243 4.1243 4.2240 4.2240 4.3778 4.3778 4.8401 4.8401 4.9556 4.9556 4.9937 4.9937 5.1075 5.1075 5.1873 5.1873 5.2721 5.2721 5.5364 5.5364 7.0770 7.0770 7.1538 7.1538 7.1695 7.1695 8.9106 8.9106 8.9743 8.9743 9.8914 9.8914 9.9002 9.9002 10.0003 10.0003 11.6061 11.6061 11.6449 11.6449 k = 0.5000 0.5000 0.5182 ( 12608 PWs) bands (ev): -67.2293 -67.2293 -38.6592 -38.6592 -28.9347 -28.9347 -28.8737 -28.8737 -22.7379 -22.7379 -22.6928 -22.6928 -22.6862 -22.6862 -20.5084 -20.5084 -20.4673 -20.4673 -20.4506 -20.4506 -20.4492 -20.4492 -5.3040 -5.3040 -5.2502 -5.2502 -5.1652 -5.1652 -5.1024 -5.1024 2.1397 2.1397 2.1503 2.1503 2.2203 2.2203 3.1974 3.1974 3.2706 3.2706 3.6201 3.6201 3.7101 3.7101 3.7278 3.7278 4.0687 4.0687 4.1243 4.1243 4.2240 4.2240 4.3778 4.3778 4.8401 4.8401 4.9556 4.9556 4.9937 4.9937 5.1075 5.1075 5.1873 5.1873 5.2721 5.2721 5.5364 5.5364 7.0770 7.0770 7.1538 7.1538 7.1695 7.1695 8.9106 8.9106 8.9743 8.9743 9.8914 9.8914 9.9002 9.9002 10.0003 10.0003 11.6061 11.6061 11.6449 11.6449 k = 0.4878 0.4878 0.5182 ( 12566 PWs) bands (ev): -67.2293 -67.2293 -38.6592 -38.6592 -28.9346 -28.9346 -28.8737 -28.8737 -22.7379 -22.7379 -22.6928 -22.6928 -22.6862 -22.6862 -20.5084 -20.5084 -20.4673 -20.4673 -20.4506 -20.4506 -20.4492 -20.4492 -5.3053 -5.3052 -5.2499 -5.2491 -5.1650 -5.1647 -5.1029 -5.1019 2.1318 2.1352 2.1543 2.1576 2.2223 2.2234 3.1937 3.2001 3.2675 3.2713 3.6137 3.6243 3.7053 3.7134 3.7232 3.7375 4.0579 4.0674 4.1214 4.1370 4.2218 4.2294 4.3768 4.3783 4.8385 4.8404 4.9482 4.9640 4.9920 4.9933 5.1072 5.1106 5.1827 5.1872 5.2753 5.2775 5.5327 5.5414 7.0733 7.0743 7.1524 7.1529 7.1674 7.1691 8.9062 8.9126 8.9713 8.9771 9.8841 9.8960 9.8967 9.9025 9.9973 10.0019 11.6078 11.6090 11.6467 11.6480 k = 0.4756 0.4756 0.5182 ( 12570 PWs) bands (ev): -67.2293 -67.2293 -38.6592 -38.6592 -28.9346 -28.9346 -28.8737 -28.8737 -22.7379 -22.7379 -22.6928 -22.6928 -22.6862 -22.6862 -20.5084 -20.5084 -20.4673 -20.4673 -20.4506 -20.4506 -20.4492 -20.4492 -5.3088 -5.3087 -5.2487 -5.2469 -5.1642 -5.1636 -5.1036 -5.1015 2.1216 2.1276 2.1593 2.1660 2.2301 2.2316 3.1890 3.2019 3.2625 3.2695 3.6057 3.6255 3.7021 3.7108 3.7287 3.7488 4.0422 4.0536 4.1287 4.1523 4.2223 4.2379 4.3760 4.3778 4.8348 4.8404 4.9419 4.9735 4.9893 4.9902 5.1084 5.1174 5.1753 5.1831 5.2863 5.2896 5.5306 5.5477 7.0635 7.0653 7.1485 7.1497 7.1631 7.1662 8.8997 8.9123 8.9683 8.9798 9.8729 9.8917 9.8971 9.9051 9.9932 10.0020 11.6126 11.6148 11.6550 11.6576 k = 0.4634 0.4634 0.5182 ( 12562 PWs) bands (ev): -67.2293 -67.2293 -38.6592 -38.6592 -28.9346 -28.9346 -28.8737 -28.8737 -22.7379 -22.7379 -22.6928 -22.6928 -22.6862 -22.6862 -20.5084 -20.5084 -20.4673 -20.4673 -20.4506 -20.4506 -20.4492 -20.4492 -5.3142 -5.3142 -5.2467 -5.2436 -5.1627 -5.1619 -5.1044 -5.1009 2.1126 2.1208 2.1618 2.1712 2.2442 2.2450 3.1830 3.2026 3.2561 3.2653 3.5966 3.6229 3.7009 3.7097 3.7375 3.7608 4.0250 4.0347 4.1394 4.1667 4.2249 4.2495 4.3761 4.3761 4.8283 4.8410 4.9362 4.9811 4.9817 4.9920 5.1103 5.1281 5.1672 5.1773 5.3024 5.3059 5.5300 5.5553 7.0480 7.0504 7.1421 7.1440 7.1565 7.1608 8.8913 8.9098 8.9651 8.9823 9.8570 9.8884 9.8906 9.9093 9.9885 10.0004 11.6174 11.6204 11.6730 11.6771 k = 0.4512 0.4512 0.5182 ( 12554 PWs) bands (ev): -67.2293 -67.2293 -38.6592 -38.6592 -28.9346 -28.9346 -28.8737 -28.8737 -22.7379 -22.7379 -22.6928 -22.6928 -22.6862 -22.6862 -20.5084 -20.5084 -20.4673 -20.4673 -20.4506 -20.4506 -20.4492 -20.4492 -5.3215 -5.3213 -5.2443 -5.2395 -5.1607 -5.1596 -5.1053 -5.1003 2.1056 2.1156 2.1618 2.1731 2.2626 2.2637 3.1752 3.2020 3.2490 3.2591 3.5864 3.6166 3.7015 3.7122 3.7470 3.7731 4.0077 4.0146 4.1502 4.1793 4.2288 4.2639 4.3733 4.3783 4.8187 4.8424 4.9312 4.9693 4.9842 5.0026 5.1127 5.1419 5.1601 5.1715 5.3213 5.3247 5.5310 5.5639 7.0272 7.0301 7.1331 7.1358 7.1477 7.1528 8.8815 8.9057 8.9618 8.9845 9.8365 9.8788 9.8854 9.9121 9.9841 9.9973 11.6211 11.6247 11.7021 11.7076 k = 0.4390 0.4390 0.5182 ( 12562 PWs) bands (ev): -67.2293 -67.2293 -38.6592 -38.6592 -28.9346 -28.9346 -28.8737 -28.8737 -22.7379 -22.7379 -22.6928 -22.6928 -22.6862 -22.6862 -20.5084 -20.5084 -20.4673 -20.4673 -20.4506 -20.4506 -20.4492 -20.4492 -5.3302 -5.3298 -5.2417 -5.2348 -5.1583 -5.1567 -5.1064 -5.0994 2.1006 2.1123 2.1597 2.1724 2.2836 2.2872 3.1655 3.1994 3.2420 3.2519 3.5756 3.6072 3.7034 3.7176 3.7565 3.7855 3.9914 3.9949 4.1605 4.1900 4.2327 4.2802 4.3696 4.3835 4.8063 4.8451 4.9267 4.9550 4.9856 5.0171 5.1156 5.1499 5.1625 5.1668 5.3416 5.3449 5.5337 5.5735 7.0016 7.0048 7.1213 7.1249 7.1370 7.1423 8.8710 8.9005 8.9582 8.9862 9.8122 9.8625 9.8818 9.9117 9.9809 9.9925 11.6246 11.6286 11.7415 11.7483 k = 0.4268 0.4268 0.5182 ( 12562 PWs) bands (ev): -67.2293 -67.2293 -38.6592 -38.6592 -28.9345 -28.9345 -28.8737 -28.8737 -22.7379 -22.7379 -22.6928 -22.6928 -22.6862 -22.6862 -20.5084 -20.5084 -20.4673 -20.4673 -20.4506 -20.4506 -20.4492 -20.4492 -5.3403 -5.3396 -5.2392 -5.2296 -5.1555 -5.1534 -5.1075 -5.0983 2.0978 2.1109 2.1561 2.1699 2.3072 2.3137 3.1536 3.1936 3.2357 3.2453 3.5642 3.5958 3.7061 3.7251 3.7655 3.7976 3.9766 3.9767 4.1704 4.1993 4.2358 4.2976 4.3655 4.3921 4.7917 4.8488 4.9224 4.9393 4.9877 5.0330 5.1193 5.1451 5.1633 5.1808 5.3624 5.3657 5.5380 5.5839 6.9719 6.9754 7.1065 7.1111 7.1244 7.1297 8.8602 8.8945 8.9546 8.9875 9.7844 9.8419 9.8769 9.9068 9.9793 9.9863 11.6289 11.6332 11.7902 11.7983 k = 0.4146 0.4146 0.5182 ( 12570 PWs) bands (ev): -67.2293 -67.2293 -38.6592 -38.6592 -28.9345 -28.9345 -28.8737 -28.8737 -22.7379 -22.7379 -22.6928 -22.6928 -22.6862 -22.6862 -20.5084 -20.5084 -20.4673 -20.4673 -20.4506 -20.4506 -20.4492 -20.4492 -5.3515 -5.3505 -5.2367 -5.2238 -5.1527 -5.1496 -5.1085 -5.0967 2.0971 2.1115 2.1513 2.1661 2.3327 2.3423 3.1395 3.1836 3.2304 3.2405 3.5525 3.5832 3.7088 3.7335 3.7736 3.8094 3.9605 3.9642 4.1801 4.2074 4.2384 4.3148 4.3620 4.4038 4.7754 4.8536 4.9155 4.9262 4.9904 5.0492 5.1243 5.1400 5.1613 5.2019 5.3830 5.3865 5.5438 5.5952 6.9387 6.9424 7.0886 7.0944 7.1102 7.1152 8.8495 8.8883 8.9508 8.9881 9.7539 9.8174 9.8700 9.8971 9.9786 9.9789 11.6347 11.6390 11.8474 11.8568 k = 0.4024 0.4024 0.5182 ( 12566 PWs) bands (ev): -67.2293 -67.2293 -38.6591 -38.6591 -28.9345 -28.9345 -28.8737 -28.8737 -22.7379 -22.7379 -22.6928 -22.6928 -22.6862 -22.6862 -20.5084 -20.5084 -20.4673 -20.4673 -20.4506 -20.4506 -20.4492 -20.4492 -5.3637 -5.3624 -5.2346 -5.2175 -5.1501 -5.1454 -5.1091 -5.0947 2.0980 2.1138 2.1458 2.1612 2.3597 2.3725 3.1234 3.1695 3.2263 3.2380 3.5406 3.5697 3.7107 3.7417 3.7808 3.8207 3.9473 3.9545 4.1898 4.2139 4.2419 4.3287 4.3622 4.4181 4.7582 4.8589 4.9007 4.9217 4.9936 5.0644 5.1311 5.1355 5.1611 5.2243 5.4027 5.4069 5.5512 5.6072 6.9027 6.9067 7.0676 7.0746 7.0946 7.0991 8.8393 8.8822 8.9469 8.9880 9.7210 9.7895 9.8605 9.8835 9.9695 9.9787 11.6422 11.6465 11.9126 11.9231 k = 0.3902 0.3902 0.5182 ( 12562 PWs) bands (ev): -67.2293 -67.2293 -38.6591 -38.6591 -28.9344 -28.9344 -28.8737 -28.8737 -22.7379 -22.7379 -22.6928 -22.6928 -22.6862 -22.6862 -20.5084 -20.5084 -20.4673 -20.4673 -20.4506 -20.4506 -20.4492 -20.4492 -5.3768 -5.3753 -5.2328 -5.2108 -5.1483 -5.1409 -5.1088 -5.0920 2.0999 2.1176 2.1403 2.1557 2.3877 2.4037 3.1056 3.1521 3.2234 3.2373 3.5287 3.5559 3.7112 3.7484 3.7877 3.8315 3.9376 3.9476 4.1996 4.2185 4.2477 4.3345 4.3710 4.4341 4.7404 4.8644 4.8836 4.9211 4.9971 5.0776 5.1316 5.1392 5.1641 5.2476 5.4212 5.4264 5.5600 5.6199 6.8646 6.8690 7.0437 7.0516 7.0777 7.0817 8.8299 8.8765 8.9430 8.9870 9.6864 9.7587 9.8483 9.8664 9.9590 9.9776 11.6516 11.6558 11.9848 11.9966 k = 0.3780 0.3780 0.5182 ( 12564 PWs) bands (ev): -67.2293 -67.2293 -38.6591 -38.6591 -28.9343 -28.9343 -28.8736 -28.8736 -22.7379 -22.7379 -22.6928 -22.6928 -22.6862 -22.6862 -20.5084 -20.5084 -20.4673 -20.4673 -20.4506 -20.4506 -20.4492 -20.4492 -5.3908 -5.3890 -5.2316 -5.2037 -5.1477 -5.1359 -5.1072 -5.0887 2.1012 2.1214 2.1364 2.1509 2.4163 2.4355 3.0867 3.1324 3.2216 3.2378 3.5170 3.5419 3.7100 3.7520 3.7954 3.8418 3.9316 3.9434 4.2097 4.2223 4.2561 4.3339 4.3868 4.4510 4.7225 4.8659 4.8698 4.9230 5.0008 5.0883 5.1281 5.1463 5.1725 5.2714 5.4381 5.4445 5.5703 5.6333 6.8252 6.8301 7.0169 7.0257 7.0595 7.0631 8.8215 8.8715 8.9390 8.9852 9.6509 9.7253 9.8331 9.8465 9.9469 9.9749 11.6631 11.6671 12.0635 12.0765 k = 0.3659 0.3659 0.5182 ( 12556 PWs) bands (ev): -67.2293 -67.2293 -38.6591 -38.6591 -28.9343 -28.9343 -28.8736 -28.8736 -22.7379 -22.7379 -22.6928 -22.6928 -22.6862 -22.6862 -20.5084 -20.5084 -20.4673 -20.4673 -20.4506 -20.4506 -20.4492 -20.4492 -5.4054 -5.4035 -5.2309 -5.1961 -5.1487 -5.1305 -5.1040 -5.0847 2.0988 2.1218 2.1369 2.1500 2.4450 2.4674 3.0669 3.1113 3.2208 3.2392 3.5055 3.5280 3.7070 3.7518 3.8048 3.8519 3.9290 3.9411 4.2201 4.2273 4.2662 4.3321 4.4048 4.4683 4.7049 4.8494 4.8734 4.9276 5.0047 5.0967 5.1250 5.1512 5.1871 5.2953 5.4529 5.4610 5.5818 5.6473 6.7852 6.7907 6.9873 6.9969 7.0403 7.0433 8.8143 8.8672 8.9350 8.9823 9.6149 9.6899 9.8150 9.8241 9.9333 9.9703 11.6765 11.6803 12.1478 12.1619 k = 0.3537 0.3537 0.5182 ( 12552 PWs) bands (ev): -67.2293 -67.2293 -38.6591 -38.6591 -28.9342 -28.9342 -28.8736 -28.8736 -22.7379 -22.7379 -22.6928 -22.6928 -22.6862 -22.6862 -20.5084 -20.5084 -20.4673 -20.4673 -20.4506 -20.4506 -20.4492 -20.4492 -5.4207 -5.4187 -5.2310 -5.1881 -5.1512 -5.1246 -5.0992 -5.0799 2.0917 2.1159 2.1429 2.1559 2.4734 2.4988 3.0468 3.0893 3.2209 3.2412 3.4943 3.5142 3.7024 3.7484 3.8160 3.8620 3.9292 3.9398 4.2308 4.2349 4.2774 4.3311 4.4231 4.4855 4.6879 4.8334 4.8760 4.9348 5.0086 5.1032 5.1223 5.1555 5.2054 5.3190 5.4653 5.4753 5.5946 5.6621 6.7454 6.7517 6.9552 6.9655 7.0202 7.0226 8.8083 8.8636 8.9310 8.9783 9.5793 9.6528 9.7941 9.7995 9.9181 9.9635 11.6918 11.6953 12.2368 12.2522 k = 0.3415 0.3415 0.5182 ( 12564 PWs) bands (ev): -67.2293 -67.2293 -38.6591 -38.6591 -28.9341 -28.9341 -28.8736 -28.8736 -22.7379 -22.7379 -22.6928 -22.6928 -22.6862 -22.6862 -20.5084 -20.5084 -20.4673 -20.4673 -20.4506 -20.4506 -20.4492 -20.4492 -5.4366 -5.4345 -5.2317 -5.1797 -5.1549 -5.1183 -5.0932 -5.0744 2.0811 2.1059 2.1529 2.1662 2.5009 2.5291 3.0269 3.0670 3.2218 3.2436 3.4836 3.5008 3.6969 3.7431 3.8282 3.8722 3.9313 3.9385 4.2418 4.2461 4.2894 4.3319 4.4411 4.5021 4.6719 4.8183 4.8776 4.9443 5.0125 5.1084 5.1199 5.1603 5.2255 5.3421 5.4751 5.4874 5.6086 5.6778 6.7064 6.7137 6.9207 6.9318 6.9993 7.0011 8.8035 8.8606 8.9271 8.9730 9.5448 9.6147 9.7707 9.7729 9.9013 9.9545 11.7088 11.7121 12.3299 12.3465 k = 0.3293 0.3293 0.5182 ( 12572 PWs) bands (ev): -67.2293 -67.2293 -38.6591 -38.6591 -28.9341 -28.9341 -28.8735 -28.8735 -22.7379 -22.7379 -22.6928 -22.6928 -22.6862 -22.6862 -20.5084 -20.5084 -20.4673 -20.4673 -20.4506 -20.4506 -20.4492 -20.4492 -5.4529 -5.4507 -5.2333 -5.1710 -5.1595 -5.1114 -5.0861 -5.0682 2.0684 2.0934 2.1655 2.1792 2.5271 2.5576 3.0075 3.0449 3.2234 3.2463 3.4736 3.4880 3.6910 3.7373 3.8410 3.8825 3.9348 3.9369 4.2529 4.2615 4.3017 4.3351 4.4585 4.5177 4.6571 4.8042 4.8785 4.9557 5.0165 5.1126 5.1177 5.1662 5.2461 5.3640 5.4818 5.4969 5.6238 5.6943 6.6688 6.6772 6.8841 6.8960 6.9779 6.9789 8.8000 8.8578 8.9230 8.9665 9.5119 9.5759 9.7446 9.7449 9.8830 9.9435 11.7273 11.7304 12.4263 12.4439 k = 0.3171 0.3171 0.5182 ( 12576 PWs) bands (ev): -67.2293 -67.2293 -38.6591 -38.6591 -28.9340 -28.9340 -28.8735 -28.8735 -22.7379 -22.7379 -22.6928 -22.6928 -22.6862 -22.6862 -20.5084 -20.5084 -20.4673 -20.4673 -20.4506 -20.4506 -20.4492 -20.4492 -5.4695 -5.4674 -5.2355 -5.1662 -5.1607 -5.1041 -5.0784 -5.0615 2.0540 2.0793 2.1799 2.1938 2.5514 2.5836 2.9892 3.0234 3.2256 3.2490 3.4644 3.4758 3.6852 3.7316 3.8538 3.8922 3.9355 3.9394 4.2639 4.2810 4.3142 4.3409 4.4753 4.5319 4.6442 4.7913 4.8791 4.9685 5.0206 5.1156 5.1159 5.1732 5.2666 5.3845 5.4852 5.5038 5.6404 5.7121 6.6329 6.6426 6.8456 6.8584 6.9559 6.9561 8.7975 8.8546 8.9189 8.9590 9.4814 9.5368 9.7147 9.7170 9.8633 9.9306 11.7470 11.7500 12.5251 12.5439 k = 0.3049 0.3049 0.5182 ( 12582 PWs) bands (ev): -67.2293 -67.2293 -38.6591 -38.6591 -28.9339 -28.9339 -28.8735 -28.8735 -22.7379 -22.7379 -22.6928 -22.6928 -22.6862 -22.6862 -20.5084 -20.5084 -20.4673 -20.4673 -20.4506 -20.4506 -20.4492 -20.4492 -5.4864 -5.4843 -5.2384 -5.1717 -5.1518 -5.0964 -5.0700 -5.0542 2.0384 2.0637 2.1958 2.2096 2.5731 2.6062 2.9728 3.0032 3.2282 3.2517 3.4562 3.4644 3.6801 3.7266 3.8662 3.8994 3.9363 3.9454 4.2747 4.3041 4.3268 4.3498 4.4911 4.5440 4.6337 4.7797 4.8796 4.9825 5.0247 5.1137 5.1187 5.1811 5.2866 5.4028 5.4851 5.5082 5.6584 5.7311 6.5989 6.6100 6.8059 6.8196 6.9329 6.9337 8.7962 8.8504 8.9146 8.9512 9.4537 9.4980 9.6835 9.6873 9.8423 9.9160 11.7676 11.7706 12.6258 12.6457 k = 0.2927 0.2927 0.5182 ( 12574 PWs) bands (ev): -67.2293 -67.2293 -38.6590 -38.6590 -28.9338 -28.9338 -28.8735 -28.8735 -22.7379 -22.7379 -22.6928 -22.6928 -22.6862 -22.6862 -20.5084 -20.5084 -20.4673 -20.4673 -20.4506 -20.4506 -20.4492 -20.4492 -5.5035 -5.5015 -5.2418 -5.1782 -5.1421 -5.0882 -5.0611 -5.0464 2.0216 2.0469 2.2127 2.2264 2.5917 2.6247 2.9589 2.9849 3.2310 3.2542 3.4491 3.4540 3.6757 3.7224 3.8776 3.9015 3.9422 3.9532 4.2850 4.3299 4.3398 4.3618 4.5062 4.5532 4.6268 4.7693 4.8802 4.9973 5.0288 5.1117 5.1211 5.1899 5.3056 5.4182 5.4817 5.5106 5.6780 5.7516 6.5666 6.5791 6.7656 6.7802 6.9094 6.9112 8.7958 8.8439 8.9100 8.9440 9.4294 9.4599 9.6512 9.6559 9.8203 9.8999 11.7889 11.7920 12.7278 12.7486 k = 0.2805 0.2805 0.5182 ( 12570 PWs) bands (ev): -67.2293 -67.2293 -38.6590 -38.6590 -28.9338 -28.9338 -28.8734 -28.8734 -22.7379 -22.7379 -22.6928 -22.6928 -22.6862 -22.6862 -20.5083 -20.5083 -20.4673 -20.4673 -20.4506 -20.4505 -20.4492 -20.4492 -5.5207 -5.5187 -5.2458 -5.1852 -5.1320 -5.0796 -5.0519 -5.0383 2.0038 2.0290 2.2304 2.2437 2.6064 2.6382 2.9482 2.9689 3.2339 3.2561 3.4433 3.4448 3.6723 3.7190 3.8878 3.8992 3.9534 3.9635 4.2948 4.3488 4.3617 4.3767 4.5204 4.5587 4.6245 4.7603 4.8810 5.0129 5.0330 5.1098 5.1232 5.1992 5.3233 5.4297 5.4749 5.5117 5.6993 5.7738 6.5355 6.5491 6.7259 6.7413 6.8857 6.8887 8.7961 8.8338 8.9050 8.9386 9.4086 9.4229 9.6182 9.6233 9.7974 9.8825 11.8105 11.8138 12.8304 12.8522 k = 0.2683 0.2683 0.5182 ( 12562 PWs) bands (ev): -67.2293 -67.2293 -38.6590 -38.6590 -28.9337 -28.9337 -28.8734 -28.8734 -22.7379 -22.7379 -22.6928 -22.6928 -22.6862 -22.6862 -20.5083 -20.5083 -20.4673 -20.4673 -20.4506 -20.4505 -20.4492 -20.4492 -5.5378 -5.5360 -5.2502 -5.1925 -5.1218 -5.0708 -5.0423 -5.0298 1.9852 2.0102 2.2486 2.2615 2.6167 2.6461 2.9414 2.9561 3.2366 3.2575 3.4370 3.4390 3.6698 3.7160 3.8950 3.8972 3.9677 3.9765 4.3040 4.3601 4.3924 4.3941 4.5338 4.5605 4.6267 4.7525 4.8820 5.0290 5.0372 5.1077 5.1252 5.2088 5.3393 5.4363 5.4654 5.5128 5.7223 5.7978 6.5043 6.5185 6.6884 6.7042 6.8619 6.8662 8.7971 8.8195 8.8993 8.9358 9.3876 9.3914 9.5847 9.5897 9.7739 9.8640 11.8321 11.8356 12.9332 12.9558 k = 0.2561 0.2561 0.5182 ( 12566 PWs) bands (ev): -67.2293 -67.2293 -38.6590 -38.6590 -28.9336 -28.9336 -28.8734 -28.8734 -22.7379 -22.7379 -22.6928 -22.6928 -22.6862 -22.6862 -20.5083 -20.5083 -20.4673 -20.4673 -20.4506 -20.4505 -20.4492 -20.4492 -5.5549 -5.5532 -5.2550 -5.2000 -5.1114 -5.0618 -5.0326 -5.0212 1.9659 1.9905 2.2670 2.2793 2.6223 2.6483 2.9387 2.9466 3.2388 3.2581 3.4306 3.4362 3.6678 3.7127 3.8909 3.9066 3.9842 3.9921 4.3127 4.3698 4.4134 4.4248 4.5467 4.5605 4.6324 4.7461 4.8833 5.0416 5.0456 5.1055 5.1271 5.2186 5.3529 5.4369 5.4542 5.5149 5.7473 5.8238 6.4714 6.4853 6.6552 6.6705 6.8381 6.8439 8.7985 8.8010 8.8928 8.9358 9.3545 9.3776 9.5511 9.5554 9.7499 9.8446 11.8533 11.8572 13.0358 13.0590 k = 0.2439 0.2439 0.5182 ( 12560 PWs) bands (ev): -67.2293 -67.2293 -38.6590 -38.6590 -28.9335 -28.9335 -28.8733 -28.8733 -22.7379 -22.7379 -22.6928 -22.6928 -22.6862 -22.6862 -20.5083 -20.5083 -20.4673 -20.4673 -20.4506 -20.4505 -20.4492 -20.4492 -5.5718 -5.5702 -5.2599 -5.2077 -5.1009 -5.0526 -5.0227 -5.0123 1.9461 1.9702 2.2852 2.2969 2.6232 2.6453 2.9398 2.9409 3.2403 3.2578 3.4258 3.4348 3.6659 3.7086 3.8881 3.9172 4.0023 4.0099 4.3209 4.3779 4.4339 4.4578 4.5592 4.5604 4.6402 4.7410 4.8850 5.0461 5.0625 5.1032 5.1289 5.2282 5.3627 5.4320 5.4429 5.5183 5.7741 5.8515 6.4352 6.4474 6.6281 6.6419 6.8145 6.8218 8.7791 8.8000 8.8853 8.9380 9.3241 9.3670 9.5177 9.5209 9.7257 9.8245 11.8738 11.8782 13.1030 13.1355 k = 0.2317 0.2317 0.5182 ( 12552 PWs) bands (ev): -67.2293 -67.2293 -38.6590 -38.6590 -28.9334 -28.9334 -28.8733 -28.8733 -22.7379 -22.7379 -22.6928 -22.6928 -22.6862 -22.6862 -20.5083 -20.5083 -20.4673 -20.4673 -20.4505 -20.4505 -20.4492 -20.4492 -5.5884 -5.5870 -5.2651 -5.2155 -5.0903 -5.0434 -5.0128 -5.0034 1.9259 1.9493 2.3031 2.3140 2.6196 2.6377 2.9388 2.9443 3.2411 3.2567 3.4227 3.4349 3.6634 3.7031 3.8876 3.9299 4.0217 4.0294 4.3288 4.3844 4.4548 4.4901 4.5619 4.5718 4.6492 4.7372 4.8870 5.0506 5.0796 5.1006 5.1307 5.2375 5.3661 5.4226 5.4347 5.5224 5.8026 5.8811 6.3944 6.4040 6.6078 6.6195 6.7910 6.8002 8.7548 8.8011 8.8768 8.9419 9.2968 9.3591 9.4850 9.4865 9.7013 9.8039 11.8932 11.8983 13.1370 13.1668 k = 0.2195 0.2195 0.5182 ( 12556 PWs) bands (ev): -67.2293 -67.2293 -38.6590 -38.6590 -28.9333 -28.9333 -28.8733 -28.8733 -22.7379 -22.7378 -22.6928 -22.6928 -22.6862 -22.6862 -20.5083 -20.5083 -20.4673 -20.4673 -20.4505 -20.4505 -20.4492 -20.4492 -5.6047 -5.6034 -5.2703 -5.2234 -5.0797 -5.0342 -5.0029 -4.9944 1.9055 1.9282 2.3204 2.3303 2.6122 2.6268 2.9401 2.9514 3.2410 3.2547 3.4210 3.4362 3.6597 3.6957 3.8903 3.9454 4.0424 4.0502 4.3362 4.3892 4.4752 4.5200 4.5664 4.5850 4.6594 4.7347 4.8896 5.0553 5.0967 5.0978 5.1325 5.2462 5.3607 5.4103 5.4328 5.5263 5.8329 5.9123 6.3487 6.3553 6.5939 6.6033 6.7678 6.7790 8.7291 8.8012 8.8674 8.9467 9.2732 9.3534 9.4530 9.4534 9.6771 9.7829 11.9113 11.9170 13.1684 13.1943 k = 0.2073 0.2073 0.5182 ( 12564 PWs) bands (ev): -67.2293 -67.2293 -38.6589 -38.6589 -28.9333 -28.9333 -28.8733 -28.8733 -22.7378 -22.7378 -22.6928 -22.6928 -22.6862 -22.6862 -20.5083 -20.5083 -20.4673 -20.4673 -20.4505 -20.4505 -20.4492 -20.4492 -5.6206 -5.6194 -5.2756 -5.2312 -5.0692 -5.0252 -4.9930 -4.9854 1.8850 1.9068 2.3367 2.3457 2.6017 2.6134 2.9443 2.9607 3.2401 3.2522 3.4208 3.4384 3.6543 3.6862 3.8966 3.9640 4.0641 4.0721 4.3432 4.3923 4.4943 4.5438 4.5766 4.5991 4.6717 4.7337 4.8927 5.0600 5.0948 5.1138 5.1344 5.2541 5.3478 5.3963 5.4365 5.5295 5.8647 5.9450 6.2987 6.3023 6.5849 6.5925 6.7450 6.7585 8.7027 8.7992 8.8580 8.9518 9.2535 9.3492 9.4210 9.4232 9.6531 9.7615 11.9276 11.9340 13.1961 13.2168 k = 0.1951 0.1951 0.5182 ( 12560 PWs) bands (ev): -67.2293 -67.2293 -38.6589 -38.6589 -28.9332 -28.9332 -28.8732 -28.8732 -22.7378 -22.7378 -22.6928 -22.6928 -22.6862 -22.6862 -20.5083 -20.5083 -20.4673 -20.4673 -20.4505 -20.4505 -20.4492 -20.4492 -5.6360 -5.6349 -5.2808 -5.2390 -5.0588 -5.0163 -4.9832 -4.9766 1.8646 1.8855 2.3519 2.3599 2.5891 2.5984 2.9510 2.9717 3.2384 3.2491 3.4218 3.4413 3.6468 3.6746 3.9068 3.9854 4.0867 4.0947 4.3496 4.3939 4.5112 4.5583 4.5937 4.6144 4.6870 4.7344 4.8964 5.0647 5.0916 5.1306 5.1363 5.2610 5.3313 5.3815 5.4428 5.5317 5.8977 5.9788 6.2451 6.2460 6.5797 6.5862 6.7227 6.7388 8.6764 8.7936 8.8497 8.9567 9.2377 9.3449 9.3922 9.3951 9.6295 9.7401 11.9419 11.9490 13.2187 13.2331 k = 0.1829 0.1829 0.5182 ( 12560 PWs) bands (ev): -67.2293 -67.2293 -38.6589 -38.6589 -28.9331 -28.9331 -28.8732 -28.8732 -22.7378 -22.7378 -22.6928 -22.6928 -22.6862 -22.6862 -20.5083 -20.5083 -20.4673 -20.4673 -20.4505 -20.4505 -20.4492 -20.4492 -5.6508 -5.6498 -5.2859 -5.2466 -5.0485 -5.0077 -4.9737 -4.9678 1.8444 1.8643 2.3657 2.3728 2.5751 2.5826 2.9598 2.9841 3.2360 3.2458 3.4237 3.4445 3.6373 3.6612 3.9207 4.0093 4.1101 4.1178 4.3555 4.3943 4.5255 4.5674 4.6127 4.6310 4.7062 4.7372 4.9009 5.0693 5.0884 5.1383 5.1470 5.2662 5.3141 5.3665 5.4497 5.5328 5.9316 6.0133 6.1875 6.1889 