Program PWSCF v.5.4.0 starts on 12Feb2017 at 3: 1:29 This program is part of the open-source Quantum ESPRESSO suite for quantum simulation of materials; please cite "P. Giannozzi et al., J. Phys.:Condens. Matter 21 395502 (2009); URL http://www.quantum-espresso.org", in publications or presentations arising from this work. More details at http://www.quantum-espresso.org/quote Parallel version (MPI & OpenMP), running on 72 processor cores Number of MPI processes: 36 Threads/MPI process: 2 R & G space division: proc/nbgrp/npool/nimage = 36 Waiting for input... Reading input from standard input Current dimensions of program PWSCF are: Max number of different atomic species (ntypx) = 10 Max number of k-points (npk) = 40000 Max angular momentum in pseudopotentials (lmaxx) = 3 Atomic positions and unit cell read from directory: ./Ti2CuSb3.save/ file Sb.rel-pbe-n-rrkjus_psl.1.0.0.UPF: wavefunction(s) 5S renormalized file Cu.rel-pbe-dn-rrkjus_psl.1.0.0.UPF: wavefunction(s) 3D renormalized Subspace diagonalization in iterative solution of the eigenvalue problem: one sub-group per band group will be used scalapack distributed-memory algorithm (size of sub-group: 4* 4 procs) Parallelization info -------------------- sticks: dense smooth PW G-vecs: dense smooth PW Min 39 39 11 2409 2409 367 Max 40 40 12 2415 2415 374 Sum 1405 1405 401 86817 86817 13345 bravais-lattice index = 14 lattice parameter (alat) = 7.4149 a.u. unit-cell volume = 898.1526 (a.u.)^3 number of atoms/cell = 6 number of atomic types = 3 number of electrons = 50.00 number of Kohn-Sham states= 60 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)= 7.414907 celldm(2)= 1.000000 celldm(3)= 2.203094 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 2.203094 ) 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 0.453907 ) PseudoPot. # 1 for Sb read from file: /users/gautes/Pseudo/Sb.rel-pbe-n-rrkjus_psl.1.0.0.UPF MD5 check sum: 6eab79124e5b154cf38452ae12125a85 Pseudo is Ultrasoft + core correction, Zval = 5.0 Generated using "atomic" code by A. Dal Corso v.5.0.2 svn rev. 9656 Using radial grid of 1243 points, 10 beta functions with: l(1) = 0 l(2) = 0 l(3) = 1 l(4) = 1 l(5) = 1 l(6) = 1 l(7) = 2 l(8) = 2 l(9) = 2 l(10) = 2 Q(r) pseudized with 0 coefficients PseudoPot. # 2 for Cu read from file: /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 PseudoPot. # 3 for Ti read from file: /users/gautes/Pseudo/Ti.rel-pbe-oncvpsp.UPF MD5 check sum: 490816c065db03488b8f3a1c39de4952 Pseudo is Norm-conserving, Zval = 12.0 Generated using ONCVPSP code by D. R. Hamann Using radial grid of 600 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 atomic species valence mass pseudopotential Sb 5.00 121.76000 Sb( 1.00) Cu 11.00 63.54600 Cu( 1.00) Ti 12.00 47.86700 Ti( 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 [1,1,0] cryst. s( 3) = ( 0 1 0 ) ( 1 0 0 ) ( 0 0 -1 ) cart. s( 3) = ( 0.0000000 1.0000000 -0.0000000 ) ( 1.0000000 -0.0000000 -0.0000000 ) ( 0.0000000 0.0000000 -1.0000000 ) isym = 4 180 deg rotation - cart. axis [1,-1,0] cryst. s( 4) = ( 0 -1 0 ) ( -1 0 0 ) ( 0 0 -1 ) cart. s( 4) = ( -0.0000000 -1.0000000 0.0000000 ) ( -1.0000000 0.0000000 -0.0000000 ) ( 0.0000000 0.0000000 -1.0000000 ) isym = 5 inv. 180 deg rotation - cart. axis [0,1,0] cryst. s( 5) = ( 1 0 0 ) ( 0 -1 0 ) ( 0 0 1 ) cart. s( 5) = ( 1.0000000 -0.0000000 0.0000000 ) ( 0.0000000 -1.0000000 0.0000000 ) ( 0.0000000 0.0000000 1.0000000 ) isym = 6 inv. 180 deg rotation - cart. axis [1,0,0] cryst. s( 6) = ( -1 0 0 ) ( 0 1 0 ) ( 0 0 1 ) cart. s( 6) = ( -1.0000000 0.0000000 0.0000000 ) ( 0.0000000 1.0000000 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 [1,1,0] 2s_d -2s_d 5 -5 6 -6 inv. 180 deg rotation - cart. axis [0,1,0] Cartesian axes number of k points= 344 Fermi-Dirac smearing, width (Ry)= 0.0010 cart. coord. in units 2pi/alat k( 1) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0029070 k( 2) = ( 0.0000000 0.0121951 -0.0000000), wk = 0.0029070 k( 3) = ( 0.0000000 0.0243902 -0.0000000), wk = 0.0029070 k( 4) = ( 0.0000000 0.0365854 -0.0000000), wk = 0.0029070 k( 5) = ( 0.0000000 0.0487805 -0.0000000), wk = 0.0029070 k( 6) = ( 0.0000000 0.0609756 -0.0000000), wk = 0.0029070 k( 7) = ( 0.0000000 0.0731707 -0.0000000), wk = 0.0029070 k( 8) = ( 0.0000000 0.0853658 -0.0000000), wk = 0.0029070 k( 9) = ( 0.0000000 0.0975610 -0.0000000), wk = 0.0029070 k( 10) = ( 0.0000000 0.1097561 -0.0000000), wk = 0.0029070 k( 11) = ( 0.0000000 0.1219512 -0.0000000), wk = 0.0029070 k( 12) = ( 0.0000000 0.1341463 -0.0000000), wk = 0.0029070 k( 13) = ( 0.0000000 0.1463415 -0.0000000), wk = 0.0029070 k( 14) = ( 0.0000000 0.1585366 -0.0000000), wk = 0.0029070 k( 15) = ( 0.0000000 0.1707317 -0.0000000), wk = 0.0029070 k( 16) = ( 0.0000000 0.1829268 -0.0000000), wk = 0.0029070 k( 17) = ( 0.0000000 0.1951219 -0.0000000), wk = 0.0029070 k( 18) = ( 0.0000000 0.2073171 -0.0000000), wk = 0.0029070 k( 19) = ( 0.0000000 0.2195122 -0.0000000), wk = 0.0029070 k( 20) = ( 0.0000000 0.2317073 -0.0000000), wk = 0.0029070 k( 21) = ( 0.0000000 0.2439024 -0.0000000), wk = 0.0029070 k( 22) = ( 0.0000000 0.2560976 -0.0000000), wk = 0.0029070 k( 23) = ( 0.0000000 0.2682927 -0.0000000), wk = 0.0029070 k( 24) = ( 0.0000000 0.2804878 -0.0000000), wk = 0.0029070 k( 25) = ( 0.0000000 0.2926829 -0.0000000), wk = 0.0029070 k( 26) = ( 0.0000000 0.3048781 -0.0000000), wk = 0.0029070 k( 27) = ( 0.0000000 0.3170732 -0.0000000), wk = 0.0029070 