6.5772 6.5833 6.7011 6.7203 8.6508 8.7830 8.8438 8.9606 9.2257 9.3365 9.3694 9.3710 9.6064 9.7186 11.9538 11.9617 13.2345 13.2417 k = 0.1707 0.1707 0.5182 ( 12556 PWs) bands (ev): -67.2293 -67.2293 -38.6589 -38.6589 -28.9330 -28.9330 -28.8732 -28.8732 -22.7378 -22.7378 -22.6928 -22.6928 -22.6862 -22.6862 -20.5083 -20.5083 -20.4673 -20.4673 -20.4505 -20.4505 -20.4492 -20.4492 -5.6650 -5.6642 -5.2909 -5.2541 -5.0385 -4.9994 -4.9644 -4.9593 1.8247 1.8435 2.3781 2.3842 2.5602 2.5663 2.9706 2.9977 3.2333 3.2423 3.4263 3.4479 3.6257 3.6460 3.9381 4.0353 4.1339 4.1410 4.3606 4.3940 4.5369 4.5741 4.6300 4.6483 4.7292 4.7426 4.9061 5.0737 5.0852 5.1405 5.1628 5.2682 5.2991 5.3521 5.4563 5.5328 5.9655 6.0479 6.1275 6.1310 6.5763 6.5829 6.6804 6.7032 8.6262 8.7676 8.8403 8.9631 9.2171 9.3199 9.3467 9.3619 9.5839 9.6971 11.9632 11.9717 13.2418 13.2422 k = 0.1585 0.1585 0.5182 ( 12572 PWs) bands (ev): -67.2293 -67.2293 -38.6589 -38.6589 -28.9329 -28.9329 -28.8732 -28.8732 -22.7378 -22.7378 -22.6928 -22.6928 -22.6862 -22.6862 -20.5083 -20.5083 -20.4673 -20.4673 -20.4505 -20.4505 -20.4492 -20.4492 -5.6785 -5.6778 -5.2956 -5.2614 -5.0287 -4.9916 -4.9554 -4.9510 1.8055 1.8232 2.3890 2.3941 2.5451 2.5502 2.9831 3.0125 3.2302 3.2387 3.4294 3.4511 3.6125 3.6293 3.9583 4.0627 4.1578 4.1642 4.3647 4.3931 4.5455 4.5787 4.6463 4.6661 4.7509 4.7545 4.9121 5.0777 5.0824 5.1431 5.1780 5.2634 5.2910 5.3385 5.4623 5.5317 5.9971 6.0671 6.0684 6.0868 6.5766 6.5843 6.6609 6.6879 8.6031 8.7488 8.8381 8.9633 9.2111 9.3004 9.3276 9.3599 9.5622 9.6757 11.9699 11.9789 13.2328 13.2406 k = 0.1463 0.1463 0.5182 ( 12572 PWs) bands (ev): -67.2293 -67.2293 -38.6589 -38.6589 -28.9329 -28.9329 -28.8731 -28.8731 -22.7378 -22.7378 -22.6928 -22.6928 -22.6862 -22.6862 -20.5083 -20.5083 -20.4673 -20.4673 -20.4505 -20.4505 -20.4492 -20.4492 -5.6912 -5.6906 -5.3001 -5.2684 -5.0192 -4.9842 -4.9468 -4.9431 1.7871 1.8036 2.3982 2.4025 2.5300 2.5344 2.9972 3.0284 3.2271 3.2353 3.4327 3.4541 3.5978 3.6115 3.9810 4.0909 4.1816 4.1872 4.3677 4.3919 4.5513 4.5811 4.6630 4.6842 4.7623 4.7805 4.9188 5.0801 5.0812 5.1460 5.1923 5.2523 5.2899 5.3260 5.4674 5.5294 5.9922 6.0093 6.0445 6.1179 6.5773 6.5870 6.6430 6.6748 8.5818 8.7278 8.8362 8.9607 9.2072 9.2831 9.3127 9.3603 9.5414 9.6544 11.9737 11.9831 13.2154 13.2296 k = 0.1341 0.1341 0.5182 ( 12572 PWs) bands (ev): -67.2293 -67.2293 -38.6589 -38.6589 -28.9328 -28.9328 -28.8731 -28.8731 -22.7378 -22.7378 -22.6928 -22.6928 -22.6862 -22.6862 -20.5083 -20.5083 -20.4673 -20.4673 -20.4505 -20.4505 -20.4492 -20.4492 -5.7032 -5.7026 -5.3042 -5.2751 -5.0101 -4.9774 -4.9386 -4.9355 1.7696 1.7849 2.4060 2.4095 2.5154 2.5192 3.0127 3.0453 3.2240 3.2321 3.4360 3.4568 3.5818 3.5926 4.0054 4.1193 4.2048 4.2098 4.3694 4.3907 4.5541 4.5810 4.6812 4.7034 4.7762 4.8058 4.9260 5.0788 5.0841 5.1493 5.2057 5.2403 5.2907 5.3147 5.4715 5.5259 5.9339 5.9483 6.0721 6.1501 6.5781 6.5904 6.6273 6.6644 8.5625 8.7056 8.8341 8.9549 9.2046 9.2699 9.3024 9.3614 9.5217 9.6334 11.9746 11.9843 13.1911 13.2102 k = 0.1220 0.1220 0.5182 ( 12562 PWs) bands (ev): -67.2293 -67.2293 -38.6589 -38.6589 -28.9328 -28.9328 -28.8731 -28.8731 -22.7378 -22.7378 -22.6928 -22.6928 -22.6862 -22.6862 -20.5083 -20.5083 -20.4673 -20.4673 -20.4505 -20.4505 -20.4492 -20.4492 -5.7142 -5.7138 -5.3080 -5.2815 -5.0015 -4.9711 -4.9310 -4.9283 1.7532 1.7672 2.4123 2.4151 2.5015 2.5048 3.0295 3.0629 3.2211 3.2292 3.4393 3.4591 3.5649 3.5729 4.0312 4.1472 4.2270 4.2321 4.3696 4.3897 4.5538 4.5784 4.7013 4.7244 4.7920 4.8296 4.9335 5.0790 5.0867 5.1529 5.2180 5.2301 5.2915 5.3048 5.4744 5.5214 5.8712 5.8871 6.1020 6.1798 6.5787 6.5937 6.6148 6.6568 8.5454 8.6829 8.8315 8.9460 9.2027 9.2610 9.2968 9.3627 9.5031 9.6126 11.9729 11.9825 13.1620 13.1843 k = 0.1098 0.1098 0.5182 ( 12566 PWs) bands (ev): -67.2293 -67.2293 -38.6588 -38.6588 -28.9327 -28.9327 -28.8731 -28.8731 -22.7378 -22.7378 -22.6928 -22.6928 -22.6862 -22.6862 -20.5083 -20.5083 -20.4673 -20.4673 -20.4505 -20.4505 -20.4492 -20.4492 -5.7244 -5.7240 -5.3114 -5.2875 -4.9933 -4.9655 -4.9238 -4.9217 1.7379 1.7506 2.4173 2.4195 2.4885 2.4913 3.0472 3.0812 3.2185 3.2267 3.4424 3.4609 3.5473 3.5527 4.0579 4.1739 4.2478 4.2543 4.3682 4.3889 4.5507 4.5737 4.7234 4.7478 4.8089 4.8511 4.9407 5.0809 5.0891 5.1564 5.2226 5.2291 5.2917 5.2963 5.4762 5.5159 5.8083 5.8264 6.1299 6.2062 6.5795 6.5949 6.6079 6.6520 8.5306 8.6603 8.8284 8.9342 9.2014 9.2561 9.2956 9.3639 9.4859 9.5921 11.9686 11.9781 13.1305 13.1542 k = 0.0976 0.0976 0.5182 ( 12574 PWs) bands (ev): -67.2293 -67.2293 -38.6588 -38.6588 -28.9326 -28.9326 -28.8730 -28.8730 -22.7378 -22.7378 -22.6928 -22.6928 -22.6862 -22.6862 -20.5083 -20.5083 -20.4673 -20.4673 -20.4505 -20.4505 -20.4492 -20.4492 -5.7336 -5.7333 -5.3144 -5.2931 -4.9857 -4.9606 -4.9173 -4.9156 1.7239 1.7353 2.4211 2.4228 2.4765 2.4790 3.0657 3.0998 3.2162 3.2247 3.4453 3.4622 3.5292 3.5321 4.0850 4.1988 4.2669 4.2765 4.3651 4.3887 4.5450 4.5671 4.7471 4.7733 4.8269 4.8700 4.9475 5.0850 5.0920 5.1592 5.2182 5.2389 5.2891 5.2912 5.4766 5.5092 5.7460 5.7666 6.1547 6.2280 6.5807 6.5922 6.6087 6.6497 8.5182 8.6381 8.8248 8.9204 9.2010 9.2546 9.2983 9.3647 9.4703 9.5720 11.9623 11.9713 13.0986 13.1223 k = 0.0854 0.0854 0.5182 ( 12570 PWs) bands (ev): -67.2293 -67.2293 -38.6588 -38.6588 -28.9326 -28.9326 -28.8730 -28.8730 -22.7378 -22.7378 -22.6928 -22.6928 -22.6862 -22.6862 -20.5083 -20.5083 -20.4673 -20.4673 -20.4505 -20.4505 -20.4492 -20.4492 -5.7418 -5.7416 -5.3170 -5.2983 -4.9787 -4.9564 -4.9115 -4.9100 1.7114 1.7214 2.4240 2.4253 2.4657 2.4679 3.0846 3.1182 3.2146 3.2233 3.4480 3.4632 3.5108 3.5115 4.1121 4.2212 4.2837 4.2991 4.3603 4.3893 4.5370 4.5587 4.7720 4.7993 4.8468 4.8858 4.9537 5.0914 5.0963 5.1606 5.2172 5.2469 5.2835 5.2899 5.4755 5.5013 5.6854 5.7085 6.1761 6.2448 6.5827 6.5902 6.6126 6.6491 8.5083 8.6168 8.8212 8.9053 9.2016 9.2551 9.3038 9.3653 9.4564 9.5522 11.9545 11.9627 13.0682 13.0907 k = 0.0732 0.0732 0.5182 ( 12566 PWs) bands (ev): -67.2293 -67.2293 -38.6588 -38.6588 -28.9326 -28.9326 -28.8730 -28.8730 -22.7378 -22.7378 -22.6928 -22.6928 -22.6862 -22.6862 -20.5083 -20.5083 -20.4673 -20.4673 -20.4505 -20.4505 -20.4492 -20.4492 -5.7490 -5.7488 -5.3191 -5.3030 -4.9722 -4.9529 -4.9063 -4.9051 1.7005 1.7090 2.4260 2.4270 2.4561 2.4580 3.1033 3.1359 3.2137 3.2226 3.4503 3.4637 3.4913 3.4924 4.1389 4.2408 4.2978 4.3221 4.3538 4.3912 4.5272 4.5488 4.7972 4.8229 4.8702 4.8985 4.9598 5.0998 5.1027 5.1604 5.2190 5.2523 5.2800 5.2879 5.4722 5.4918 5.6279 5.6535 6.1939 6.2563 6.5858 6.5909 6.6174 6.6498 8.5009 8.5965 8.8177 8.8898 9.2035 9.2566 9.3112 9.3660 9.4444 9.5328 11.9457 11.9531 13.0406 13.0610 k = 0.0610 0.0610 0.5182 ( 12564 PWs) bands (ev): -67.2293 -67.2293 -38.6588 -38.6588 -28.9325 -28.9325 -28.8730 -28.8730 -22.7378 -22.7378 -22.6928 -22.6928 -22.6862 -22.6862 -20.5083 -20.5083 -20.4673 -20.4673 -20.4505 -20.4505 -20.4492 -20.4492 -5.7551 -5.7550 -5.3206 -5.3072 -4.9664 -4.9501 -4.9018 -4.9009 1.6911 1.6983 2.4275 2.4282 2.4479 2.4496 3.1214 3.1519 3.2141 3.2227 3.4520 3.4638 3.4721 3.4745 4.1650 4.2577 4.3085 4.3450 4.3458 4.3949 4.5160 4.5374 4.8217 4.8419 4.8963 4.9081 4.9681 5.1099 5.1122 5.1585 5.2226 5.2541 5.2793 5.2852 5.4650 5.4795 5.5764 5.6034 6.2084 6.2627 6.5898 6.5940 6.6226 6.6510 8.4961 8.5776 8.8147 8.8746 9.2068 9.2578 9.3200 9.3671 9.4345 9.5140 11.9366 11.9430 13.0165 13.0343 k = 0.0488 0.0488 0.5182 ( 12556 PWs) bands (ev): -67.2293 -67.2293 -38.6588 -38.6588 -28.9325 -28.9325 -28.8730 -28.8730 -22.7378 -22.7378 -22.6928 -22.6928 -22.6862 -22.6862 -20.5083 -20.5083 -20.4673 -20.4673 -20.4505 -20.4505 -20.4492 -20.4492 -5.7602 -5.7601 -5.3217 -5.3110 -4.9613 -4.9482 -4.8981 -4.8974 1.6835 1.6892 2.4284 2.4290 2.4412 2.4425 3.1380 3.1649 3.2165 3.2239 3.4497 3.4568 3.4581 3.4641 4.1902 4.2721 4.3156 4.3356 4.3682 4.4008 4.5038 4.5246 4.8441 4.8568 4.9149 4.9187 4.9838 5.1212 5.1254 5.1551 5.2259 5.2519 5.2810 5.2819 5.4501 5.4623 5.5365 5.5619 6.2201 6.2649 6.5943 6.5982 6.6283 6.6524 8.4938 8.5602 8.8127 8.8604 9.2115 9.2575 9.3294 9.3687 9.4268 9.4959 11.9281 11.9333 12.9968 13.0114 k = 0.0366 0.0366 0.5182 ( 12538 PWs) bands (ev): -67.2293 -67.2293 -38.6588 -38.6588 -28.9325 -28.9325 -28.8730 -28.8730 -22.7378 -22.7378 -22.6928 -22.6928 -22.6862 -22.6862 -20.5083 -20.5083 -20.4673 -20.4673 -20.4505 -20.4505 -20.4492 -20.4492 -5.7641 -5.7640 -5.3223 -5.3142 -4.9570 -4.9470 -4.8952 -4.8947 1.6776 1.6820 2.4291 2.4294 2.4360 2.4370 3.1524 3.1736 3.2212 3.2263 3.4361 3.4413 3.4574 3.4636 4.2140 4.2841 4.3189 4.3241 4.3905 4.4089 4.4912 4.5105 4.8630 4.8685 4.9197 4.9305 5.0116 5.1335 5.1427 5.1498 5.2264 5.2466 5.2790 5.2837 5.4249 5.4383 5.5136 5.5326 6.2296 6.2639 6.5986 6.6021 6.6343 6.6533 8.4940 8.5445 8.8120 8.8476 9.2172 9.2553 9.3389 9.3706 9.4221 9.4786 11.9208 11.9248 12.9816 12.9928 k = 0.0244 0.0244 0.5182 ( 12546 PWs) bands (ev): -67.2293 -67.2293 -38.6588 -38.6588 -28.9325 -28.9325 -28.8730 -28.8730 -22.7378 -22.7378 -22.6928 -22.6928 -22.6862 -22.6862 -20.5083 -20.5083 -20.4673 -20.4673 -20.4505 -20.4505 -20.4492 -20.4492 -5.7670 -5.7669 -5.3223 -5.3169 -4.9534 -4.9467 -4.8930 -4.8927 1.6736 1.6765 2.4294 2.4296 2.4322 2.4329 3.1636 3.1777 3.2271 3.2296 3.4239 3.4281 3.4587 3.4629 4.2364 4.2932 4.3117 4.3189 4.4113 4.4187 4.4787 4.4955 4.8769 4.8776 4.9233 4.9339 5.0466 5.1419 5.1468 5.1632 5.2198 5.2381 5.2782 5.2858 5.3977 5.4105 5.5037 5.5153 6.2375 6.2608 6.6023 6.6050 6.6402 6.6534 8.4966 8.5306 8.8130 8.8366 9.2239 9.2511 9.3482 9.3712 9.4215 9.4624 11.9153 11.9180 12.9712 12.9788 k = 0.0122 0.0122 0.5182 ( 12550 PWs) bands (ev): -67.2293 -67.2293 -38.6588 -38.6588 -28.9324 -28.9324 -28.8730 -28.8730 -22.7378 -22.7378 -22.6928 -22.6928 -22.6862 -22.6862 -20.5083 -20.5083 -20.4673 -20.4673 -20.4505 -20.4505 -20.4492 -20.4492 -5.7687 -5.7686 -5.3218 -5.3191 -4.9505 -4.9472 -4.8917 -4.8916 1.6715 1.6730 2.4296 2.4297 2.4301 2.4304 3.1715 3.1784 3.2320 3.2327 3.4163 3.4187 3.4599 3.4621 4.2571 4.2912 4.3069 4.3164 4.4286 4.4288 4.4686 4.4802 4.8839 4.8848 4.9268 4.9332 5.0815 5.1297 5.1622 5.1842 5.2052 5.2258 5.2805 5.2862 5.3793 5.3871 5.5004 5.5058 6.2444 6.2562 6.6050 6.6065 6.6456 6.6523 8.5017 8.5188 8.8157 8.8275 9.2311 9.2452 9.3567 9.3690 9.4260 9.4476 11.9121 11.9134 12.9658 12.9696 k = 0.0000 0.0000 0.5182 ( 12540 PWs) bands (ev): -67.2293 -67.2293 -38.6588 -38.6588 -28.9324 -28.9324 -28.8730 -28.8730 -22.7378 -22.7378 -22.6928 -22.6928 -22.6862 -22.6862 -20.5083 -20.5083 -20.4673 -20.4673 -20.4505 -20.4505 -20.4492 -20.4492 -5.7692 -5.7692 -5.3207 -5.3207 -4.9484 -4.9484 -4.8913 -4.8913 1.6713 1.6713 2.4294 2.4294 2.4298 2.4298 3.1763 3.1763 3.2339 3.2339 3.4145 3.4145 3.4611 3.4611 4.2757 4.2757 4.3119 4.3119 4.4354 4.4354 4.4681 4.4681 4.8867 4.8867 4.9304 4.9304 5.1102 5.1102 5.1805 5.1805 5.2092 5.2092 5.2841 5.2841 5.3754 5.3754 5.5012 5.5012 6.2506 6.2506 6.6065 6.6065 6.6497 6.6497 8.5091 8.5091 8.8206 8.8206 9.2384 9.2384 9.3639 9.3639 9.4352 9.4352 11.9114 11.9114 12.9652 12.9652 k = 0.0000 0.5000-0.0000 ( 12570 PWs) bands (ev): -67.2293 -67.2293 -38.6590 -38.6590 -28.9336 -28.9336 -28.8731 -28.8731 -22.7379 -22.7379 -22.6928 -22.6928 -22.6862 -22.6862 -20.5083 -20.5083 -20.4673 -20.4673 -20.4506 -20.4506 -20.4492 -20.4492 -5.7229 -5.7229 -5.3980 -5.3980 -4.9291 -4.9291 -4.8725 -4.8725 2.0797 2.0797 2.4253 2.4253 2.6371 2.6371 3.2426 3.2426 3.3607 3.3607 3.4724 3.4724 3.5509 3.5509 3.7928 3.7928 3.9291 3.9291 4.3293 4.3293 4.4360 4.4360 4.6389 4.6389 4.8741 4.8741 5.0012 5.0012 5.0692 5.0692 5.3268 5.3268 5.3912 5.3912 5.5155 5.5155 5.6735 5.6735 5.9956 5.9956 6.7142 6.7142 6.7588 6.7588 8.2219 8.2219 8.8716 8.8716 9.3384 9.3384 9.3848 9.3848 9.5103 9.5103 12.1790 12.1790 12.8393 12.8393 k = 0.0000 0.5000 0.0167 ( 12556 PWs) bands (ev): -67.2293 -67.2293 -38.6590 -38.6590 -28.9336 -28.9336 -28.8731 -28.8731 -22.7379 -22.7379 -22.6928 -22.6928 -22.6862 -22.6862 -20.5083 -20.5083 -20.4673 -20.4673 -20.4506 -20.4506 -20.4492 -20.4492 -5.7225 -5.7224 -5.3989 -5.3964 -4.9307 -4.9282 -4.8731 -4.8726 2.0795 2.0795 2.4250 2.4258 2.6362 2.6384 3.2393 3.2457 3.3557 3.3600 3.4743 3.4761 3.5491 3.5524 3.7911 3.7934 3.9252 3.9320 4.3266 4.3310 4.4309 4.4403 4.6373 4.6395 4.8731 4.8761 4.9933 5.0053 5.0687 5.0738 5.3188 5.3355 5.3831 5.3999 5.5128 5.5178 5.6728 5.6740 5.9963 5.9974 6.7126 6.7135 6.7586 6.7591 8.2168 8.2308 8.8636 8.8799 9.3361 9.3398 9.3718 9.4021 9.5070 9.5105 12.1803 12.1805 12.8376 12.8438 k = 0.0000 0.5000 0.0334 ( 12576 PWs) bands (ev): -67.2293 -67.2293 -38.6590 -38.6590 -28.9336 -28.9336 -28.8731 -28.8731 -22.7379 -22.7379 -22.6928 -22.6928 -22.6862 -22.6862 -20.5083 -20.5083 -20.4673 -20.4673 -20.4506 -20.4506 -20.4492 -20.4492 -5.7212 -5.7211 -5.3992 -5.3943 -4.9331 -4.9280 -4.8744 -4.8733 2.0789 2.0790 2.4249 2.4265 2.6358 2.6403 3.2358 3.2488 3.3461 3.3541 3.4803 3.4851 3.5468 3.5542 3.7885 3.7931 3.9205 3.9337 4.3229 4.3317 4.4252 4.4436 4.6346 4.6390 4.8731 4.8790 4.9833 5.0047 5.0733 5.0809 5.3117 5.3444 5.3757 5.4087 5.5096 5.5197 5.6718 5.6742 5.9996 6.0017 6.7088 6.7106 6.7586 6.7596 8.2156 8.2436 8.8561 8.8883 9.3346 9.3359 9.3674 9.4217 9.5007 9.5078 12.1843 12.1847 12.8387 12.8511 k = 0.0000 0.5000 0.0502 ( 12578 PWs) bands (ev): -67.2293 -67.2293 -38.6590 -38.6590 -28.9336 -28.9336 -28.8731 -28.8731 -22.7379 -22.7379 -22.6928 -22.6928 -22.6862 -22.6862 -20.5083 -20.5083 -20.4673 -20.4673 -20.4506 -20.4506 -20.4492 -20.4492 -5.7190 -5.7189 -5.3990 -5.3916 -4.9362 -4.9287 -4.8764 -4.8748 2.0780 2.0781 2.4249 2.4274 2.6359 2.6426 3.2323 3.2516 3.3334 3.3446 3.4876 3.4979 3.5440 3.5572 3.7848 3.7918 3.9151 3.9342 4.3179 4.3317 4.4193 4.4459 4.6309 4.6375 4.8743 4.8826 4.9727 5.0003 5.0818 5.0892 5.3056 5.3522 5.3706 5.4175 5.5061 5.5213 5.6705 5.6741 6.0053 6.0086 6.7028 6.7056 6.7588 6.7603 8.2183 8.2602 8.8493 8.8966 9.3269 9.3345 9.3715 9.4426 9.4916 9.5022 12.1910 12.1916 12.8427 12.8609 k = 0.0000 0.5000 0.0669 ( 12594 PWs) bands (ev): -67.2293 -67.2293 -38.6590 -38.6590 -28.9336 -28.9336 -28.8731 -28.8731 -22.7379 -22.7379 -22.6928 -22.6928 -22.6862 -22.6862 -20.5083 -20.5083 -20.4673 -20.4673 -20.4506 -20.4506 -20.4492 -20.4492 -5.7160 -5.7158 -5.3981 -5.3883 -4.9401 -4.9301 -4.8792 -4.8769 2.0766 2.0767 2.4251 2.4285 2.6364 2.6455 3.2286 3.2543 3.3189 3.3331 3.4937 3.5124 3.5413 3.5627 3.7803 3.7896 3.9093 3.9332 4.3118 4.3307 4.4135 4.4470 4.6263 4.6349 4.8764 4.8867 4.9621 4.9938 5.0923 5.0979 5.3006 5.3540 5.3724 5.4260 5.5022 5.5228 5.6689 5.6739 6.0134 6.0180 6.6948 6.6984 6.7593 6.7613 8.2246 8.2804 8.8434 8.9045 9.3173 9.3358 9.3795 9.4643 9.4802 9.4942 12.2004 12.2012 12.8494 12.8728 k = 0.0000 0.5000 0.0836 ( 12578 PWs) bands (ev): -67.2293 -67.2293 -38.6590 -38.6590 -28.9336 -28.9336 -28.8731 -28.8731 -22.7379 -22.7379 -22.6928 -22.6928 -22.6862 -22.6862 -20.5083 -20.5083 -20.4673 -20.4673 -20.4506 -20.4506 -20.4492 -20.4492 -5.7121 -5.7119 -5.3966 -5.3845 -4.9446 -4.9323 -4.8826 -4.8797 2.0749 2.0750 2.4254 2.4298 2.6375 2.6489 3.2247 3.2568 3.3035 3.3205 3.4966 3.5245 3.5420 3.5719 3.7748 3.7865 3.9032 3.9307 4.3044 4.3290 4.4081 4.4472 4.6208 4.6314 4.8795 4.8908 4.9523 4.9864 5.1037 5.1065 5.2966 5.3500 5.3807 5.4337 5.4980 5.5242 5.6671 5.6734 6.0236 6.0298 6.6848 6.6893 6.7603 6.7625 8.2344 8.3040 8.8386 8.9119 9.3091 9.3383 9.3889 9.4660 9.4844 9.4873 12.2124 12.2133 12.8585 12.8867 k = 0.0000 0.5000 0.1003 ( 12574 PWs) bands (ev): -67.2293 -67.2293 -38.6590 -38.6590 -28.9336 -28.9336 -28.8731 -28.8731 -22.7379 -22.7379 -22.6928 -22.6928 -22.6862 -22.6862 -20.5083 -20.5083 -20.4673 -20.4673 -20.4506 -20.4506 -20.4492 -20.4492 -5.7074 -5.7071 -5.3946 -5.3800 -4.9498 -4.9354 -4.8867 -4.8831 2.0728 2.0729 2.4259 2.4312 2.6391 2.6530 3.2207 3.2590 3.2876 3.3076 3.4958 3.5255 3.5542 3.5848 3.7685 3.7827 3.8970 3.9266 4.2960 4.3266 4.4034 4.4465 4.6146 4.6270 4.8833 4.8946 4.9437 4.9787 5.1147 5.1151 5.2937 5.3451 5.3906 5.4406 5.4936 5.5259 5.6651 5.6729 6.0360 6.0438 6.6730 6.6784 6.7616 6.7642 8.2476 8.3308 8.8348 8.9186 9.3027 9.3417 9.3982 9.4513 9.4744 9.5100 12.2269 12.2280 12.8698 12.9020 k = 0.0000 0.5000 0.1170 ( 12570 PWs) bands (ev): -67.2293 -67.2293 -38.6590 -38.6590 -28.9336 -28.9336 -28.8731 -28.8731 -22.7379 -22.7379 -22.6928 -22.6928 -22.6862 -22.6862 -20.5083 -20.5083 -20.4673 -20.4673 -20.4506 -20.4506 -20.4492 -20.4492 -5.7019 -5.7015 -5.3920 -5.3750 -4.9557 -4.9392 -4.8915 -4.8870 2.0704 2.0704 2.4264 2.4327 2.6412 2.6577 3.2165 3.2607 3.2715 3.2949 3.4920 3.5210 3.5717 3.6006 3.7615 3.7782 3.8907 3.9210 4.2868 4.3233 4.3993 4.4451 4.6077 4.6218 4.8877 4.8971 4.9371 4.9710 5.1223 5.1260 5.2919 5.3403 5.4008 5.4460 5.4890 5.5279 5.6629 5.6722 6.0502 6.0598 6.6596 6.6659 6.7636 6.7663 8.2639 8.3605 8.8323 8.9245 9.2981 9.3447 9.4048 9.4368 9.4667 9.5327 12.2439 12.2450 12.8828 12.9182 k = 0.0000 0.5000 0.1337 ( 12578 PWs) bands (ev): -67.2293 -67.2293 -38.6590 -38.6590 -28.9336 -28.9336 -28.8731 -28.8731 -22.7379 -22.7379 -22.6928 -22.6928 -22.6862 -22.6862 -20.5083 -20.5083 -20.4673 -20.4673 -20.4506 -20.4506 -20.4492 -20.4492 -5.6955 -5.6951 -5.3888 -5.3695 -4.9621 -4.9438 -4.8970 -4.8916 2.0675 2.0675 2.4269 2.4344 2.6440 2.6631 3.2121 3.2556 3.2611 3.2834 3.4860 3.5151 3.5902 3.6182 3.7540 3.7734 3.8846 3.9138 4.2771 4.3193 4.3959 4.4432 4.6004 4.6159 4.8925 4.8975 4.9334 4.9633 5.1291 5.1360 5.2911 5.3360 5.4107 5.4500 5.4844 5.5305 5.6608 5.6716 6.0660 6.0776 6.6447 6.6519 6.7663 6.7689 8.2831 8.3929 8.8310 8.9296 9.2947 9.3451 9.4050 9.4250 9.4659 9.5552 12.2632 12.2644 12.8971 12.9348 k = 0.0000 0.5000 0.1505 ( 12576 PWs) bands (ev): -67.2293 -67.2293 -38.6590 -38.6590 -28.9336 -28.9336 -28.8732 -28.8731 -22.7379 -22.7379 -22.6928 -22.6928 -22.6862 -22.6862 -20.5083 -20.5083 -20.4673 -20.4673 -20.4506 -20.4506 -20.4492 -20.4492 -5.6884 -5.6880 -5.3850 -5.3635 -4.9692 -4.9492 -4.9031 -4.8967 2.0641 2.0642 2.4275 2.4362 2.6475 2.6692 3.2072 3.2400 3.2577 3.2755 3.4784 3.5086 3.6086 3.6369 3.7461 3.7686 3.8786 3.9051 4.2672 4.3146 4.3931 4.4409 4.5927 4.6095 4.8952 4.8977 4.9329 4.9559 5.1349 5.1448 5.2912 5.3324 5.4200 5.4523 5.4799 5.5336 5.6587 5.6711 6.0832 6.0968 6.6286 6.6366 6.7698 6.7722 8.3049 8.4276 8.8308 8.9339 9.2914 9.3396 9.3986 9.4196 9.4732 9.5772 12.2847 12.2859 12.9122 12.9513 k = 0.0000 0.5000 0.1672 ( 12552 PWs) bands (ev): -67.2293 -67.2293 -38.6590 -38.6590 -28.9336 -28.9336 -28.8732 -28.8732 -22.7379 -22.7379 -22.6928 -22.6928 -22.6862 -22.6862 -20.5083 -20.5083 -20.4673 -20.4673 -20.4506 -20.4506 -20.4492 -20.4492 -5.6806 -5.6801 -5.3807 -5.3570 -4.9769 -4.9553 -4.9098 -4.9024 2.0604 2.0606 2.4281 2.4380 2.6515 2.6762 3.2012 3.2255 3.2487 3.2734 3.4699 3.5016 3.6262 3.6556 3.7384 3.7644 3.8729 3.8950 4.2574 4.3093 4.3908 4.4383 4.5848 4.6026 4.8908 4.9031 4.9348 4.9486 5.1396 5.1522 5.2921 5.3293 5.4284 5.4530 5.4757 5.5372 5.6569 5.6707 6.1014 6.1171 6.6114 6.6202 6.7742 6.7763 8.3291 8.4643 8.8318 8.9374 9.2866 9.3270 9.3902 9.4223 9.4857 9.5985 12.3083 12.3094 12.9276 12.9672 k = 0.0000 0.5000 0.1839 ( 12556 PWs) bands (ev): -67.2293 -67.2293 -38.6590 -38.6590 -28.9336 -28.9336 -28.8732 -28.8732 -22.7379 -22.7379 -22.6928 -22.6928 -22.6862 -22.6862 -20.5083 -20.5083 -20.4673 -20.4673 -20.4506 -20.4506 -20.4492 -20.4492 -5.6720 -5.6715 -5.3759 -5.3499 -4.9852 -4.9622 -4.9172 -4.9085 2.0564 2.0567 2.4287 2.4398 2.6563 2.6839 3.1929 3.2135 3.2373 3.2737 3.4606 3.4943 3.6418 3.6730 3.7321 3.7618 3.8675 3.8837 4.2480 4.3033 4.3890 4.4357 4.5768 4.5955 4.8855 4.9084 4.9379 4.9416 5.1432 5.1579 5.2937 5.3268 5.4357 5.4522 5.4720 5.5410 5.6555 5.6706 6.1203 6.1381 6.5933 6.6030 6.7797 6.7814 8.3554 8.5026 8.8337 8.9402 9.2785 9.3093 9.3843 9.4311 9.5007 9.6189 12.3338 12.3348 12.9427 12.9818 k = 0.0000 0.5000 0.2006 ( 12560 