k( 28) = ( 0.0000000 0.3292683 -0.0000000), wk = 0.0029070 k( 29) = ( 0.0000000 0.3414634 -0.0000000), wk = 0.0029070 k( 30) = ( 0.0000000 0.3536585 -0.0000000), wk = 0.0029070 k( 31) = ( 0.0000000 0.3658537 -0.0000000), wk = 0.0029070 k( 32) = ( 0.0000000 0.3780488 -0.0000000), wk = 0.0029070 k( 33) = ( 0.0000000 0.3902439 -0.0000000), wk = 0.0029070 k( 34) = ( 0.0000000 0.4024390 -0.0000000), wk = 0.0029070 k( 35) = ( 0.0000000 0.4146341 -0.0000000), wk = 0.0029070 k( 36) = ( 0.0000000 0.4268293 -0.0000000), wk = 0.0029070 k( 37) = ( 0.0000000 0.4390244 -0.0000000), wk = 0.0029070 k( 38) = ( 0.0000000 0.4512195 -0.0000000), wk = 0.0029070 k( 39) = ( 0.0000000 0.4634146 -0.0000000), wk = 0.0029070 k( 40) = ( 0.0000000 0.4756098 -0.0000000), wk = 0.0029070 k( 41) = ( 0.0000000 0.4878049 -0.0000000), wk = 0.0029070 k( 42) = ( 0.0000000 0.5000000 -0.0000000), wk = 0.0029070 k( 43) = ( 0.0000000 0.5000000 -0.0000000), wk = 0.0029070 k( 44) = ( 0.0121951 0.5000000 -0.0000000), wk = 0.0029070 k( 45) = ( 0.0243902 0.5000000 -0.0000000), wk = 0.0029070 k( 46) = ( 0.0365854 0.5000000 -0.0000000), wk = 0.0029070 k( 47) = ( 0.0487805 0.5000000 -0.0000000), wk = 0.0029070 k( 48) = ( 0.0609756 0.5000000 -0.0000000), wk = 0.0029070 k( 49) = ( 0.0731707 0.5000000 -0.0000000), wk = 0.0029070 k( 50) = ( 0.0853658 0.5000000 -0.0000000), wk = 0.0029070 k( 51) = ( 0.0975610 0.5000000 -0.0000000), wk = 0.0029070 k( 52) = ( 0.1097561 0.5000000 -0.0000000), wk = 0.0029070 k( 53) = ( 0.1219512 0.5000000 -0.0000000), wk = 0.0029070 k( 54) = ( 0.1341463 0.5000000 -0.0000000), wk = 0.0029070 k( 55) = ( 0.1463415 0.5000000 -0.0000000), wk = 0.0029070 k( 56) = ( 0.1585366 0.5000000 -0.0000000), wk = 0.0029070 k( 57) = ( 0.1707317 0.5000000 -0.0000000), wk = 0.0029070 k( 58) = ( 0.1829268 0.5000000 -0.0000000), wk = 0.0029070 k( 59) = ( 0.1951219 0.5000000 -0.0000000), wk = 0.0029070 k( 60) = ( 0.2073171 0.5000000 -0.0000000), wk = 0.0029070 k( 61) = ( 0.2195122 0.5000000 -0.0000000), wk = 0.0029070 k( 62) = ( 0.2317073 0.5000000 -0.0000000), wk = 0.0029070 k( 63) = ( 0.2439024 0.5000000 -0.0000000), wk = 0.0029070 k( 64) = ( 0.2560976 0.5000000 -0.0000000), wk = 0.0029070 k( 65) = ( 0.2682927 0.5000000 -0.0000000), wk = 0.0029070 k( 66) = ( 0.2804878 0.5000000 -0.0000000), wk = 0.0029070 k( 67) = ( 0.2926829 0.5000000 -0.0000000), wk = 0.0029070 k( 68) = ( 0.3048781 0.5000000 -0.0000000), wk = 0.0029070 k( 69) = ( 0.3170732 0.5000000 -0.0000000), wk = 0.0029070 k( 70) = ( 0.3292683 0.5000000 -0.0000000), wk = 0.0029070 k( 71) = ( 0.3414634 0.5000000 -0.0000000), wk = 0.0029070 k( 72) = ( 0.3536585 0.5000000 -0.0000000), wk = 0.0029070 k( 73) = ( 0.3658537 0.5000000 -0.0000000), wk = 0.0029070 k( 74) = ( 0.3780488 0.5000000 -0.0000000), wk = 0.0029070 k( 75) = ( 0.3902439 0.5000000 -0.0000000), wk = 0.0029070 k( 76) = ( 0.4024390 0.5000000 -0.0000000), wk = 0.0029070 k( 77) = ( 0.4146341 0.5000000 -0.0000000), wk = 0.0029070 k( 78) = ( 0.4268293 0.5000000 -0.0000000), wk = 0.0029070 k( 79) = ( 0.4390244 0.5000000 -0.0000000), wk = 0.0029070 k( 80) = ( 0.4512195 0.5000000 -0.0000000), wk = 0.0029070 k( 81) = ( 0.4634146 0.5000000 -0.0000000), wk = 0.0029070 k( 82) = ( 0.4756098 0.5000000 -0.0000000), wk = 0.0029070 k( 83) = ( 0.4878049 0.5000000 -0.0000000), wk = 0.0029070 k( 84) = ( 0.5000000 0.5000000 -0.0000000), wk = 0.0029070 k( 85) = ( 0.5000000 0.5000000 -0.0000000), wk = 0.0029070 k( 86) = ( 0.4912281 0.4912281 -0.0000000), wk = 0.0029070 k( 87) = ( 0.4824561 0.4824561 -0.0000000), wk = 0.0029070 k( 88) = ( 0.4736842 0.4736842 -0.0000000), wk = 0.0029070 k( 89) = ( 0.4649123 0.4649123 -0.0000000), wk = 0.0029070 k( 90) = ( 0.4561404 0.4561403 -0.0000000), wk = 0.0029070 k( 91) = ( 0.4473684 0.4473684 -0.0000000), wk = 0.0029070 k( 92) = ( 0.4385965 0.4385965 -0.0000000), wk = 0.0029070 k( 93) = ( 0.4298246 0.4298246 -0.0000000), wk = 0.0029070 k( 94) = ( 0.4210526 0.4210526 -0.0000000), wk = 0.0029070 k( 95) = ( 0.4122807 0.4122807 -0.0000000), wk = 0.0029070 k( 96) = ( 0.4035088 0.4035088 -0.0000000), wk = 0.0029070 k( 97) = ( 0.3947368 0.3947368 -0.0000000), wk = 0.0029070 k( 98) = ( 0.3859649 0.3859649 -0.0000000), wk = 0.0029070 k( 99) = ( 0.3771930 0.3771930 -0.0000000), wk = 0.0029070 k( 100) = ( 0.3684211 0.3684210 -0.0000000), wk = 0.0029070 k( 101) = ( 0.3596491 0.3596491 -0.0000000), wk = 0.0029070 k( 102) = ( 0.3508772 0.3508772 -0.0000000), wk = 0.0029070 k( 103) = ( 0.3421053 0.3421053 -0.0000000), wk = 0.0029070 k( 104) = ( 0.3333333 0.3333333 -0.0000000), wk = 0.0029070 k( 105) = ( 0.3245614 0.3245614 -0.0000000), wk = 0.0029070 k( 106) = ( 0.3157895 0.3157895 -0.0000000), wk = 0.0029070 k( 107) = ( 0.3070175 0.3070175 -0.0000000), wk = 0.0029070 k( 108) = ( 0.2982456 0.2982456 -0.0000000), wk = 0.0029070 k( 109) = ( 0.2894737 0.2894737 -0.0000000), wk = 0.0029070 k( 110) = ( 0.2807018 0.2807017 -0.0000000), wk = 0.0029070 k( 111) = ( 0.2719298 0.2719298 -0.0000000), wk = 0.0029070 k( 112) = ( 0.2631579 0.2631579 -0.0000000), wk = 0.0029070 k( 113) = ( 0.2543860 0.2543860 -0.0000000), wk = 0.0029070 k( 114) = ( 0.2456140 0.2456140 -0.0000000), wk = 0.0029070 k( 115) = ( 0.2368421 0.2368421 -0.0000000), wk = 0.0029070 k( 116) = ( 0.2280702 0.2280702 -0.0000000), wk = 0.0029070 k( 117) = ( 0.2192983 0.2192982 -0.0000000), wk = 0.0029070 k( 118) = ( 0.2105263 0.2105263 -0.0000000), wk = 0.0029070 k( 119) = ( 0.2017544 0.2017544 -0.0000000), wk = 0.0029070 k( 120) = ( 0.1929825 0.1929825 -0.0000000), wk = 0.0029070 k( 121) = ( 0.1842105 0.1842105 -0.0000000), wk = 0.0029070 k( 122) = ( 0.1754386 0.1754386 -0.0000000), wk = 0.0029070 k( 123) = ( 0.1666667 0.1666667 -0.0000000), wk = 0.0029070 k( 124) = ( 0.1578947 0.1578947 -0.0000000), wk = 0.0029070 k( 125) = ( 0.1491228 0.1491228 -0.0000000), wk = 0.0029070 k( 126) = ( 0.1403509 0.1403509 -0.0000000), wk = 0.0029070 k( 127) = ( 0.1315790 0.1315790 -0.0000000), wk = 0.0029070 k( 128) = ( 0.1228070 0.1228070 -0.0000000), wk = 0.0029070 k( 129) = ( 0.1140351 0.1140351 -0.0000000), wk = 0.0029070 k( 130) = ( 0.1052632 0.1052632 -0.0000000), wk = 0.0029070 k( 131) = ( 0.0964912 0.0964912 -0.0000000), wk = 0.0029070 k( 132) = ( 0.0877193 0.0877193 -0.0000000), wk = 0.0029070 k( 133) = ( 0.0789474 0.0789474 -0.0000000), wk = 0.0029070 k( 134) = ( 0.0701754 0.0701754 -0.0000000), wk = 0.0029070 k( 135) = ( 0.0614035 0.0614035 -0.0000000), wk = 0.0029070 k( 136) = ( 0.0526316 0.0526316 -0.0000000), wk = 0.0029070 k( 137) = ( 0.0438597 0.0438596 -0.0000000), wk = 0.0029070 k( 138) = ( 0.0350877 0.0350877 -0.0000000), wk = 0.0029070 k( 139) = ( 0.0263158 0.0263158 -0.0000000), wk = 0.0029070 k( 140) = ( 0.0175439 0.0175439 -0.0000000), wk = 0.0029070 k( 141) = ( 0.0087719 0.0087719 -0.0000000), wk = 0.0029070 k( 142) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0029070 k( 143) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0029070 k( 144) = ( 0.0000000 0.0000000 0.0119449), wk = 0.0029070 k( 145) = ( 0.0000000 0.0000000 0.0238898), wk = 0.0029070 k( 146) = ( 0.0000000 0.0000000 0.0358348), wk = 0.0029070 k( 147) = ( 0.0000000 0.0000000 0.0477797), wk = 0.0029070 k( 148) = ( 0.0000000 0.0000000 0.0597246), wk = 0.0029070 k( 149) = ( 0.0000000 0.0000000 0.0716695), wk = 0.0029070 k( 150) = ( 0.0000000 0.0000000 0.0836145), wk = 0.0029070 k( 151) = ( 0.0000000 0.0000000 0.0955594), wk = 0.0029070 k( 152) = ( 0.0000000 0.0000000 0.1075043), wk = 0.0029070 k( 153) = ( 0.0000000 0.0000000 0.1194492), wk = 0.0029070 k( 154) = ( 0.0000000 0.0000000 0.1313942), wk = 0.0029070 k( 155) = ( 0.0000000 0.0000000 0.1433391), wk = 0.0029070 k( 156) = ( 0.0000000 0.0000000 0.1552840), wk = 0.0029070 k( 157) = ( 0.0000000 0.0000000 0.1672289), wk = 0.0029070 k( 158) = ( 0.0000000 0.0000000 0.1791739), wk = 0.0029070 k( 159) = ( 0.0000000 0.0000000 0.1911188), wk = 0.0029070 k( 160) = ( 0.0000000 0.0000000 0.2030637), wk = 0.0029070 k( 161) = ( 0.0000000 0.0000000 0.2150086), wk = 0.0029070 k( 162) = ( 0.0000000 0.0000000 0.2269536), wk = 0.0029070 k( 163) = ( 0.0000000 0.0000000 0.2269536), wk = 0.0029070 k( 164) = ( 0.0000000 0.0121951 0.2269536), wk = 0.0029070 k( 165) = ( 0.0000000 0.0243902 0.2269536), wk = 0.0029070 k( 166) = ( 0.0000000 0.0365854 0.2269536), wk = 0.0029070 k( 167) = ( 0.0000000 0.0487805 0.2269536), wk = 0.0029070 k( 168) = ( 0.0000000 0.0609756 0.2269536), wk = 0.0029070 k( 169) = ( 0.0000000 0.0731707 0.2269536), wk = 0.0029070 k( 170) = ( 0.0000000 0.0853658 0.2269536), wk = 0.0029070 k( 171) = ( 0.0000000 0.0975610 0.2269536), wk = 0.0029070 k( 172) = ( 0.0000000 0.1097561 0.2269536), wk = 0.0029070 k( 173) = ( 0.0000000 0.1219512 0.2269536), wk = 0.0029070 k( 174) = ( 0.0000000 0.1341463 0.2269536), wk = 0.0029070 k( 175) = ( 0.0000000 0.1463415 0.2269536), wk = 0.0029070 k( 176) = ( 0.0000000 0.1585366 0.2269536), wk = 0.0029070 k( 177) = ( 0.0000000 0.1707317 0.2269536), wk = 0.0029070 k( 178) = ( 0.0000000 0.1829268 0.2269536), wk = 0.0029070 k( 179) = ( 0.0000000 0.1951219 0.2269536), wk = 0.0029070 k( 180) = ( 0.0000000 0.2073171 0.2269536), wk = 0.0029070 k( 181) = ( 0.0000000 0.2195122 0.2269536), wk = 0.0029070 k( 182) = ( 0.0000000 0.2317073 0.2269536), wk = 0.0029070 k( 183) = ( 0.0000000 0.2439024 0.2269536), wk = 0.0029070 k( 184) = ( 0.0000000 0.2560976 0.2269536), wk = 0.0029070 k( 185) = ( 0.0000000 0.2682927 0.2269536), wk = 0.0029070 k( 186) = ( 0.0000000 0.2804878 0.2269536), wk = 0.0029070 k( 187) = ( 0.0000000 0.2926829 0.2269536), wk = 0.0029070 k( 188) = ( 0.0000000 0.3048781 0.2269536), wk = 0.0029070 k( 189) = ( 0.0000000 0.3170732 0.2269536), wk = 0.0029070 k( 190) = ( 0.0000000 0.3292683 0.2269536), wk = 0.0029070 k( 191) = ( 0.0000000 0.3414634 0.2269536), wk = 0.0029070 k( 192) = ( 0.0000000 0.3536585 0.2269536), wk = 0.0029070 k( 193) = ( 0.0000000 0.3658537 0.2269536), wk = 0.0029070 k( 194) = ( 0.0000000 0.3780488 0.2269536), wk = 0.0029070 k( 195) = ( 0.0000000 0.3902439 0.2269536), wk = 0.0029070 k( 196) = ( 0.0000000 0.4024390 0.2269536), wk = 0.0029070 k( 197) = ( 0.0000000 0.4146341 0.2269536), wk = 0.0029070 k( 198) = ( 0.0000000 0.4268293 0.2269536), wk = 0.0029070 k( 199) = ( 0.0000000 0.4390244 0.2269536), wk = 0.0029070 k( 200) = ( 0.0000000 0.4512195 0.2269536), wk = 0.0029070 k( 201) = ( 0.0000000 0.4634146 0.2269536), wk = 0.0029070 k( 202) = ( 0.0000000 0.4756098 0.2269536), wk = 0.0029070 k( 203) = ( 0.0000000 0.4878049 0.2269536), wk = 0.0029070 k( 204) = ( 0.0000000 0.5000000 0.2269536), wk = 0.0029070 k( 205) = ( 0.0000000 0.5000000 0.2269536), wk = 0.0029070 k( 206) = ( 0.0121951 0.5000000 0.2269536), wk = 0.0029070 k( 207) = ( 0.0243902 0.5000000 0.2269536), wk = 0.0029070 k( 208) = ( 0.0365854 0.5000000 0.2269536), wk = 0.0029070 k( 209) = ( 0.0487805 0.5000000 0.2269536), wk = 0.0029070 k( 210) = ( 0.0609756 0.5000000 0.2269536), wk = 0.0029070 k( 211) = ( 0.0731707 0.5000000 0.2269536), wk = 0.0029070 k( 212) = ( 0.0853658 0.5000000 0.2269536), wk = 0.0029070 k( 213) = ( 0.0975610 0.5000000 0.2269536), wk = 0.0029070 k( 214) = ( 0.1097561 0.5000000 0.2269536), wk = 0.0029070 k( 215) = ( 0.1219512 0.5000000 0.2269536), wk = 0.0029070 k( 216) = ( 0.1341463 0.5000000 0.2269536), wk = 0.0029070 k( 217) = ( 0.1463415 0.5000000 0.2269536), wk = 0.0029070 k( 218) = ( 0.1585366 0.5000000 0.2269536), wk = 0.0029070 k( 219) = ( 0.1707317 0.5000000 0.2269536), wk = 0.0029070 k( 220) = ( 0.1829268 0.5000000 0.2269536), wk = 0.0029070 k( 221) = ( 0.1951219 0.5000000 0.2269536), wk = 0.0029070 k( 222) = ( 0.2073171 0.5000000 0.2269536), wk = 0.0029070 k( 223) = ( 0.2195122 0.5000000 0.2269536), wk = 0.0029070 k( 224) = ( 0.2317073 0.5000000 0.2269536), wk = 0.0029070 k( 225) = ( 0.2439024 0.5000000 0.2269536), wk = 0.0029070 k( 226) = ( 0.2560976 0.5000000 0.2269536), wk = 0.0029070 k( 227) = ( 0.2682927 0.5000000 0.2269536), wk = 0.0029070 k( 228) = ( 0.2804878 0.5000000 0.2269536), wk = 0.0029070 k( 229) = ( 0.2926829 0.5000000 0.2269536), wk = 0.0029070 k( 230) = ( 0.3048781 0.5000000 0.2269536), wk = 0.0029070 k( 231) = ( 0.3170732 0.5000000 0.2269536), wk = 0.0029070 k( 232) = ( 0.3292683 0.5000000 0.2269536), wk = 0.0029070 k( 233) = ( 0.3414634 0.5000000 0.2269536), wk = 0.0029070 k( 234) = ( 0.3536585 0.5000000 0.2269536), wk = 0.0029070 k( 235) = ( 0.3658537 0.5000000 0.2269536), wk = 0.0029070 k( 236) = ( 0.3780488 0.5000000 0.2269536), wk = 0.0029070 k( 237) = ( 0.3902439 0.5000000 0.2269536), wk = 0.0029070 k( 238) = ( 0.4024390 0.5000000 0.2269536), wk = 0.0029070 k( 239) = ( 0.4146341 0.5000000 0.2269536), wk = 0.0029070 k( 240) = ( 0.4268293 0.5000000 0.2269536), wk = 0.0029070 k( 241) = ( 0.4390244 0.5000000 0.2269536), wk = 0.0029070 k( 242) = ( 0.4512195 0.5000000 0.2269536), wk = 0.0029070 k( 243) = ( 0.4634146 0.5000000 0.2269536), wk = 0.0029070 k( 244) = ( 0.4756098 0.5000000 0.2269536), wk = 0.0029070 k( 245) = ( 0.4878049 0.5000000 0.2269536), wk = 0.0029070 k( 246) = ( 0.5000000 0.5000000 0.2269536), wk = 0.0029070 k( 247) = ( 0.5000000 0.5000000 0.2269536), wk = 0.0029070 k( 248) = ( 0.4912281 0.4912281 0.2269536), wk = 0.0029070 k( 249) = ( 0.4824561 0.4824561 0.2269536), wk = 0.0029070 k( 250) = ( 0.4736842 0.4736842 0.2269536), wk = 0.0029070 k( 251) = ( 0.4649123 0.4649123 0.2269536), wk = 0.0029070 k( 252) = ( 0.4561404 0.4561403 0.2269536), wk = 0.0029070 k( 253) = ( 0.4473684 0.4473684 0.2269536), wk = 0.0029070 k( 254) = ( 0.4385965 0.4385965 0.2269536), wk = 0.0029070 k( 255) = ( 0.4298246 0.4298246 0.2269536), wk = 0.0029070 k( 256) = ( 0.4210526 0.4210526 0.2269536), wk = 0.0029070 k( 257) = ( 0.4122807 0.4122807 0.2269536), wk = 0.0029070 k( 258) = ( 0.4035088 0.4035088 0.2269536), wk = 0.0029070 k( 259) = ( 0.3947368 0.3947368 0.2269536), wk = 0.0029070 k( 260) = ( 0.3859649 0.3859649 0.2269536), wk = 0.0029070 k( 261) = ( 0.3771930 0.3771930 0.2269536), wk = 0.0029070 k( 262) = ( 0.3684211 0.3684210 0.2269536), wk = 0.0029070 k( 263) = ( 0.3596491 0.3596491 0.2269536), wk = 0.0029070 k( 264) = ( 0.3508772 0.3508772 0.2269536), wk = 0.0029070 k( 265) = ( 0.3421053 0.3421053 0.2269536), wk = 0.0029070 k( 266) = ( 0.3333333 0.3333333 0.2269536), wk = 0.0029070 k( 267) = ( 0.3245614 0.3245614 0.2269536), wk = 0.0029070 k( 268) = ( 0.3157895 0.3157895 0.2269536), wk = 0.0029070 k( 269) = ( 0.3070175 0.3070175 0.2269536), wk = 0.0029070 k( 270) = ( 0.2982456 0.2982456 0.2269536), wk = 0.0029070 k( 271) = ( 0.2894737 0.2894737 0.2269536), wk = 0.0029070 k( 272) = ( 0.2807018 0.2807017 0.2269536), wk = 0.0029070 k( 273) = ( 0.2719298 0.2719298 0.2269536), wk = 0.0029070 k( 274) = ( 0.2631579 0.2631579 0.2269536), wk = 0.0029070 k( 275) = ( 0.2543860 0.2543860 0.2269536), wk = 0.0029070 k( 276) = ( 0.2456140 0.2456140 0.2269536), wk = 0.0029070 k( 277) = ( 0.2368421 0.2368421 0.2269536), wk = 0.0029070 k( 278) = ( 0.2280702 0.2280702 0.2269536), wk = 0.0029070 k( 279) = ( 0.2192983 0.2192982 0.2269536), wk = 0.0029070 k( 280) = ( 0.2105263 0.2105263 0.2269536), wk = 0.0029070 k( 281) = ( 0.2017544 0.2017544 0.2269536), wk = 0.0029070 k( 282) = ( 0.1929825 0.1929825 0.2269536), wk = 0.0029070 k( 283) = ( 0.1842105 0.1842105 0.2269536), wk = 0.0029070 k( 284) = ( 0.1754386 0.1754386 0.2269536), wk = 0.0029070 k( 285) = ( 0.1666667 0.1666667 0.2269536), wk = 0.0029070 k( 286) = ( 0.1578947 0.1578947 0.2269536), wk = 0.0029070 k( 287) = ( 0.1491228 0.1491228 0.2269536), wk = 0.0029070 k( 288) = ( 0.1403509 0.1403509 0.2269536), wk = 0.0029070 k( 289) = ( 0.1315790 0.1315790 0.2269536), wk = 0.0029070 k( 290) = ( 0.1228070 0.1228070 0.2269536), wk = 0.0029070 k( 291) = ( 0.1140351 0.1140351 0.2269536), wk = 0.0029070 k( 292) = ( 0.1052632 0.1052632 0.2269536), wk = 0.0029070 k( 293) = ( 0.0964912 0.0964912 0.2269536), wk = 0.0029070 k( 294) = ( 0.0877193 0.0877193 0.2269536), wk = 0.0029070 k( 295) = ( 0.0789474 0.0789474 0.2269536), wk = 0.0029070 k( 296) = ( 0.0701754 0.0701754 0.2269536), wk = 0.0029070 k( 297) = ( 0.0614035 0.0614035 0.2269536), wk = 0.0029070 k( 298) = ( 0.0526316 0.0526316 0.2269536), wk = 0.0029070 k( 299) = ( 0.0438597 0.0438596 0.2269536), wk = 0.0029070 k( 300) = ( 0.0350877 0.0350877 0.2269536), wk = 0.0029070 k( 301) = ( 0.0263158 0.0263158 0.2269536), wk = 0.0029070 k( 302) = ( 0.0175439 