PWs) bands (ev): -67.2293 -67.2293 -38.6590 -38.6590 -28.9336 -28.9336 -28.8732 -28.8732 -22.7379 -22.7379 -22.6928 -22.6928 -22.6862 -22.6862 -20.5083 -20.5083 -20.4673 -20.4673 -20.4506 -20.4506 -20.4492 -20.4492 -5.6628 -5.6622 -5.3706 -5.3425 -4.9940 -4.9698 -4.9250 -4.9152 2.0520 2.0524 2.4292 2.4415 2.6618 2.6924 3.1812 3.2051 3.2254 3.2746 3.4510 3.4868 3.6541 3.6852 3.7307 3.7623 3.8626 3.8713 4.2390 4.2968 4.3876 4.4330 4.5689 4.5883 4.8797 4.9133 4.9350 4.9415 5.1456 5.1619 5.2959 5.3250 5.4412 5.4503 5.4696 5.5449 5.6547 5.6709 6.1395 6.1594 6.5745 6.5850 6.7864 6.7874 8.3835 8.5421 8.8365 8.9424 9.2661 9.2892 9.3831 9.4439 9.5172 9.6381 12.3609 12.3619 12.9568 12.9946 k = 0.0000 0.5000 0.2173 ( 12548 PWs) bands (ev): -67.2293 -67.2293 -38.6590 -38.6590 -28.9336 -28.9336 -28.8732 -28.8732 -22.7379 -22.7379 -22.6928 -22.6928 -22.6862 -22.6862 -20.5083 -20.5083 -20.4673 -20.4673 -20.4506 -20.4506 -20.4492 -20.4492 -5.6530 -5.6523 -5.3647 -5.3345 -5.0033 -4.9781 -4.9334 -4.9223 2.0473 2.0478 2.4297 2.4432 2.6680 2.7016 3.1671 3.1993 3.2134 3.2757 3.4413 3.4792 3.6614 3.6872 3.7391 3.7675 3.8581 3.8584 4.2308 4.2899 4.3864 4.4302 4.5611 4.5811 4.8738 4.9165 4.9299 4.9452 5.1468 5.1640 5.2986 5.3238 5.4441 5.4474 5.4690 5.5485 5.6546 5.6716 6.1587 6.1805 6.5553 6.5666 6.7942 6.7946 8.4132 8.5823 8.8397 8.9440 9.2501 9.2685 9.3867 9.4593 9.5344 9.6560 12.3896 12.3904 12.9694 13.0053 k = 0.0000 0.5000 0.2340 ( 12550 PWs) bands (ev): -67.2293 -67.2293 -38.6590 -38.6590 -28.9336 -28.9336 -28.8732 -28.8732 -22.7379 -22.7379 -22.6928 -22.6928 -22.6862 -22.6862 -20.5083 -20.5083 -20.4673 -20.4673 -20.4506 -20.4506 -20.4492 -20.4492 -5.6426 -5.6419 -5.3584 -5.3262 -5.0130 -4.9869 -4.9423 -4.9299 2.0424 2.0430 2.4301 2.4448 2.6748 2.7117 3.1521 3.1949 3.2015 3.2766 3.4316 3.4715 3.6631 3.6813 3.7542 3.7780 3.8443 3.8554 4.2232 4.2827 4.3855 4.4275 4.5535 4.5740 4.8677 4.9145 4.9297 4.9486 5.1470 5.1643 5.3017 5.3232 5.4438 5.4441 5.4708 5.5517 5.6552 5.6729 6.1776 6.2011 6.5358 6.5478 6.8030 6.8033 8.4441 8.6228 8.8433 8.9449 9.2319 9.2482 9.3938 9.4764 9.5520 9.6724 12.4196 12.4201 12.9801 13.0134 k = 0.0000 0.5000 0.2508 ( 12554 PWs) bands (ev): -67.2293 -67.2293 -38.6590 -38.6590 -28.9336 -28.9336 -28.8732 -28.8732 -22.7379 -22.7379 -22.6928 -22.6928 -22.6862 -22.6862 -20.5083 -20.5083 -20.4673 -20.4673 -20.4506 -20.4506 -20.4492 -20.4492 -5.6317 -5.6309 -5.3517 -5.3175 -5.0231 -4.9964 -4.9517 -4.9379 2.0373 2.0380 2.4305 2.4462 2.6824 2.7225 3.1368 3.1898 3.1913 3.2774 3.4223 3.4637 3.6602 3.6723 3.7705 3.7928 3.8302 3.8543 4.2164 4.2752 4.3848 4.4248 4.5463 4.5672 4.8614 4.9082 4.9333 4.9518 5.1461 5.1628 5.3050 5.3231 5.4398 5.4421 5.4741 5.5544 5.6568 5.6746 6.1958 6.2208 6.5163 6.5288 6.8126 6.8137 8.4759 8.6630 8.8467 8.9451 9.2133 9.2292 9.4034 9.4947 9.5698 9.6873 12.4506 12.4509 12.9884 13.0187 k = 0.0000 0.5000 0.2675 ( 12538 PWs) bands (ev): -67.2293 -67.2293 -38.6590 -38.6590 -28.9336 -28.9336 -28.8732 -28.8732 -22.7379 -22.7379 -22.6928 -22.6928 -22.6862 -22.6862 -20.5083 -20.5083 -20.4673 -20.4673 -20.4506 -20.4506 -20.4492 -20.4492 -5.6203 -5.6195 -5.3445 -5.3085 -5.0336 -5.0063 -4.9614 -4.9463 2.0321 2.0329 2.4308 2.4474 2.6906 2.7339 3.1215 3.1783 3.1883 3.2779 3.4133 3.4560 3.6540 3.6622 3.7842 3.8089 3.8179 3.8570 4.2104 4.2676 4.3842 4.4222 4.5396 4.5607 4.8547 4.9003 4.9377 4.9545 5.1444 5.1599 5.3084 5.3235 5.4355 5.4391 5.4778 5.5565 5.6592 5.6770 6.2131 6.2392 6.4968 6.5099 6.8234 6.8251 8.5083 8.7023 8.8497 8.9445 9.1956 9.2122 9.4145 9.5138 9.5877 9.7003 12.4823 12.4823 12.9939 13.0211 k = 0.0000 0.5000 0.2842 ( 12536 PWs) bands (ev): -67.2293 -67.2293 -38.6590 -38.6590 -28.9336 -28.9336 -28.8732 -28.8732 -22.7379 -22.7379 -22.6928 -22.6928 -22.6862 -22.6862 -20.5083 -20.5083 -20.4673 -20.4673 -20.4506 -20.4506 -20.4492 -20.4492 -5.6086 -5.6078 -5.3369 -5.2991 -5.0444 -5.0167 -4.9715 -4.9551 2.0268 2.0277 2.4311 2.4484 2.6994 2.7460 3.1063 3.1669 3.1860 3.2782 3.4049 3.4484 3.6458 3.6516 3.7928 3.8009 3.8317 3.8653 4.2052 4.2601 4.3838 4.4197 4.5334 4.5547 4.8476 4.8916 4.9420 4.9569 5.1418 5.1556 5.3120 5.3244 5.4310 5.4358 5.4816 5.5580 5.6625 5.6799 6.2293 6.2561 6.4777 6.4911 6.8353 6.8376 8.5411 8.7399 8.8519 8.9429 9.1801 9.1977 9.4266 9.5335 9.6055 9.7115 12.5142 12.5145 12.9966 13.0206 k = 0.0000 0.5000 0.3009 ( 12516 PWs) bands (ev): -67.2293 -67.2293 -38.6590 -38.6590 -28.9336 -28.9336 -28.8733 -28.8733 -22.7379 -22.7379 -22.6928 -22.6928 -22.6862 -22.6862 -20.5083 -20.5083 -20.4673 -20.4673 -20.4506 -20.4506 -20.4492 -20.4492 -5.5966 -5.5957 -5.3290 -5.2896 -5.0554 -5.0273 -4.9818 -4.9642 2.0215 2.0225 2.4313 2.4491 2.7087 2.7586 3.0913 3.1557 3.1844 3.2782 3.3970 3.4407 3.6366 3.6408 3.7876 3.7956 3.8523 3.8793 4.2007 4.2526 4.3836 4.4172 4.5277 4.5492 4.8399 4.8820 4.9461 4.9588 5.1387 5.1505 5.3155 5.3255 5.4266 5.4323 5.4852 5.5588 5.6665 5.6832 6.2442 6.2714 6.4591 6.4727 6.8482 6.8510 8.5739 8.7748 8.8530 8.9401 9.1677 9.1863 9.4390 9.5534 9.6230 9.7208 12.5463 12.5469 12.9965 13.0173 k = 0.0000 0.5000 0.3176 ( 12528 PWs) bands (ev): -67.2293 -67.2293 -38.6590 -38.6590 -28.9336 -28.9336 -28.8733 -28.8733 -22.7379 -22.7379 -22.6928 -22.6928 -22.6862 -22.6862 -20.5083 -20.5083 -20.4673 -20.4673 -20.4506 -20.4506 -20.4492 -20.4492 -5.5843 -5.5835 -5.3207 -5.2798 -5.0666 -5.0382 -4.9924 -4.9737 2.0163 2.0173 2.4314 2.4495 2.7186 2.7717 3.0766 3.1445 3.1835 3.2779 3.3898 3.4330 3.6268 3.6302 3.7748 3.7943 3.8736 3.8969 4.1969 4.2453 4.3834 4.4148 4.5228 4.5443 4.8315 4.8716 4.9498 4.9604 5.1352 5.1447 5.3191 5.3268 5.4223 5.4290 5.4886 5.5590 5.6712 5.6870 6.2579 6.2850 6.4411 6.4548 6.8618 6.8649 8.6064 8.8061 8.8529 8.9362 9.1596 9.1781 9.4518 9.5732 9.6401 9.7280 12.5782 12.5791 12.9937 13.0116 k = 0.0000 0.5000 0.3343 ( 12542 PWs) bands (ev): -67.2293 -67.2293 -38.6590 -38.6590 -28.9336 -28.9336 -28.8733 -28.8733 -22.7379 -22.7379 -22.6928 -22.6928 -22.6862 -22.6862 -20.5083 -20.5083 -20.4673 -20.4673 -20.4506 -20.4506 -20.4492 -20.4492 -5.5720 -5.5712 -5.3122 -5.2700 -5.0777 -5.0492 -5.0031 -4.9835 2.0113 2.0123 2.4315 2.4496 2.7289 2.7850 3.0623 3.1333 3.1835 3.2772 3.3832 3.4254 3.6168 3.6197 3.7629 3.7908 3.8950 3.9164 4.1938 4.2383 4.3834 4.4124 4.5186 4.5401 4.8223 4.8603 4.9530 4.9615 5.1314 5.1388 5.3225 5.3283 5.4183 5.4257 5.4918 5.5586 5.6763 5.6911 6.2702 6.2967 6.4240 6.4375 6.8758 6.8792 8.6382 8.8325 8.8515 8.9315 9.1562 9.1734 9.4646 9.5927 9.6566 9.7332 12.6096 12.6107 12.9885 13.0037 k = 0.0000 0.5000 0.3511 ( 12546 PWs) bands (ev): -67.2293 -67.2293 -38.6590 -38.6590 -28.9336 -28.9336 -28.8733 -28.8733 -22.7379 -22.7379 -22.6928 -22.6928 -22.6862 -22.6862 -20.5083 -20.5083 -20.4673 -20.4673 -20.4506 -20.4506 -20.4492 -20.4492 -5.5597 -5.5589 -5.3036 -5.2602 -5.0888 -5.0601 -5.0139 -4.9935 2.0064 2.0074 2.4317 2.4494 2.7397 2.7984 3.0484 3.1222 3.1844 3.2762 3.3774 3.4177 3.6069 3.6097 3.7522 3.7859 3.9161 3.9364 4.1914 4.2317 4.3836 4.4101 4.5152 4.5366 4.8123 4.8480 4.9558 4.9624 5.1276 5.1329 5.3257 5.3299 5.4146 5.4226 5.4949 5.5576 5.6817 5.6954 6.2812 6.3068 6.4079 6.4211 6.8900 6.8935 8.6692 8.8489 8.8525 8.9269 9.1577 9.1718 9.4775 9.6116 9.6723 9.7364 12.6401 12.6415 12.9814 12.9943 k = 0.0000 0.5000 0.3678 ( 12540 PWs) bands (ev): -67.2293 -67.2293 -38.6590 -38.6590 -28.9336 -28.9336 -28.8733 -28.8733 -22.7379 -22.7379 -22.6928 -22.6928 -22.6862 -22.6862 -20.5083 -20.5083 -20.4673 -20.4673 -20.4505 -20.4505 -20.4492 -20.4492 -5.5476 -5.5467 -5.2947 -5.2505 -5.0994 -5.0709 -5.0247 -5.0038 2.0019 2.0028 2.4318 2.4490 2.7507 2.8116 3.0353 3.1110 3.1862 3.2747 3.3722 3.4100 3.5974 3.6001 3.7428 3.7802 3.9367 3.9560 4.1896 4.2254 4.3838 4.4079 4.5127 4.5338 4.8017 4.8349 4.9581 4.9629 5.1240 5.1274 5.3288 5.3315 5.4113 5.4197 5.4979 5.5560 5.6873 5.6997 6.2910 6.3151 6.3930 6.4056 6.9041 6.9075 8.6989 8.8456 8.8645 8.9241 9.1639 9.1732 9.4906 9.6294 9.6871 9.7377 12.6694 12.6709 12.9729 12.9837 k = 0.0000 0.5000 0.3845 ( 12552 PWs) bands (ev): -67.2293 -67.2293 -38.6590 -38.6590 -28.9336 -28.9336 -28.8733 -28.8733 -22.7379 -22.7379 -22.6928 -22.6928 -22.6862 -22.6862 -20.5083 -20.5083 -20.4673 -20.4673 -20.4505 -20.4505 -20.4492 -20.4492 -5.5358 -5.5350 -5.2858 -5.2412 -5.1095 -5.0812 -5.0354 -5.0142 1.9976 1.9986 2.4321 2.4482 2.7620 2.8245 3.0230 3.0998 3.1889 3.2728 3.3677 3.4024 3.5885 3.5911 3.7349 3.7741 3.9564 3.9749 4.1884 4.2197 4.3842 4.4057 4.5111 4.5318 4.7904 4.8211 4.9599 4.9632 5.1206 5.1224 5.3315 5.3330 5.4084 5.4171 5.5010 5.5540 5.6929 5.7040 6.2994 6.3218 6.3794 6.3914 6.9176 6.9209 8.7271 8.8418 8.8680 8.9242 9.1735 9.1771 9.5039 9.6456 9.7007 9.7372 12.6970 12.6987 12.9636 12.9725 k = 0.0000 0.5000 0.4012 ( 12540 PWs) bands (ev): -67.2293 -67.2293 -38.6590 -38.6590 -28.9336 -28.9336 -28.8733 -28.8733 -22.7379 -22.7379 -22.6928 -22.6928 -22.6862 -22.6862 -20.5083 -20.5083 -20.4673 -20.4673 -20.4505 -20.4505 -20.4492 -20.4492 -5.5245 -5.5237 -5.2770 -5.2326 -5.1187 -5.0909 -5.0458 -5.0247 1.9937 1.9946 2.4324 2.4473 2.7735 2.8365 3.0119 3.0884 3.1925 3.2704 3.3639 3.3949 3.5803 3.5829 3.7286 3.7676 3.9750 3.9925 4.1877 4.2145 4.3846 4.4036 4.5105 4.5304 4.7789 4.8068 4.9613 4.9634 5.1175 5.1181 5.3340 5.3345 5.4061 5.4146 5.5040 5.5516 5.6984 5.7081 6.3067 6.3269 6.3674 6.3785 6.9304 6.9334 8.7534 8.8381 8.8650 8.9259 9.1828 9.1851 9.5178 9.6598 9.7130 9.7355 12.7226 12.7244 12.9539 12.9612 k = 0.0000 0.5000 0.4179 ( 12540 PWs) bands (ev): -67.2293 -67.2293 -38.6590 -38.6590 -28.9336 -28.9336 -28.8733 -28.8733 -22.7379 -22.7379 -22.6928 -22.6928 -22.6862 -22.6862 -20.5083 -20.5083 -20.4673 -20.4673 -20.4505 -20.4505 -20.4492 -20.4492 -5.5139 -5.5132 -5.2682 -5.2251 -5.1265 -5.0998 -5.0557 -5.0353 1.9903 1.9911 2.4328 2.4462 2.7852 2.8472 3.0025 3.0769 3.1970 3.2673 3.3609 3.3877 3.5730 3.5754 3.7239 3.7610 3.9921 4.0083 4.1875 4.2100 4.3852 4.4016 4.5108 4.5296 4.7675 4.7924 4.9623 4.9635 5.1146 5.1148 5.3358 5.3361 5.4043 5.4124 5.5071 5.5488 5.7035 5.7119 6.3127 6.3305 6.3572 6.3673 6.9420 6.9447 8.7775 8.8352 8.8587 8.9271 9.1899 9.1973 9.5323 9.6706 9.7238 9.7335 12.7458 12.7476 12.9444 12.9503 k = 0.0000 0.5000 0.4346 ( 12548 PWs) bands (ev): -67.2293 -67.2293 -38.6590 -38.6590 -28.9336 -28.9336 -28.8733 -28.8733 -22.7379 -22.7379 -22.6928 -22.6928 -22.6862 -22.6862 -20.5083 -20.5083 -20.4673 -20.4673 -20.4505 -20.4505 -20.4492 -20.4492 -5.5043 -5.5037 -5.2598 -5.2192 -5.1322 -5.1077 -5.0650 -5.0457 1.9873 1.9880 2.4333 2.4449 2.7968 2.8557 2.9954 3.0652 3.2022 3.2636 3.3585 3.3809 3.5667 3.5689 3.7208 3.7545 4.0075 4.0221 4.1878 4.2060 4.3860 4.3997 4.5120 4.5292 4.7566 4.7783 4.9630 4.9636 5.1118 5.1125 5.3371 5.3378 5.4030 5.4104 5.5103 5.5457 5.7082 5.7152 6.3174 6.3322 6.3491 6.3581 6.9524 6.9547 8.7979 8.8345 8.8513 8.9266 9.1978 9.2087 9.5476 9.6766 9.7326 9.7328 12.7661 12.7679 12.9357 12.9402 k = 0.0000 0.5000 0.4514 ( 12558 PWs) bands (ev): -67.2293 -67.2293 -38.6590 -38.6590 -28.9336 -28.9336 -28.8733 -28.8733 -22.7379 -22.7379 -22.6928 -22.6928 -22.6862 -22.6862 -20.5083 -20.5083 -20.4673 -20.4673 -20.4505 -20.4505 -20.4492 -20.4492 -5.4959 -5.4954 -5.2517 -5.2158 -5.1354 -5.1142 -5.0732 -5.0558 1.9849 1.9855 2.4339 2.4435 2.8083 2.8614 2.9913 3.0535 3.2082 3.2593 3.3568 3.3747 3.5614 3.5633 3.7193 3.7480 4.0209 4.0334 4.1885 4.2026 4.3868 4.3979 4.5140 4.5290 4.7469 4.7651 4.9634 4.9636 5.1097 5.1106 5.3381 5.3391 5.4023 5.4087 5.5136 5.5424 5.7124 5.7180 6.3203 6.3316 6.3436 6.3518 6.9612 6.9631 8.8115 8.8395 8.8439 8.9241 9.2059 9.2182 9.5636 9.6762 9.7344 9.7401 12.7834 12.7850 12.9280 12.9314 k = 0.0000 0.5000 0.4681 ( 12544 PWs) bands (ev): -67.2293 -67.2293 -38.6590 -38.6590 -28.9336 -28.9336 -28.8733 -28.8733 -22.7379 -22.7379 -22.6928 -22.6928 -22.6862 -22.6862 -20.5083 -20.5083 -20.4673 -20.4673 -20.4505 -20.4505 -20.4492 -20.4492 -5.4890 -5.4886 -5.2440 -5.2149 -5.1358 -5.1194 -5.0801 -5.0654 1.9830 1.9834 2.4347 2.4421 2.8196 2.8634 2.9909 3.0419 3.2146 3.2542 3.3560 3.3693 3.5573 3.5588 3.7193 3.7419 4.0321 4.0419 4.1895 4.1998 4.3878 4.3961 4.5167 4.5288 4.7390 4.7532 4.9636 4.9637 5.1082 5.1091 5.3390 5.3400 5.4020 5.4070 5.5171 5.5389 5.7159 5.7201 6.3212 6.3290 6.3411 6.3482 6.9682 6.9697 8.8166 8.8371 8.8520 8.9195 9.2136 9.2251 9.5803 9.6699 9.7383 9.7454 12.7971 12.7985 12.9218 12.9242 k = 0.0000 0.5000 0.4848 ( 12532 PWs) bands (ev): -67.2293 -67.2293 -38.6590 -38.6590 -28.9336 -28.9336 -28.8734 -28.8734 -22.7379 -22.7379 -22.6928 -22.6928 -22.6862 -22.6862 -20.5083 -20.5083 -20.4673 -20.4673 -20.4505 -20.4505 -20.4492 -20.4492 -5.4838 -5.4835 -5.2370 -5.2166 -5.1341 -5.1232 -5.0849 -5.0740 1.9816 1.9819 2.4357 2.4407 2.8305 2.8618 2.9942 3.0304 3.2214 3.2484 3.3559 3.3647 3.5544 3.5555 3.7206 3.7362 4.0408 4.0476 4.1907 4.1974 4.3889 4.3944 4.5196 4.5282 4.7335 4.7434 4.9636 4.9638 5.1072 5.1079 5.3398 5.3405 5.4021 5.4056 5.5206 5.5352 5.7186 5.7214 6.3207 6.3256 6.3411 6.3464 6.9735 6.9744 8.8185 8.8312 8.8669 8.9128 9.2204 9.2293 9.5973 9.6593 9.7428 9.7486 12.8072 12.8082 12.9174 12.9189 k = 0.0000 0.5000 0.5015 ( 12544 PWs) bands (ev): -67.2293 -67.2293 -38.6590 -38.6590 -28.9336 -28.9336 -28.8734 -28.8734 -22.7379 -22.7379 -22.6928 -22.6928 -22.6862 -22.6862 -20.5083 -20.5083 -20.4673 -20.4673 -20.4505 -20.4505 -20.4492 -20.4492 -5.4805 -5.4804 -5.2306 -5.2201 -5.1314 -5.1261 -5.0869 -5.0810 1.9808 1.9810 2.4368 2.4393 2.8406 2.8569 3.0006 3.0194 3.2284 3.2421 3.3567 3.3611 3.5528 3.5534 3.7230 3.7310 4.0468 4.0503 4.1922 4.1954 4.3901 4.3929 4.5225 4.5270 4.7311 4.7361 4.9637 4.9638 5.1068 5.1072 5.3403 5.3407 5.4026 5.4044 5.5242 5.5316 5.7206 5.7220 6.3204 6.3227 6.3423 6.3450 6.9767 6.9772 8.8202 8.8264 8.8810 8.9041 9.2258 9.2306 9.6142 9.6459 9.7467 9.7499 12.8134 12.8140 12.9148 12.9155 k = 0.0000 0.5000 0.5182 ( 12544 PWs) bands (ev): -67.2293 -67.2293 -38.6590 -38.6590 -28.9336 -28.9336 -28.8734 -28.8734 -22.7379 -22.7379 -22.6928 -22.6928 -22.6862 -22.6862 -20.5083 -20.5083 -20.4673 -20.4673 -20.4505 -20.4505 -20.4492 -20.4492 -5.4794 -5.4794 -5.2249 -5.2249 -5.1287 -5.1287 -5.0856 -5.0856 1.9806 1.9806 2.4380 2.4380 2.8496 2.8496 3.0092 3.0092 3.2354 3.2354 3.3584 3.3584 3.5525 3.5525 3.7266 3.7266 4.0500 4.0500 4.1937 4.1937 4.3914 4.3914 4.5250 4.5250 4.7320 4.7320 4.9637 4.9637 5.1068 5.1068 5.3406 5.3406 5.4034 5.4034 5.5279 5.5279 5.7217 5.7217 6.3209 6.3209 6.3437 6.3437 6.9780 6.9780 8.8228 8.8228 8.8935 8.8935 9.2293 9.2293 9.6306 9.6306 9.7492 9.7492 12.8157 12.8157 12.9141 12.9141 k = 0.5000 0.5000-0.0000 ( 12464 PWs) bands (ev): -67.2293 -67.2293 -38.6592 -38.6592 -28.9347 -28.9347 -28.8735 -28.8735 -22.7379 -22.7379 -22.6928 -22.6928 -22.6862 -22.6862 -20.5084 -20.5084 -20.4673 -20.4673 -20.4506 -20.4506 -20.4492 -20.4492 -5.3896 -5.3896 -5.2644 -5.2644 -5.1803 -5.1803 -5.0841 -5.0841 2.5041 2.5041 2.5057 2.5057 2.9705 2.9705 3.1816 3.1816 3.2708 3.2708 3.4988 3.4988 3.5359 3.5359 3.6106 3.6106 3.7042 3.7042 4.1015 4.1015 4.2151 4.2151 4.3323 4.3323 4.9201 4.9201 4.9575 4.9575 5.1243 5.1243 5.1551 5.1551 5.2547 5.2547 5.2823 5.2823 5.5027 5.5027 6.4810 6.4810 6.5166 6.5166 6.9964 6.9964 8.5952 8.5952 8.8332 8.8332 9.1662 9.1662 9.8250 9.8250 9.8621 9.8621 12.5491 12.5491 12.5553 12.5553 k = 0.5000 0.5000 0.0167 ( 12480 PWs) bands (ev): -67.2293 -67.2293 -38.6592 -38.6592 -28.9347 -28.9347 -28.8735 -28.8735 -22.7379 -22.7379 -22.6928 -22.6928 -22.6862 -22.6862 -20.5084 -20.5084 -20.4673 -20.4673 -20.4506 -20.4506 -20.4492 -20.4492 -5.3894 -5.3894 -5.2644 -5.2644 -5.1803 -5.1803 -5.0841 -5.0841 2.5017 2.5017 2.5060 2.5060 2.9627 2.9627 3.1840 3.1840 3.2757 3.2757 3.4984 3.4984 3.5366 3.5366 3.6109 3.6109 3.7043 3.7043 4.1015 4.1015 4.2151 4.2151 4.3325 4.3325 4.9202 4.9202 4.9572 4.9572 5.1238 5.1238 5.1552 5.1552 5.2546 5.2546 5.2821 5.2821 5.5029 5.5029 6.4826 6.4826 6.5182 6.5182 6.9967 6.9967 8.5956 8.5956 8.8346 8.8346 9.1674 9.1674 9.8253 9.8253 9.8624 9.8624 12.5464 12.5464 12.5525 12.5525 k = 0.5000 0.5000 0.0334 ( 12492 PWs) bands (ev): -67.2293 -67.2293 -38.6592 -38.6592 -28.9347 -28.9347 -28.8735 -28.8735 -22.7379 -22.7379 -22.6928 -22.6928 -22.6862 -22.6862 -20.5084 -20.5084 -20.4673 -20.4673 -20.4506 -20.4506 -20.4492 -20.4492 -5.3888 -5.3888 -5.2642 -5.2642 -5.1802 -5.1802 -5.0842 -5.0842 2.4967 2.4967 2.5049 2.5049 2.9416 2.9416 3.1893 3.1893 3.2903 3.2903 3.4971 3.4971 3.5388 3.5388 3.6116 3.6116 3.7044 3.7044 4.1017 4.1017 4.2150 4.2150 4.3330 4.3330 4.9202 4.9202 4.9563 4.9563 5.1222 5.1222 5.1554 5.1554 5.2541 5.2541 5.2815 5.2815 5.5035 5.5035 6.4874 6.4874 6.5228 6.5228 6.9973 6.9973 8.5970 8.5970 8.8387 8.8387 9.1709 9.1709 9.8263 9.8263 9.8633 9.8633 12.5383 12.5383 12.5441 12.5441 k = 0.5000 0.5000 0.0502 ( 12516 PWs) bands (ev): -67.2293 -67.2293 -38.6592 -38.6592 -28.9347 -28.9347 -28.8735 -28.8735 -22.7379 -22.7379 -22.6928 -22.6928 -22.6862 -22.6862 -20.5084 -20.5084 -20.4673 -20.4673 -20.4506 -20.4506 -20.4492 -20.4492 -5.3879 -5.3879 -5.2640 -5.2640 -5.1800 -5.1800 -5.0843 -5.0843 2.4897 2.4897 2.5019 2.5019 2.9117 2.9117 3.1943 3.1943 3.3131 3.3131 3.4951 3.4951 3.5425 3.5425 3.6127 3.6127 3.7046 3.7046 4.1021 4.1021 4.2149 4.2149 4.3338 4.3338 4.9204 4.9204 4.9548 4.9548 5.1198 5.1198 5.1556 5.1556 5.2533 5.2533 5.2805 5.2805 5.5045 5.5045 6.4955 6.4955 6.5304 6.5304 6.9984 6.9984 8.5993 8.5993 8.8451 8.8451 9.1769 9.1769 9.8280 9.8280 9.8647 9.8647 12.5250 12.5250 12.5303 12.5303 k = 0.5000 0.5000 0.0669 ( 12512 PWs) bands (ev): -67.2293 -67.2293 -38.6592 -38.6592 -28.9347 -28.9347 -28.8735 -28.8735 -22.7379 -22.7379 -22.6928 -22.6928 -22.6862 -22.6862 -20.5084 -20.5084 -20.4673 -20.4673 -20.4506 -20.4506 -20.4492 -20.4492 -5.3866 -5.3866 -5.2637 -5.2637 -5.1797 -5.1797 -5.0845 -5.0845 2.4808 2.4808 2.4970 2.4970 2.8765 2.8765 3.1979 3.1979 3.3411 3.3411 3.4929 3.4929 3.5476 3.5476 3.6142 3.6142 3.7049 3.7049 4.1025 4.1025 4.2147 4.2147 4.3350 4.3350 4.9205 4.9205 4.9528 4.9528 5.1165 5.1165 5.1558 5.1558 5.2522 5.2522 5.2793 5.2793 5.5059 5.5059 6.5066 6.5066 6.5410 6.5410 6.9998 6.9998 8.6029 8.6029 8.8534 8.8534 9.1856 9.1856 9.8302 9.8302 9.8666 9.8666 12.5067 12.5067 12.5113 12.5113 k = 0.5000 0.5000 0.0836 ( 12520 PWs) bands (ev): -67.2293 -67.2293 -38.6592 -38.6592 -28.9347 -28.9347 -28.8735 -28.8735 -22.7379 -22.7379 -22.6928 -22.6928 -22.6862 -22.6862 -20.5084 -20.5084 -20.4673 -20.4673 -20.4506 -20.4506 -20.4492 -20.4492 -5.3849 -5.3849 -5.2633 -5.2633 -5.1794 -5.1794 -5.0847 -5.0847 2.4701 2.4701 2.4904 2.4904 2.8382 2.8382 3.2004 3.2004 3.3708 3.3708 3.4912 3.4912 3.5543 3.5543 3.6161 3.6161 3.7054 3.7054 4.1031 4.1031 4.2146 4.2146 4.3364 4.3364 4.9207 4.9207 4.9504 4.9504 5.1125 5.1125 5.1558 5.1558 5.2508 5.2508 5.2778 5.2778 5.5075 5.5075 6.5207 6.5207 6.5545 6.5545 7.0017 7.0017 8.6077 8.6077 8.8629 8.8629 9.1974 9.1974 9.8330 9.8330 9.8691 9.8691 12.4835 12.4835 12.4872 12.4872 k = 0.5000 0.5000 0.1003 ( 12524 PWs) bands (ev): -67.2293 -67.2293 -38.6592 -38.6592 -28.9347 -28.9347 -28.8735 -28.8735 -22.7379 -22.7379 -22.6928 -22.6928 -22.6862 -22.6862 -20.5084 -20.5084 -20.4673 -20.4673 -20.4506 -20.4506 -20.4492 -20.4492 -5.3829 -5.3829 -5.2629 -5.2629 -5.1790 -5.1790 -5.0850 -5.0850 2.4578 2.4578 2.4822 2.4822 2.7984 2.7984 3.2022 3.2022 3.3983 3.3983 3.4920 3.4920 3.5627 3.5627 3.6181 3.6181 3.7060 3.7060 4.1038 4.1038 4.2145 4.2145 4.3381 4.3381 4.9207 4.9207 4.9477 4.9477 5.1079 5.1079 5.1556 5.1556 5.2490 5.2490 5.2763 5.2763 5.5093 5.5093 6.5377 6.5377 6.5708 6.5708 7.0040 7.0040 8.6141 8.6141 8.8729 8.8729 9.2125 9.2125 9.8364 9.8364 9.8719 9.8719 12.4557 12.4557 12.4585 12.4585 k = 0.5000 0.5000 0.1170 ( 12524 PWs) bands (ev): -67.2293 -67.2293 -38.6592 -38.6592 -28.9347 -28.9347 -28.8735 -28.8735 -22.7379 -22.7379 -22.6928 -22.6928 -22.6862 -22.6862 -20.5084 -20.5084 -20.4673 -20.4673 -20.4506 -20.4506 -20.4492 -20.4492 -5.3805 -5.3805 -5.2624 -5.2624 -5.1785 -5.1785 -5.0854 -5.0854 2.4441 2.4441 2.4725 2.4725 2.7577 2.7577 3.2036 3.2036 3.4184 3.4184 3.4987 3.4987 3.5735 3.5735 3.6204 3.6204 3.7068 3.7068 4.1045 4.1045 4.2144 4.2144 4.3401 4.3401 4.9205 4.9205 4.9448 4.9448 5.1029 5.1029 5.1551 5.1551 5.2468 5.2468 5.2747 5.2747 5.5114 5.5114 6.5574 6.5574 6.5896 6.5896 7.0066 7.0066 8.6220 8.6220 8.8829 8.8829 9.2311 9.2311 9.8402 9.8402 9.8752 9.8752 12.4235 12.4235 12.4258 12.4258 k = 0.5000 0.5000 0.1337 ( 12508 PWs) bands (ev): -67.2293 -67.2293 -38.6592 -38.6592 -28.9347 -28.9347 -28.8735 -28.8735 -22.7379 -22.7379 -22.6928 -22.6928 -22.6862 -22.6862 -20.5084 -20.5084 -20.4673 -20.4673 -20.4506 -20.4506 -20.4492 -20.4492 -5.3779 -5.3779 -5.2618 -5.2618 -5.1780 -5.1780 -5.0858 -5.0858 2.4291 2.4291 2.4616 2.4616 2.7168 2.7168 3.2047 3.2047 3.4271 3.4271 3.5137 3.5137 3.5875 3.5875 3.6227 3.6227 3.7077 3.7077 4.1054 4.1054 4.2143 4.2143 4.3422 4.3422 4.9199 4.9199 4.9420 4.9420 5.0975 5.0975 5.1544 5.1544 5.2444 5.2444 5.2732 5.2732 5.5135 5.5135 6.5797 6.5797 6.6110 6.6110 7.0095 7.0095 8.6317 8.6317 8.8922 8.8922 9.2534 9.2534 9.8445 9.8445 9.8787 9.8787 12.3873 12.3873 12.3896 12.3896 k = 0.5000 0.5000 0.1505 ( 12492 PWs) bands (ev): -67.2293 -67.2293 -38.6592 -38.6592 -28.9347 -28.9347 -28.8735 -28.8735 -22.7379 -22.7379 -22.6928 -22.6928 -22.6862 -22.6862 -20.5084 -20.5084 -20.4673 -20.4673 -20.4506 -20.4506 -20.4492 -20.4492 -5.3749 -5.3749 -5.2611 -5.2611 -5.1774 -5.1774 -5.0863 -5.0863 2.4130 2.4130 2.4495 2.4495 2.6761 2.6761 3.2056 3.2056 3.4265 3.4265 3.5327 3.5327 3.6061 3.6061 3.6251 3.6251 3.7089 3.7089 4.1063 4.1063 4.2144 4.2144 4.3445 4.3445 4.9185 4.9185 4.9396 4.9396 5.0917 5.0917 5.1533 5.1533 5.2415 5.2415 5.2719 5.2719 5.5156 5.5156 6.6043 6.6043 6.6345 6.6345 7.0127 7.0127 8.6429 8.6429 8.9006 8.9006 9.2795 9.2795 9.8490 9.8490 9.8825 9.8825 12.3473 12.3473 12.3506 12.3506 k = 0.5000 0.5000 0.1672 ( 12524 PWs) bands (ev): -67.2293 -67.2293 -38.6592 -38.6592 -28.9347 -28.9347 -28.8736 -28.8736 -22.7379 -22.7379 -22.6928 -22.6928 -22.6862 -22.6862 -20.5084 -20.5084 -20.4673 -20.4673 -20.4506 -20.4506 -20.4492 -20.4492 -5.3717 -5.3717 -5.2604 -5.2604 -5.1768 -5.1768 -5.0868 -5.0868 2.3961 2.3961 2.4366 2.4366 2.6359 2.6359 3.2065 3.2065 3.4210 3.4210 3.5505 3.5505 3.6268 3.6268 3.6308 3.6308 3.7102 3.7102 4.1073 4.1073 4.2145 4.2145 4.3470 4.3470 4.9163 4.9163 4.9380 4.9380 5.0857 5.0857 5.1520 5.1520 5.2384 5.2384 5.2707 5.2707 5.5178 5.5178 6.6310 6.6310 6.6601 6.6601 7.0162 7.0162 8.6558 8.6558 8.9077 8.9077 9.3092 9.3092 9.8538 9.8538 9.8864 9.8864 12.3044 12.3044 12.3091 12.3091 k = 0.5000 0.5000 0.1839 ( 12532 PWs) bands (ev): -67.2293 -67.2293 -38.6592 -38.6592 -28.9347 -28.9347 -28.8736 -28.8736 -22.7379 -22.7379 -22.6928 -22.6928 -22.6862 -22.6862 -20.5084 -20.5084 -20.4673 -20.4673 -20.4506 -20.4506 -20.4492 -20.4492 -5.3683 -5.3683 -5.2597 -5.2597 -5.1761 -5.1761 -5.0874 -5.0874 2.3785 2.3785 2.4229 2.4229 2.5963 2.5963 3.2072 3.2072 3.4130 3.4130 3.5652 3.5652 3.6295 3.6295 3.6587 3.6587 3.7118 3.7118 4.1083 4.1083 4.2146 4.2146 4.3495 4.3495 4.9130 4.9130 4.9372 4.9372 5.0795 5.0795 5.1503 5.1503 5.2350 5.2350 5.2698 5.2698 5.5199 5.5199 6.6595 6.6595 6.6876 6.6876 7.0199 7.0199 8.6703 8.6703 8.9135 8.9135 9.3421 9.3421 9.8587 9.8587 9.8904 9.8904 12.2592 12.2592 12.2656 12.2656 k = 0.5000 0.5000 0.2006 ( 12532 PWs) bands (ev): -67.2293 -67.2293 -38.6592 -38.6592 -28.9347 -28.9347 -28.8736 -28.8736 -22.7379 -22.7379 -22.6928 -22.6928 -22.6862 -22.6862 -20.5084 -20.5084 -20.4673 -20.4673 -20.4506 -20.4506 -20.4492 -20.4492 -5.3646 -5.3646 -5.2590 -5.2590 -5.1754 -5.1754 -5.0881 -5.0881 2.3605 2.3605 2.4086 2.4086 2.5577 2.5577 3.2079 3.2079 3.4035 3.4035 3.5774 3.5774 3.6317 3.6317 3.6894 3.6894 3.7138 3.7138 4.1093 4.1093 4.2149 4.2149 4.3521 4.3521 4.9089 4.9089 4.9371 4.9371 5.0731 5.0731 5.1485 5.1485 5.2315 5.2315 5.2691 5.2691 5.5219 5.5219 6.6897 6.6897 6.7166 6.7166 7.0237 7.0237 8.6862 8.6862 8.9181 8.9181 9.3780 9.3780 9.8636 9.8636 9.8943 9.8943 12.2122 12.2122 12.2205 12.2205 k = 0.5000 0.5000 0.2173 ( 12548 PWs) bands (ev): -67.2293 -67.2293 -38.6592 -38.6592 -28.9347 -28.9347 -28.8736 -28.8736 -22.7379 -22.7379 -22.6928 -22.6928 -22.6862 -22.6862 -20.5084 -20.5084 -20.4673 -20.4673 -20.4506 -20.4506 -20.4492 -20.4492 -5.3607 -5.3607 -5.2582 -5.2582 -5.1747 -5.1747 -5.0888 -5.0888 2.3423 2.3423 2.3940 2.3940 2.5202 2.5202 3.2085 3.2085 3.3932 3.3932 3.5878 3.5878 3.6340 3.6340 3.7136 3.7136 3.7237 3.7237 4.1103 4.1103 4.2153 4.2153 4.3547 4.3547 4.9043 4.9043 4.9375 4.9375 5.0667 5.0667 5.1463 5.1463 5.2278 5.2278 5.2686 5.2686 5.5238 5.5238 6.7212 6.7212 6.7470 6.7470 7.0278 7.0278 8.7033 8.7033 8.9216 8.9216 9.4164 9.4164 9.8686 9.8686 9.8981 9.8981 12.1642 12.1642 12.1743 12.1743 k = 0.5000 0.5000 0.2340 ( 12540 PWs) bands (ev): -67.2293 -67.2293 -38.6592 -38.6592 -28.9347 -28.9347 -28.8736 -28.8736 -22.7379 -22.7379 -22.6928 -22.6928 -22.6862 -22.6862 -20.5084 -20.5084 -20.4673 -20.4673 -20.4506 -20.4506 -20.4492 -20.4492 -5.3567 -5.3567 -5.2574 -5.2574 -5.1739 -5.1739 -5.0896 -5.0896 2.3240 2.3240 2.3792 2.3792 2.4839 2.4839 3.2091 3.2091 3.3823 3.3823 3.5968 3.5968 3.6364 3.6364 3.7167 3.7167 3.7546 3.7546 4.1114 4.1114 4.2158 4.2158 4.3573 4.3573 4.8993 4.8993 4.9383 4.9383 5.0603 5.0603 5.1440 5.1440 5.2240 5.2240 5.2683 5.2683 5.5255 5.5255 6.7537 6.7537 6.7784 6.7784 7.0319 7.0319 8.7216 8.7216 8.9240 8.9240 9.4568 9.4568 9.8733 9.8733 9.9017 9.9017 12.1156 12.1156 12.1278 12.1278 k = 0.5000 0.5000 0.2508 ( 12580 PWs) bands (ev): -67.2293 -67.2293 -38.6592 -38.6592 -28.9347 -28.9347 -28.8736 -28.8736 -22.7379 -22.7379 -22.6928 -22.6928 -22.6862 -22.6862 -20.5084 -20.5084 -20.4673 -20.4673 -20.4506 -20.4506 -20.4492 -20.4492 -5.3525 -5.3525 -5.2566 -5.2566 -5.1732 -5.1732 -5.0904 -5.0904 2.3058 2.3058 2.3643 2.3643 2.4489 2.4489 3.2095 3.2095 3.3712 3.3712 3.6044 3.6044 3.6392 3.6392 3.7188 3.7188 3.7862 3.7862 4.1124 4.1124 4.2163 4.2163 4.3598 4.3598 4.8940 4.8940 4.9393 4.9393 5.0539 5.0539 5.1415 5.1415 5.2203 5.2203 5.2681 5.2681 5.5272 5.5272 6.7870 6.7870 6.8105 6.8105 7.0361 7.0361 8.7406 8.7406 8.9257 8.9257 9.4987 9.4987 9.8779 9.8779 9.9050 9.9050 12.0671 12.0671 12.0813 12.0813 k = 0.5000 0.5000 0.2675 ( 12568 PWs) bands (ev): -67.2293 -67.2293 -38.6592 -38.6592 -28.9347 -28.9347 -28.8736 -28.8736 -22.7379 -22.7379 -22.6928 -22.6928 -22.6862 -22.6862 -20.5084 -20.5084 -20.4673 -20.4673 -20.4506 -20.4506 -20.4492 -20.4492 -5.3483 -5.3483 -5.2558 -5.2558 -5.1724 -5.1724 -5.0913 -5.0913 2.2880 2.2880 2.3495 2.3495 2.4155 2.4155 3.2098 3.2098 3.3600 3.3600 3.6105 3.6105 3.6428 3.6428 3.7209 3.7209 3.8169 3.8169 4.1134 4.1134 4.2169 4.2169 4.3623 4.3623 4.8887 4.8887 4.9405 4.9405 5.0475 5.0475 5.1388 5.1388 5.2166 5.2166 5.2681 5.2681 5.5286 5.5286 6.8207 6.8207 6.8431 6.8431 7.0403 7.0403 8.7603 8.7603 8.9267 8.9267 9.5415 9.5415 9.8821 9.8821 9.9080 9.9080 12.0191 12.0191 12.0353 12.0353 k = 0.5000 0.5000 0.2842 ( 12560 PWs) bands (ev): -67.2293 -67.2293 -38.6592 -38.6592 -28.9347 -28.9347 -28.8736 -28.8736 -22.7379 -22.7379 -22.6928 -22.6928 -22.6862 -22.6862 -20.5084 -20.5084 -20.4673 -20.4673 -20.4506 -20.4506 -20.4492 -20.4492 -5.3440 -5.3440 -5.2551 -5.2551 -5.1716 -5.1716 -5.0922 -5.0922 2.2705 2.2705 2.3350 2.3350 2.3837 2.3837 3.2100 3.2100 3.3489 3.3489 3.6150 3.6150 3.6472 3.6472 3.7228 3.7228 3.8465 3.8465 4.1145 4.1145 4.2176 4.2176 4.3646 4.3646 4.8835 4.8835 4.9419 4.9419 5.0414 5.0414 5.1361 5.1361 5.2131 5.2131 5.2683 5.2683 5.5299 5.5299 6.8546 6.8546 6.8758 6.8758 7.0446 7.0446 8.7803 8.7803 8.9272 8.9272 9.5848 9.5848 9.8859 9.8859 9.9106 9.9106 11.9720 11.9720 11.9904 11.9904 k = 0.5000 0.5000 0.3009 ( 12552 PWs) bands (ev): -67.2293 -67.2293 -38.6592 -38.6592 -28.9347 -28.9347 -28.8737 -28.8737 -22.7379 -22.7379 -22.6928 -22.6928 -22.6862 -22.6862 -20.5084 -20.5084 -20.4673 -20.4673 -20.4506 -20.4506 -20.4492 -20.4492 -5.3397 -5.3397 -5.2544 -5.2544 -5.1709 -5.1709 -5.0932 -5.0932 2.2537 2.2537 2.3209 2.3209 2.3536 2.3536 3.2101 3.2101 3.3382 3.3382 3.6181 3.6181 3.6525 3.6525 3.7247 3.7247 3.8748 3.8748 4.1155 4.1155 4.2183 4.2183 4.3668 4.3668 4.8783 4.8783 4.9432 4.9432 5.0354 5.0354 5.1332 5.1332 5.2097 5.2097 5.2685 5.2685 5.5311 5.5311 6.8882 6.8882 6.9083 6.9083 7.0488 7.0488 8.8004 8.8004 8.9274 8.9274 9.6281 9.6281 9.8893 9.8893 9.9127 9.9127 11.9265 11.9265 11.9470 11.9470 k = 0.5000 0.5000 0.3176 ( 12544 PWs) bands (ev): -67.2293 -67.2293 -38.6592 -38.6592 -28.9347 -28.9347 -28.8737 -28.8737 -22.7379 -22.7379 -22.6928 -22.6928 -22.6862 -22.6862 -20.5084 -20.5084 -20.4673 -20.4673 -20.4506 -20.4506 -20.4492 -20.4492 -5.3355 -5.3355 -5.2537 -5.2537 -5.1702 -5.1702 -5.0942 -5.0942 2.2377 2.2377 2.3073 2.3073 2.3255 2.3255 3.2099 3.2099 3.3279 3.3279 3.6199 3.6199 3.6583 3.6583 3.7263 3.7263 3.9016 3.9016 4.1164 4.1164 4.2190 4.2190 4.3688 4.3688 4.8733 4.8733 4.9447 4.9447 5.0297 5.0297 5.1303 5.1303 5.2064 5.2064 5.2687 5.2687 5.5321 5.5321 6.9212 6.9212 6.9402 6.9402 7.0529 7.0529 8.8202 8.8202 8.9273 8.9273 9.6709 9.6709 9.8922 9.8922 9.9145 9.9145 11.8828 11.8828 11.9054 11.9054 k = 0.5000 0.5000 0.3343 ( 12512 PWs) bands (ev): -67.2293 -67.2293 -38.6592 -38.6592 -28.9347 -28.9347 -28.8737 -28.8737 -22.7379 -22.7379 -22.6928 -22.6928 -22.6862 -22.6862 -20.5084 -20.5084 -20.4673 -20.4673 -20.4506 -20.4506 -20.4492 -20.4492 -5.3313 -5.3313 -5.2531 -5.2531 -5.1694 -5.1694 -5.0952 -5.0952 2.2225 2.2225 2.2937 2.2937 2.2997 2.2997 3.2095 3.2095 3.3183 3.3183 3.6210 3.6210 3.6644 3.6644 3.7277 3.7277 3.9268 3.9268 4.1174 4.1174 4.2197 4.2197 4.3706 4.3706 4.8684 4.8684 4.9461 4.9461 5.0243 5.0243 5.1274 5.1274 5.2034 5.2034 5.2691 5.2691 5.5330 5.5330 6.9533 6.9533 6.9712 6.9712 7.0571 7.0571 8.8395 8.8395 