0.0175439 0.2269536), wk = 0.0029070 k( 303) = ( 0.0087719 0.0087719 0.2269536), wk = 0.0029070 k( 304) = ( 0.0000000 0.0000000 0.2269536), wk = 0.0029070 k( 305) = ( 0.0000000 0.5000000 -0.0000000), wk = 0.0029070 k( 306) = ( 0.0000000 0.5000000 0.0119449), wk = 0.0029070 k( 307) = ( 0.0000000 0.5000000 0.0238898), wk = 0.0029070 k( 308) = ( 0.0000000 0.5000000 0.0358348), wk = 0.0029070 k( 309) = ( 0.0000000 0.5000000 0.0477797), wk = 0.0029070 k( 310) = ( 0.0000000 0.5000000 0.0597246), wk = 0.0029070 k( 311) = ( 0.0000000 0.5000000 0.0716695), wk = 0.0029070 k( 312) = ( 0.0000000 0.5000000 0.0836145), wk = 0.0029070 k( 313) = ( 0.0000000 0.5000000 0.0955594), wk = 0.0029070 k( 314) = ( 0.0000000 0.5000000 0.1075043), wk = 0.0029070 k( 315) = ( 0.0000000 0.5000000 0.1194492), wk = 0.0029070 k( 316) = ( 0.0000000 0.5000000 0.1313942), wk = 0.0029070 k( 317) = ( 0.0000000 0.5000000 0.1433391), wk = 0.0029070 k( 318) = ( 0.0000000 0.5000000 0.1552840), wk = 0.0029070 k( 319) = ( 0.0000000 0.5000000 0.1672289), wk = 0.0029070 k( 320) = ( 0.0000000 0.5000000 0.1791739), wk = 0.0029070 k( 321) = ( 0.0000000 0.5000000 0.1911188), wk = 0.0029070 k( 322) = ( 0.0000000 0.5000000 0.2030637), wk = 0.0029070 k( 323) = ( 0.0000000 0.5000000 0.2150086), wk = 0.0029070 k( 324) = ( 0.0000000 0.5000000 0.2269536), wk = 0.0029070 k( 325) = ( 0.5000000 0.5000000 -0.0000000), wk = 0.0029070 k( 326) = ( 0.5000000 0.5000000 0.0119449), wk = 0.0029070 k( 327) = ( 0.5000000 0.5000000 0.0238898), wk = 0.0029070 k( 328) = ( 0.5000000 0.5000000 0.0358348), wk = 0.0029070 k( 329) = ( 0.5000000 0.5000000 0.0477797), wk = 0.0029070 k( 330) = ( 0.5000000 0.5000000 0.0597246), wk = 0.0029070 k( 331) = ( 0.5000000 0.5000000 0.0716695), wk = 0.0029070 k( 332) = ( 0.5000000 0.5000000 0.0836145), wk = 0.0029070 k( 333) = ( 0.5000000 0.5000000 0.0955594), wk = 0.0029070 k( 334) = ( 0.5000000 0.5000000 0.1075043), wk = 0.0029070 k( 335) = ( 0.5000000 0.5000000 0.1194492), wk = 0.0029070 k( 336) = ( 0.5000000 0.5000000 0.1313942), wk = 0.0029070 k( 337) = ( 0.5000000 0.5000000 0.1433391), wk = 0.0029070 k( 338) = ( 0.5000000 0.5000000 0.1552840), wk = 0.0029070 k( 339) = ( 0.5000000 0.5000000 0.1672289), wk = 0.0029070 k( 340) = ( 0.5000000 0.5000000 0.1791739), wk = 0.0029070 k( 341) = ( 0.5000000 0.5000000 0.1911188), wk = 0.0029070 k( 342) = ( 0.5000000 0.5000000 0.2030637), wk = 0.0029070 k( 343) = ( 0.5000000 0.5000000 0.2150086), wk = 0.0029070 k( 344) = ( 0.5000000 0.5000000 0.2269536), wk = 0.0029070 cryst. coord. k( 1) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0029070 k( 2) = ( 0.0000000 0.0121951 0.0000000), wk = 0.0029070 k( 3) = ( 0.0000000 0.0243902 0.0000000), wk = 0.0029070 k( 4) = ( 0.0000000 0.0365854 0.0000000), wk = 0.0029070 k( 5) = ( 0.0000000 0.0487805 0.0000000), wk = 0.0029070 k( 6) = ( 0.0000000 0.0609756 0.0000000), wk = 0.0029070 k( 7) = ( 0.0000000 0.0731707 0.0000000), wk = 0.0029070 k( 8) = ( 0.0000000 0.0853658 0.0000000), wk = 0.0029070 k( 9) = ( 0.0000000 0.0975610 0.0000000), wk = 0.0029070 k( 10) = ( 0.0000000 0.1097561 -0.0000000), wk = 0.0029070 k( 11) = ( 0.0000000 0.1219512 0.0000000), wk = 0.0029070 k( 12) = ( 0.0000000 0.1341463 -0.0000000), wk = 0.0029070 k( 13) = ( 0.0000000 0.1463415 0.0000000), wk = 0.0029070 k( 14) = ( 0.0000000 0.1585366 0.0000000), wk = 0.0029070 k( 15) = ( 0.0000000 0.1707317 -0.0000000), wk = 0.0029070 k( 16) = ( 0.0000000 0.1829268 0.0000000), wk = 0.0029070 k( 17) = ( 0.0000000 0.1951219 0.0000000), wk = 0.0029070 k( 18) = ( 0.0000000 0.2073171 -0.0000000), wk = 0.0029070 k( 19) = ( 0.0000000 0.2195122 -0.0000000), wk = 0.0029070 k( 20) = ( 0.0000000 0.2317073 -0.0000000), wk = 0.0029070 k( 21) = ( 0.0000000 0.2439024 0.0000000), wk = 0.0029070 k( 22) = ( 0.0000000 0.2560976 -0.0000000), wk = 0.0029070 k( 23) = ( 0.0000000 0.2682927 -0.0000000), wk = 0.0029070 k( 24) = ( 0.0000000 0.2804878 -0.0000000), wk = 0.0029070 k( 25) = ( 0.0000000 0.2926829 0.0000000), wk = 0.0029070 k( 26) = ( 0.0000000 0.3048781 0.0000000), wk = 0.0029070 k( 27) = ( 0.0000000 0.3170732 0.0000000), wk = 0.0029070 k( 28) = ( 0.0000000 0.3292683 -0.0000000), wk = 0.0029070 k( 29) = ( 0.0000000 0.3414634 -0.0000000), wk = 0.0029070 k( 30) = ( 0.0000000 0.3536585 0.0000000), wk = 0.0029070 k( 31) = ( 0.0000000 0.3658537 0.0000000), wk = 0.0029070 k( 32) = ( 0.0000000 0.3780488 0.0000000), wk = 0.0029070 k( 33) = ( 0.0000000 0.3902439 0.0000000), wk = 0.0029070 k( 34) = ( 0.0000000 0.4024390 0.0000000), wk = 0.0029070 k( 35) = ( 0.0000000 0.4146341 -0.0000000), wk = 0.0029070 k( 36) = ( 0.0000000 0.4268293 0.0000000), wk = 0.0029070 k( 37) = ( 0.0000000 0.4390244 0.0000000), wk = 0.0029070 k( 38) = ( 0.0000000 0.4512195 -0.0000000), wk = 0.0029070 k( 39) = ( 0.0000000 0.4634146 0.0000000), wk = 0.0029070 k( 40) = ( 0.0000000 0.4756098 -0.0000000), wk = 0.0029070 k( 41) = ( 0.0000000 0.4878049 0.0000000), wk = 0.0029070 k( 42) = ( 0.0000000 0.5000000 0.0000000), wk = 0.0029070 k( 43) = ( 0.0000000 0.5000000 0.0000000), wk = 0.0029070 k( 44) = ( 0.0121951 0.5000000 -0.0000000), wk = 0.0029070 k( 45) = ( 0.0243902 0.5000000 0.0000000), wk = 0.0029070 k( 46) = ( 0.0365854 0.5000000 0.0000000), wk = 0.0029070 k( 47) = ( 0.0487805 0.5000000 0.0000000), wk = 0.0029070 k( 48) = ( 0.0609756 0.5000000 -0.0000000), wk = 0.0029070 k( 49) = ( 0.0731707 0.5000000 -0.0000000), wk = 0.0029070 k( 50) = ( 0.0853658 0.5000000 