8.9273 8.9273 9.7125 9.7125 9.8945 9.8945 9.9160 9.9160 11.8414 11.8414 11.8661 11.8661 k = 0.5000 0.5000 0.3511 ( 12536 PWs) bands (ev): -67.2293 -67.2293 -38.6592 -38.6592 -28.9347 -28.9347 -28.8737 -28.8737 -22.7379 -22.7379 -22.6928 -22.6928 -22.6862 -22.6862 -20.5084 -20.5084 -20.4673 -20.4673 -20.4506 -20.4506 -20.4492 -20.4492 -5.3273 -5.3273 -5.2525 -5.2525 -5.1688 -5.1688 -5.0962 -5.0962 2.2083 2.2083 2.2737 2.2737 2.2831 2.2831 3.2089 3.2089 3.3094 3.3094 3.6215 3.6215 3.6706 3.6706 3.7289 3.7289 3.9502 3.9502 4.1183 4.1183 4.2204 4.2204 4.3722 4.3722 4.8639 4.8639 4.9475 4.9475 5.0192 5.0192 5.1246 5.1246 5.2007 5.2007 5.2695 5.2695 5.5337 5.5337 6.9841 6.9841 7.0006 7.0006 7.0613 7.0613 8.8576 8.8576 8.9274 8.9274 9.7525 9.7525 9.8963 9.8963 9.9173 9.9173 11.8026 11.8026 11.8294 11.8294 k = 0.5000 0.5000 0.3678 ( 12556 PWs) bands (ev): -67.2293 -67.2293 -38.6592 -38.6592 -28.9347 -28.9347 -28.8737 -28.8737 -22.7379 -22.7379 -22.6928 -22.6928 -22.6862 -22.6862 -20.5084 -20.5084 -20.4673 -20.4673 -20.4506 -20.4506 -20.4492 -20.4492 -5.3234 -5.3234 -5.2520 -5.2520 -5.1681 -5.1681 -5.0971 -5.0971 2.1952 2.1952 2.2516 2.2516 2.2715 2.2715 3.2080 3.2080 3.3014 3.3014 3.6217 3.6217 3.6766 3.6766 3.7298 3.7298 3.9719 3.9719 4.1192 4.1192 4.2211 4.2211 4.3736 4.3736 4.8596 4.8596 4.9489 4.9489 5.0145 5.0145 5.1218 5.1218 5.1981 5.1981 5.2698 5.2698 5.5343 5.5343 7.0133 7.0133 7.0278 7.0278 7.0660 7.0660 8.8742 8.8742 8.9281 8.9281 9.7900 9.7900 9.8976 9.8976 9.9187 9.9187 11.7667 11.7667 11.7954 11.7954 k = 0.5000 0.5000 0.3845 ( 12580 PWs) bands (ev): -67.2293 -67.2293 -38.6592 -38.6592 -28.9347 -28.9347 -28.8737 -28.8737 -22.7379 -22.7379 -22.6928 -22.6928 -22.6862 -22.6862 -20.5084 -20.5084 -20.4673 -20.4673 -20.4506 -20.4506 -20.4492 -20.4492 -5.3197 -5.3197 -5.2515 -5.2515 -5.1676 -5.1676 -5.0981 -5.0981 2.1833 2.1833 2.2314 2.2314 2.2612 2.2612 3.2068 3.2068 3.2943 3.2943 3.6217 3.6217 3.6823 3.6823 3.7305 3.7305 3.9916 3.9916 4.1200 4.1200 4.2217 4.2217 4.3747 4.3747 4.8557 4.8557 4.9502 4.9502 5.0102 5.0102 5.1191 5.1191 5.1958 5.1958 5.2702 5.2702 5.5348 5.5348 7.0403 7.0403 7.0506 7.0506 7.0731 7.0731 8.8884 8.8884 8.9301 8.9301 9.8239 9.8239 9.8985 9.8985 9.9210 9.9210 11.7340 11.7340 11.7646 11.7646 k = 0.5000 0.5000 0.4012 ( 12564 PWs) bands (ev): -67.2293 -67.2293 -38.6592 -38.6592 -28.9347 -28.9347 -28.8737 -28.8737 -22.7379 -22.7379 -22.6928 -22.6928 -22.6862 -22.6862 -20.5084 -20.5084 -20.4673 -20.4673 -20.4506 -20.4506 -20.4492 -20.4492 -5.3163 -5.3163 -5.2512 -5.2512 -5.1670 -5.1670 -5.0990 -5.0990 2.1728 2.1728 2.2132 2.2132 2.2518 2.2518 3.2054 3.2054 3.2882 3.2882 3.6215 3.6215 3.6877 3.6877 3.7308 3.7308 4.0092 4.0092 4.1208 4.1208 4.2223 4.2223 4.3756 4.3756 4.8522 4.8522 4.9514 4.9514 5.0064 5.0064 5.1167 5.1167 5.1938 5.1938 5.2706 5.2706 5.5352 5.5352 7.0616 7.0616 7.0668 7.0668 7.0879 7.0879 8.8989 8.8989 8.9343 8.9343 9.8526 9.8526 9.8989 9.8989 9.9253 9.9253 11.7046 11.7046 11.7370 11.7370 k = 0.5000 0.5000 0.4179 ( 12556 PWs) bands (ev): -67.2293 -67.2293 -38.6592 -38.6592 -28.9347 -28.9347 -28.8737 -28.8737 -22.7379 -22.7379 -22.6928 -22.6928 -22.6862 -22.6862 -20.5084 -20.5084 -20.4673 -20.4673 -20.4506 -20.4506 -20.4492 -20.4492 -5.3133 -5.3133 -5.2509 -5.2509 -5.1666 -5.1666 -5.0998 -5.0998 2.1636 2.1636 2.1973 2.1973 2.2436 2.2436 3.2038 3.2038 3.2831 3.2831 3.6212 3.6212 3.6928 3.6928 3.7308 3.7308 4.0247 4.0247 4.1216 4.1216 4.2228 4.2228 4.3764 4.3764 4.8490 4.8490 4.9525 4.9525 5.0030 5.0030 5.1144 5.1144 5.1921 5.1921 5.2710 5.2710 5.5356 5.5356 7.0677 7.0677 7.0883 7.0883 7.1070 7.1070 8.9052 8.9052 8.9412 8.9412 9.8733 9.8733 9.8992 9.8992 9.9339 9.9339 11.6789 11.6789 11.7128 11.7128 k = 0.5000 0.5000 0.4346 ( 12596 PWs) bands (ev): -67.2293 -67.2293 -38.6592 -38.6592 -28.9347 -28.9347 -28.8737 -28.8737 -22.7379 -22.7379 -22.6928 -22.6928 -22.6862 -22.6862 -20.5084 -20.5084 -20.4673 -20.4673 -20.4506 -20.4506 -20.4492 -20.4492 -5.3106 -5.3106 -5.2506 -5.2506 -5.1661 -5.1661 -5.1006 -5.1006 2.1559 2.1559 2.1835 2.1835 2.2366 2.2366 3.2022 3.2022 3.2790 3.2790 3.6209 3.6209 3.6973 3.6973 3.7305 3.7305 4.0380 4.0380 4.1223 4.1223 4.2232 4.2232 4.3769 4.3769 4.8463 4.8463 4.9534 4.9534 5.0002 5.0002 5.1124 5.1124 5.1906 5.1906 5.2713 5.2713 5.5358 5.5358 7.0709 7.0709 7.1077 7.1077 7.1251 7.1251 8.9083 8.9083 8.9495 8.9495 9.8847 9.8847 9.8995 9.8995 9.9479 9.9479 11.6569 11.6569 11.6922 11.6922 k = 0.5000 0.5000 0.4514 ( 12588 PWs) bands (ev): -67.2293 -67.2293 -38.6592 -38.6592 -28.9347 -28.9347 -28.8737 -28.8737 -22.7379 -22.7379 -22.6928 -22.6928 -22.6862 -22.6862 -20.5084 -20.5084 -20.4673 -20.4673 -20.4506 -20.4506 -20.4492 -20.4492 -5.3083 -5.3083 -5.2504 -5.2504 -5.1658 -5.1658 -5.1012 -5.1012 2.1497 2.1497 2.1720 2.1720 2.2308 2.2308 3.2007 3.2007 3.2758 3.2758 3.6207 3.6207 3.7014 3.7014 3.7300 3.7300 4.0490 4.0490 4.1229 4.1229 4.2235 4.2235 4.3773 4.3773 4.8441 4.8441 4.9542 4.9542 4.9978 4.9978 5.1107 5.1107 5.1894 5.1894 5.2716 5.2716 5.5360 5.5360 7.0732 7.0732 7.1239 7.1239 7.1406 7.1406 8.9097 8.9097 8.9577 8.9577 9.8894 9.8894 9.8999 9.8999 9.9641 9.9641 11.6387 11.6387 11.6753 11.6753 k = 0.5000 0.5000 0.4681 ( 12588 PWs) bands (ev): -67.2293 -67.2293 -38.6592 -38.6592 -28.9347 -28.9347 -28.8737 -28.8737 -22.7379 -22.7379 -22.6928 -22.6928 -22.6862 -22.6862 -20.5084 -20.5084 -20.4673 -20.4673 -20.4506 -20.4506 -20.4492 -20.4492 -5.3064 -5.3064 -5.2503 -5.2503 -5.1655 -5.1655 -5.1017 -5.1017 2.1451 2.1451 2.1629 2.1629 2.2262 2.2262 3.1993 3.1993 3.2735 3.2735 3.6204 3.6204 3.7049 3.7049 3.7293 3.7293 4.0576 4.0576 4.1235 4.1235 4.2238 4.2238 4.3775 4.3775 4.8423 4.8423 4.9548 4.9548 4.9960 4.9960 5.1093 5.1093 5.1885 5.1885 5.2718 5.2718 5.5362 5.5362 7.0749 7.0749 7.1369 7.1369 7.1531 7.1531 8.9103 8.9103 8.9647 8.9647 9.8910 9.8910 9.9001 9.9001 9.9790 9.9790 11.6245 11.6245 11.6620 11.6620 k = 0.5000 0.5000 0.4848 ( 12588 PWs) bands (ev): -67.2293 -67.2293 -38.6592 -38.6592 -28.9347 -28.9347 -28.8737 -28.8737 -22.7379 -22.7379 -22.6928 -22.6928 -22.6862 -22.6862 -20.5084 -20.5084 -20.4673 -20.4673 -20.4506 -20.4506 -20.4492 -20.4492 -5.3051 -5.3051 -5.2502 -5.2502 -5.1653 -5.1653 -5.1021 -5.1021 2.1419 2.1419 2.1560 2.1560 2.2229 2.2229 3.1983 3.1983 3.2718 3.2718 3.6202 3.6202 3.7076 3.7076 3.7286 3.7286 4.0637 4.0637 4.1239 4.1239 4.2239 4.2239 4.3777 4.3777 4.8411 4.8411 4.9552 4.9552 4.9947 4.9947 5.1083 5.1083 5.1878 5.1878 5.2720 5.2720 5.5363 5.5363 7.0760 7.0760 7.1463 7.1463 7.1621 7.1621 8.9105 8.9105 8.9699 8.9699 9.8914 9.8914 9.9002 9.9002 9.9906 9.9906 11.6143 11.6143 11.6525 11.6525 k = 0.5000 0.5000 0.5015 ( 12588 PWs) bands (ev): -67.2293 -67.2293 -38.6592 -38.6592 -28.9347 -28.9347 -28.8737 -28.8737 -22.7379 -22.7379 -22.6928 -22.6928 -22.6862 -22.6862 -20.5084 -20.5084 -20.4673 -20.4673 -20.4506 -20.4506 -20.4492 -20.4492 -5.3043 -5.3043 -5.2502 -5.2502 -5.1652 -5.1652 -5.1023 -5.1023 2.1402 2.1402 2.1518 2.1518 2.2209 2.2209 3.1976 3.1976 3.2709 3.2709 3.6201 3.6201 3.7095 3.7095 3.7280 3.7280 4.0674 4.0674 4.1242 4.1242 4.2240 4.2240 4.3778 4.3778 4.8403 4.8403 4.9555 4.9555 4.9940 4.9940 5.1077 5.1077 5.1874 5.1874 5.2721 5.2721 5.5364 5.5364 7.0767 7.0767 7.1519 7.1519 7.1676 7.1676 8.9106 8.9106 8.9732 8.9732 9.8914 9.8914 9.9002 9.9002 9.9978 9.9978 11.6082 11.6082 11.6468 11.6468 k = 0.5000 0.5000 0.5182 ( 12608 PWs) bands (ev): -67.2293 -67.2293 -38.6592 -38.6592 -28.9347 -28.9347 -28.8737 -28.8737 -22.7379 -22.7379 -22.6928 -22.6928 -22.6862 -22.6862 -20.5084 -20.5084 -20.4673 -20.4673 -20.4506 -20.4506 -20.4492 -20.4492 -5.3040 -5.3040 -5.2502 -5.2502 -5.1652 -5.1652 -5.1024 -5.1024 2.1397 2.1397 2.1503 2.1503 2.2203 2.2203 3.1974 3.1974 3.2706 3.2706 3.6201 3.6201 3.7101 3.7101 3.7278 3.7278 4.0687 4.0687 4.1243 4.1243 4.2240 4.2240 4.3778 4.3778 4.8401 4.8401 4.9556 4.9556 4.9937 4.9937 5.1075 5.1075 5.1873 5.1873 5.2721 5.2721 5.5364 5.5364 7.0770 7.0770 7.1538 7.1538 7.1695 7.1695 8.9106 8.9106 8.9743 8.9743 9.8914 9.8914 9.9002 9.9002 10.0003 10.0003 11.6061 11.6061 11.6449 11.6449 Writing output data file Cu2WS4.save init_run : 1.61s CPU 0.90s WALL ( 1 calls) electrons : 716.71s CPU 608.29s WALL ( 1 calls) Called by init_run: wfcinit : 0.00s CPU 0.00s WALL ( 1 calls) potinit : 0.07s CPU 0.05s WALL ( 1 calls) Called by electrons: c_bands : 716.70s CPU 608.27s WALL ( 1 calls) v_of_rho : 0.01s CPU 0.01s WALL ( 1 calls) v_h : 0.00s CPU 0.00s WALL ( 1 calls) v_xc : 0.01s CPU 0.01s WALL ( 1 calls) newd : 0.77s CPU 0.41s WALL ( 1 calls) Called by c_bands: init_us_2 : 0.46s CPU 0.61s WALL ( 300 calls) cegterg : 617.81s CPU 552.52s WALL ( 445 calls) Called by sum_band: Called by *egterg: h_psi : 440.74s CPU 344.84s WALL ( 7680 calls) s_psi : 24.22s CPU 21.08s WALL ( 7680 calls) g_psi : 0.73s CPU 0.66s WALL ( 6935 calls) cdiaghg : 162.39s CPU 159.10s WALL ( 7235 calls) cegterg:over : 29.56s CPU 29.42s WALL ( 6935 calls) cegterg:upda : 19.95s CPU 20.11s WALL ( 6935 calls) cegterg:last : 13.97s CPU 13.93s WALL ( 1345 calls) cdiaghg:chol : 6.88s CPU 7.04s WALL ( 7235 calls) cdiaghg:inve : 4.83s CPU 4.97s WALL ( 7235 calls) cdiaghg:para : 9.75s CPU 9.66s WALL ( 14470 calls) Called by h_psi: h_psi:vloc : 377.18s CPU 289.35s WALL ( 7680 calls) h_psi:vnl : 62.78s CPU 54.76s WALL ( 7680 calls) add_vuspsi : 36.77s CPU 31.55s WALL ( 7680 calls) General routines calbec : 25.95s CPU 23.19s WALL ( 7680 calls) fft : 0.10s CPU 0.06s WALL ( 15 calls) fftw : 367.54s CPU 281.12s WALL ( 1427200 calls) davcio : 0.58s CPU 2.00s WALL ( 600 calls) Parallel routines fft_scatter : 206.06s CPU 183.25s WALL ( 1427215 calls) PWSCF : 13m 5.35s CPU 11m38.74s WALL This run was terminated on: 20:43:24 10Apr2017 =------------------------------------------------------------------------------= JOB DONE. =------------------------------------------------------------------------------=