0.0000000), wk = 0.0029070 k( 51) = ( 0.0975610 0.5000000 -0.0000000), wk = 0.0029070 k( 52) = ( 0.1097561 0.5000000 0.0000000), wk = 0.0029070 k( 53) = ( 0.1219512 0.5000000 0.0000000), wk = 0.0029070 k( 54) = ( 0.1341463 0.5000000 0.0000000), wk = 0.0029070 k( 55) = ( 0.1463415 0.5000000 0.0000000), wk = 0.0029070 k( 56) = ( 0.1585366 0.5000000 0.0000000), wk = 0.0029070 k( 57) = ( 0.1707317 0.5000000 0.0000000), wk = 0.0029070 k( 58) = ( 0.1829268 0.5000000 -0.0000000), wk = 0.0029070 k( 59) = ( 0.1951219 0.5000000 0.0000000), wk = 0.0029070 k( 60) = ( 0.2073171 0.5000000 0.0000000), wk = 0.0029070 k( 61) = ( 0.2195122 0.5000000 0.0000000), wk = 0.0029070 k( 62) = ( 0.2317073 0.5000000 0.0000000), wk = 0.0029070 k( 63) = ( 0.2439024 0.5000000 0.0000000), wk = 0.0029070 k( 64) = ( 0.2560976 0.5000000 0.0000000), wk = 0.0029070 k( 65) = ( 0.2682927 0.5000000 0.0000000), wk = 0.0029070 k( 66) = ( 0.2804878 0.5000000 -0.0000000), wk = 0.0029070 k( 67) = ( 0.2926829 0.5000000 -0.0000000), wk = 0.0029070 k( 68) = ( 0.3048781 0.5000000 -0.0000000), wk = 0.0029070 k( 69) = ( 0.3170732 0.5000000 0.0000000), wk = 0.0029070 k( 70) = ( 0.3292683 0.5000000 0.0000000), wk = 0.0029070 k( 71) = ( 0.3414634 0.5000000 -0.0000000), wk = 0.0029070 k( 72) = ( 0.3536585 0.5000000 0.0000000), wk = 0.0029070 k( 73) = ( 0.3658537 0.5000000 -0.0000000), wk = 0.0029070 k( 74) = ( 0.3780488 0.5000000 0.0000000), wk = 0.0029070 k( 75) = ( 0.3902439 0.5000000 0.0000000), wk = 0.0029070 k( 76) = ( 0.4024390 0.5000000 -0.0000000), wk = 0.0029070 k( 77) = ( 0.4146341 0.5000000 0.0000000), wk = 0.0029070 k( 78) = ( 0.4268293 0.5000000 -0.0000000), wk = 0.0029070 k( 79) = ( 0.4390244 0.5000000 0.0000000), wk = 0.0029070 k( 80) = ( 0.4512195 0.5000000 -0.0000000), wk = 0.0029070 k( 81) = ( 0.4634146 0.5000000 -0.0000000), wk = 0.0029070 k( 82) = ( 0.4756098 0.5000000 0.0000000), wk = 0.0029070 k( 83) = ( 0.4878049 0.5000000 -0.0000000), wk = 0.0029070 k( 84) = ( 0.5000000 0.5000000 0.0000000), wk = 0.0029070 k( 85) = ( 0.5000000 0.5000000 0.0000000), wk = 0.0029070 k( 86) = ( 0.4912281 0.4912281 0.0000000), wk = 0.0029070 k( 87) = ( 0.4824561 0.4824561 -0.0000000), wk = 0.0029070 k( 88) = ( 0.4736842 0.4736842 -0.0000000), wk = 0.0029070 k( 89) = ( 0.4649123 0.4649123 0.0000000), wk = 0.0029070 k( 90) = ( 0.4561404 0.4561404 0.0000000), wk = 0.0029070 k( 91) = ( 0.4473684 0.4473684 -0.0000000), wk = 0.0029070 k( 92) = ( 0.4385965 0.4385965 0.0000000), wk = 0.0029070 k( 93) = ( 0.4298246 0.4298246 -0.0000000), wk = 0.0029070 k( 94) = ( 0.4210526 0.4210526 -0.0000000), wk = 0.0029070 k( 95) = ( 0.4122807 0.4122807 0.0000000), wk = 0.0029070 k( 96) = ( 0.4035088 0.4035088 0.0000000), wk = 0.0029070 k( 97) = ( 0.3947368 0.3947368 -0.0000000), wk = 0.0029070 k( 98) = ( 0.3859649 0.3859649 0.0000000), wk = 0.0029070 k( 99) = ( 0.3771930 0.3771930 -0.0000000), wk = 0.0029070 k( 100) = ( 0.3684211 0.3684211 -0.0000000), wk = 0.0029070 k( 101) = ( 0.3596491 0.3596491 0.0000000), wk = 0.0029070 k( 102) = ( 0.3508772 0.3508772 -0.0000000), wk = 0.0029070 k( 103) = ( 0.3421053 0.3421053 -0.0000000), wk = 0.0029070 k( 104) = ( 0.3333333 0.3333333 0.0000000), wk = 0.0029070 k( 105) = ( 0.3245614 0.3245614 -0.0000000), wk = 0.0029070 k( 106) = ( 0.3157895 0.3157895 -0.0000000), wk = 0.0029070 k( 107) = ( 0.3070175 0.3070175 -0.0000000), wk = 0.0029070 k( 108) = ( 0.2982456 0.2982456 -0.0000000), wk = 0.0029070 k( 109) = ( 0.2894737 0.2894737 -0.0000000), wk = 0.0029070 k( 110) = ( 0.2807018 0.2807018 0.0000000), wk = 0.0029070 k( 111) = ( 0.2719298 0.2719298 -0.0000000), wk = 0.0029070 k( 112) = ( 0.2631579 0.2631579 0.0000000), wk = 0.0029070 k( 113) = ( 0.2543860 0.2543860 0.0000000), wk = 0.0029070 k( 114) = ( 0.2456140 0.2456140 0.0000000), wk = 0.0029070 k( 115) = ( 0.2368421 0.2368421 -0.0000000), wk = 0.0029070 k( 116) = ( 0.2280702 0.2280702 0.0000000), wk = 0.0029070 k( 117) = ( 0.2192983 0.2192983 0.0000000), wk = 0.0029070 k( 118) = ( 0.2105263 0.2105263 -0.0000000), wk = 0.0029070 k( 119) = ( 0.2017544 0.2017544 0.0000000), wk = 0.0029070 k( 120) = ( 0.1929825 0.1929825 -0.0000000), wk = 0.0029070 k( 121) = ( 0.1842105 0.1842105 -0.0000000), wk = 0.0029070 k( 122) = ( 0.1754386 0.1754386 0.0000000), wk = 0.0029070 k( 123) = ( 0.1666667 0.1666667 -0.0000000), wk = 0.0029070 k( 124) = ( 0.1578947 0.1578947 -0.0000000), wk = 0.0029070 k( 125) = ( 0.1491228 0.1491228 0.0000000), wk = 0.0029070 k( 126) = ( 0.1403509 0.1403509 -0.0000000), wk = 0.0029070 k( 127) = ( 0.1315790 0.1315790 -0.0000000), wk = 0.0029070 k( 128) = ( 0.1228070 0.1228070 0.0000000), wk = 0.0029070 k( 129) = ( 0.1140351 0.1140351 0.0000000), wk = 0.0029070 k( 130) = ( 0.1052632 0.1052632 -0.0000000), wk = 0.0029070 k( 131) = ( 0.0964912 0.0964912 -0.0000000), wk = 0.0029070 k( 132) = ( 0.0877193 0.0877193 0.0000000), wk = 0.0029070 k( 133) = ( 0.0789474 0.0789474 -0.0000000), wk = 0.0029070 k( 134) = ( 0.0701754 0.0701754 -0.0000000), wk = 0.0029070 k( 135) = ( 0.0614035 0.0614035 0.0000000), wk = 0.0029070 k( 136) = ( 0.0526316 0.0526316 -0.0000000), wk = 0.0029070 k( 137) = ( 0.0438597 0.0438597 0.0000000), wk = 0.0029070 k( 138) = ( 0.0350877 0.0350877 -0.0000000), wk = 0.0029070 k( 139) = ( 0.0263158 0.0263158 -0.0000000), wk = 0.0029070 k( 140) = ( 0.0175439 0.0175439 -0.0000000), wk = 0.0029070 k( 141) = ( 0.0087719 0.0087719 -0.0000000), wk = 0.0029070 k( 142) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0029070 k( 143) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0029070 k( 144) = ( 0.0000000 0.0000000 0.0263158), wk = 0.0029070 k( 145) = ( 0.0000000 0.0000000 0.0526316), wk = 0.0029070 k( 146) = ( 0.0000000 0.0000000 0.0789474), wk = 0.0029070 k( 147) = ( 0.0000000 0.0000000 0.1052632), wk = 0.0029070 k( 148) = ( 0.0000000 0.0000000 0.1315790), wk = 0.0029070 k( 149) = ( 0.0000000 0.0000000 0.1578947), wk = 0.0029070 k( 150) = ( 0.0000000 0.0000000 0.1842105), wk = 0.0029070 k( 151) = ( 0.0000000 0.0000000 0.2105263), wk = 0.0029070 k( 152) = ( 0.0000000 0.0000000 0.2368421), wk = 0.0029070 k( 153) = ( 0.0000000 0.0000000 0.2631579), wk = 0.0029070 k( 154) = ( 0.0000000 0.0000000 0.2894737), wk = 0.0029070 k( 155) = ( 0.0000000 0.0000000 0.3157895), wk = 0.0029070 k( 156) = ( 0.0000000 0.0000000 0.3421053), wk = 0.0029070 k( 157) = ( 0.0000000 0.0000000 0.3684210), wk = 0.0029070 k( 158) = ( 0.0000000 0.0000000 0.3947368), wk = 0.0029070 k( 159) = ( 0.0000000 0.0000000 0.4210526), wk = 0.0029070 k( 160) = ( 0.0000000 0.0000000 0.4473684), wk = 0.0029070 k( 161) = ( 0.0000000 0.0000000 0.4736842), wk = 0.0029070 k( 162) = ( 0.0000000 0.0000000 0.5000000), wk = 0.0029070 k( 163) = ( 0.0000000 0.0000000 0.5000000), wk = 0.0029070 k( 164) = ( 0.0000000 0.0121951 0.5000000), wk = 0.0029070 k( 165) = ( 0.0000000 0.0243902 0.5000000), wk = 0.0029070 k( 166) = ( 0.0000000 0.0365854 0.5000000), wk = 0.0029070 k( 167) = ( 0.0000000 0.0487805 0.5000000), wk = 0.0029070 k( 168) = ( 0.0000000 0.0609756 0.5000000), wk = 0.0029070 k( 169) = ( 0.0000000 0.0731707 0.5000000), wk = 0.0029070 k( 170) = ( 0.0000000 0.0853658 0.5000000), wk = 0.0029070 k( 171) = ( 0.0000000 0.0975610 0.5000000), wk = 0.0029070 k( 172) = ( 0.0000000 0.1097561 0.5000000), wk = 0.0029070 k( 173) = ( 0.0000000 0.1219512 0.5000000), wk = 0.0029070 k( 174) = ( 0.0000000 0.1341463 0.5000000), wk = 0.0029070 k( 175) = ( 0.0000000 0.1463415 0.5000000), wk = 0.0029070 k( 176) = ( 0.0000000 0.1585366 0.5000000), wk = 0.0029070 k( 177) = ( 0.0000000 0.1707317 0.5000000), wk = 0.0029070 k( 178) = ( 0.0000000 0.1829268 0.5000000), wk = 0.0029070 k( 179) = ( 0.0000000 0.1951219 0.5000000), wk = 0.0029070 k( 180) = ( 0.0000000 0.2073171 0.5000000), wk = 0.0029070 k( 181) = ( 0.0000000 0.2195122 0.5000000), wk = 0.0029070 k( 182) = ( 0.0000000 0.2317073 0.5000000), wk = 0.0029070 k( 183) = ( 0.0000000 0.2439024 0.5000000), wk = 0.0029070 k( 184) = ( 0.0000000 0.2560976 0.5000000), wk = 0.0029070 k( 185) = ( 0.0000000 0.2682927 0.5000000), wk = 0.0029070 k( 186) = ( 0.0000000 0.2804878 0.5000000), wk = 0.0029070 k( 187) = ( 0.0000000 0.2926829 0.5000000), wk = 0.0029070 k( 188) = ( 0.0000000 0.3048781 0.5000000), wk = 0.0029070 k( 189) = ( 0.0000000 0.3170732 0.5000000), wk = 0.0029070 k( 190) = ( 0.0000000 0.3292683 0.5000000), wk = 0.0029070 k( 191) = ( 0.0000000 0.3414634 0.5000000), wk = 0.0029070 k( 192) = ( 0.0000000 0.3536585 0.5000000), wk = 0.0029070 k( 193) = ( 0.0000000 0.3658537 0.5000000), wk = 0.0029070 k( 194) = ( 0.0000000 0.3780488 0.5000000), wk = 0.0029070 k( 195) = ( 0.0000000 0.3902439 0.5000000), wk = 0.0029070 k( 196) = ( 0.0000000 0.4024390 0.5000000), wk = 0.0029070 k( 197) = ( 0.0000000 0.4146341 0.5000000), wk = 0.0029070 k( 198) = ( 0.0000000 0.4268293 0.5000000), wk = 0.0029070 k( 199) = ( 0.0000000 0.4390244 0.5000000), wk = 0.0029070 k( 200) = ( 0.0000000 0.4512195 0.5000000), wk = 0.0029070 k( 201) = ( 0.0000000 0.4634146 0.5000000), wk = 0.0029070 k( 202) = ( 0.0000000 0.4756098 0.5000000), wk = 0.0029070 k( 203) = ( 0.0000000 0.4878049 0.5000000), wk = 0.0029070 k( 204) = ( 0.0000000 0.5000000 0.5000000), wk = 0.0029070 k( 205) = ( 0.0000000 0.5000000 0.5000000), wk = 0.0029070 k( 206) = ( 0.0121951 0.5000000 0.5000000), wk = 0.0029070 k( 207) = ( 0.0243902 0.5000000 0.5000000), wk = 0.0029070 k( 208) = ( 0.0365854 0.5000000 0.5000000), wk = 0.0029070 k( 209) = ( 0.0487805 0.5000000 0.5000000), wk = 0.0029070 k( 210) = ( 0.0609756 0.5000000 0.5000000), wk = 0.0029070 k( 211) = ( 0.0731707 0.5000000 0.5000000), wk = 0.0029070 k( 212) = ( 0.0853658 0.5000000 0.5000000), wk = 0.0029070 k( 213) = ( 0.0975610 0.5000000 0.5000000), wk = 0.0029070 k( 214) = ( 0.1097561 0.5000000 0.5000000), wk = 0.0029070 k( 215) = ( 0.1219512 0.5000000 0.5000000), wk = 0.0029070 k( 216) = ( 0.1341463 0.5000000 0.5000000), wk = 0.0029070 k( 217) = ( 0.1463415 0.5000000 0.5000000), wk = 0.0029070 k( 218) = ( 0.1585366 0.5000000 0.5000000), wk = 0.0029070 k( 219) = ( 0.1707317 0.5000000 0.5000000), wk = 0.0029070 k( 220) = ( 0.1829268 0.5000000 0.5000000), wk = 0.0029070 k( 221) = ( 0.1951219 0.5000000 0.5000000), wk = 0.0029070 k( 222) = ( 0.2073171 0.5000000 0.5000000), wk = 0.0029070 k( 223) = ( 0.2195122 0.5000000 0.5000000), wk = 0.0029070 k( 224) = ( 0.2317073 0.5000000 0.5000000), wk = 0.0029070 k( 225) = ( 0.2439024 0.5000000 0.5000000), wk = 0.0029070 k( 226) = ( 0.2560976 0.5000000 0.5000000), wk = 0.0029070 k( 227) = ( 0.2682927 0.5000000 0.5000000), wk = 0.0029070 k( 228) = ( 0.2804878 0.5000000 0.5000000), wk = 0.0029070 k( 229) = ( 0.2926829 0.5000000 0.5000000), wk = 0.0029070 k( 230) = ( 0.3048781 0.5000000 0.5000000), wk = 0.0029070 k( 231) = ( 0.3170732 0.5000000 0.5000000), wk = 0.0029070 k( 232) = ( 0.3292683 0.5000000 0.5000000), wk = 0.0029070 k( 233) = ( 0.3414634 0.5000000 0.5000000), wk = 0.0029070 k( 234) = ( 0.3536585 0.5000000 0.5000000), wk = 0.0029070 k( 235) = ( 0.3658537 0.5000000 0.5000000), wk = 0.0029070 k( 236) = ( 0.3780488 0.5000000 0.5000000), wk = 0.0029070 k( 237) = ( 0.3902439 0.5000000 0.5000000), wk = 0.0029070 k( 238) = ( 0.4024390 0.5000000 0.5000000), wk = 0.0029070 k( 239) = ( 0.4146341 0.5000000 0.5000000), wk = 0.0029070 k( 240) = ( 0.4268293 0.5000000 0.5000000), wk = 0.0029070 k( 241) = ( 0.4390244 0.5000000 0.5000000), wk = 0.0029070 k( 242) = ( 0.4512195 0.5000000 0.5000000), wk = 0.0029070 k( 243) = ( 0.4634146 0.5000000 0.5000000), wk = 0.0029070 k( 244) = ( 0.4756098 0.5000000 0.5000000), wk = 0.0029070 k( 245) = ( 0.4878049 0.5000000 0.5000000), wk = 0.0029070 k( 246) = ( 0.5000000 0.5000000 0.5000000), wk = 0.0029070 k( 247) = ( 0.5000000 0.5000000 0.5000000), wk = 0.0029070 k( 248) = ( 0.4912281 0.4912281 0.5000000), wk = 0.0029070 k( 249) = ( 0.4824561 0.4824561 0.5000000), wk = 0.0029070 k( 250) = ( 0.4736842 0.4736842 0.5000000), wk = 0.0029070 k( 251) = ( 0.4649123 0.4649123 0.5000000), wk = 0.0029070 k( 252) = ( 0.4561404 0.4561404 0.5000000), wk = 0.0029070 k( 253) = ( 0.4473684 0.4473684 0.5000000), wk = 0.0029070 k( 254) = ( 0.4385965 0.4385965 0.5000000), wk = 0.0029070 k( 255) = ( 0.4298246 0.4298246 0.5000000), wk = 0.0029070 k( 256) = ( 0.4210526 0.4210526 0.5000000), wk = 0.0029070 k( 257) = ( 0.4122807 0.4122807 0.5000000), wk = 0.0029070 k( 258) = ( 0.4035088 0.4035088 0.5000000), wk = 0.0029070 k( 259) = ( 0.3947368 0.3947368 0.5000000), wk = 0.0029070 k( 260) = ( 0.3859649 0.3859649 0.5000000), wk = 0.0029070 k( 261) = ( 0.3771930 0.3771930 0.5000000), wk = 0.0029070 k( 262) = ( 0.3684211 0.3684211 0.5000000), wk = 0.0029070 k( 263) = ( 0.3596491 0.3596491 0.5000000), wk = 0.0029070 k( 264) = ( 0.3508772 0.3508772 0.5000000), wk = 0.0029070 k( 265) = ( 0.3421053 0.3421053 0.5000000), wk = 0.0029070 k( 266) = ( 0.3333333 0.3333333 0.5000000), wk = 0.0029070 k( 267) = ( 0.3245614 0.3245614 0.5000000), wk = 0.0029070 k( 268) = ( 0.3157895 0.3157895 0.5000000), wk = 0.0029070 k( 269) = ( 0.3070175 0.3070175 0.5000000), wk = 0.0029070 k( 270) = ( 0.2982456 0.2982456 0.5000000), wk = 0.0029070 k( 271) = ( 0.2894737 0.2894737 0.5000000), wk = 0.0029070 k( 272) = ( 0.2807018 0.2807018 0.5000000), wk = 0.0029070 k( 273) = ( 0.2719298 0.2719298 0.5000000), wk = 0.0029070 k( 274) = ( 0.2631579 0.2631579 0.5000000), wk = 0.0029070 k( 275) = ( 0.2543860 0.2543860 0.5000000), wk = 0.0029070 k( 276) = ( 0.2456140 0.2456140 0.5000000), wk = 0.0029070 k( 277) = ( 0.2368421 0.2368421 0.5000000), wk = 0.0029070 k( 278) = ( 0.2280702 0.2280702 0.5000000), wk = 0.0029070 k( 279) = ( 0.2192983 0.2192983 0.5000000), wk = 0.0029070 k( 280) = ( 0.2105263 0.2105263 0.5000000), wk = 0.0029070 k( 281) = ( 0.2017544 0.2017544 0.5000000), wk = 0.0029070 k( 282) = ( 0.1929825 0.1929825 0.5000000), wk = 0.0029070 k( 283) = ( 0.1842105 0.1842105 0.5000000), wk = 0.0029070 k( 284) = ( 0.1754386 0.1754386 0.5000000), wk = 0.0029070 k( 285) = ( 0.1666667 0.1666667 0.5000000), wk = 0.0029070 k( 286) = ( 0.1578947 0.1578947 0.5000000), wk = 0.0029070 k( 287) = ( 0.1491228 0.1491228 0.5000000), wk = 0.0029070 k( 288) = ( 0.1403509 0.1403509 0.5000000), wk = 0.0029070 k( 289) = ( 0.1315790 0.1315790 0.5000000), wk = 0.0029070 k( 290) = ( 0.1228070 0.1228070 0.5000000), wk = 0.0029070 k( 291) = ( 0.1140351 0.1140351 0.5000000), wk = 0.0029070 k( 292) = ( 0.1052632 0.1052632 0.5000000), wk = 0.0029070 k( 293) = ( 0.0964912 0.0964912 0.5000000), wk = 0.0029070 k( 294) = ( 0.0877193 0.0877193 0.5000000), wk = 0.0029070 k( 295) = ( 0.0789474 0.0789474 0.5000000), wk = 0.0029070 k( 296) = ( 0.0701754 0.0701754 0.5000000), wk = 0.0029070 k( 297) = ( 0.0614035 0.0614035 0.5000000), wk = 0.0029070 k( 298) = ( 0.0526316 0.0526316 0.5000000), wk = 0.0029070 k( 299) = ( 0.0438597 0.0438597 0.5000000), wk = 0.0029070 k( 300) = ( 0.0350877 0.0350877 0.5000000), wk = 0.0029070 k( 301) = ( 0.0263158 0.0263158 0.5000000), wk = 0.0029070 k( 302) = ( 0.0175439 0.0175439 0.5000000), wk = 0.0029070 k( 303) = ( 0.0087719 0.0087719 0.5000000), wk = 0.0029070 k( 304) = ( 0.0000000 0.0000000 0.5000000), wk = 0.0029070 k( 305) = ( 0.0000000 0.5000000 0.0000000), wk = 0.0029070 k( 306) = ( 0.0000000 0.5000000 0.0263158), wk = 0.0029070 k( 307) = ( 0.0000000 0.5000000 0.0526316), wk = 0.0029070 k( 308) = ( 0.0000000 0.5000000 0.0789474), wk = 0.0029070 k( 309) = ( 0.0000000 0.5000000 0.1052632), wk = 0.0029070 k( 310) = ( 0.0000000 0.5000000 0.1315790), wk = 0.0029070 k( 311) = ( 0.0000000 0.5000000 0.1578947), wk = 0.0029070 k( 312) = ( 0.0000000 0.5000000 0.1842105), wk = 0.0029070 k( 313) = ( 0.0000000 0.5000000 0.2105263), wk = 0.0029070 k( 314) = ( 0.0000000 0.5000000 0.2368421), wk = 0.0029070 k( 315) = ( 0.0000000 0.5000000 0.2631579), wk = 0.0029070 k( 316) = ( 0.0000000 0.5000000 0.2894737), wk = 0.0029070 k( 317) = ( 0.0000000 0.5000000 0.3157895), wk = 0.0029070 k( 318) = ( 0.0000000 0.5000000 0.3421053), wk = 0.0029070 k( 319) = ( 0.0000000 0.5000000 0.3684211), wk = 0.0029070 k( 320) = ( 0.0000000 0.5000000 0.3947368), wk = 0.0029070 k( 321) = ( 0.0000000 0.5000000 0.4210526), wk = 0.0029070 k( 322) = ( 0.0000000 0.5000000 0.4473684), wk = 0.0029070 k( 323) = ( 0.0000000 0.5000000 0.4736842), wk = 0.0029070 k( 324) = ( 0.0000000 0.5000000 0.5000000), wk = 0.0029070 k( 325) = ( 0.5000000 0.5000000 0.0000000), wk = 0.0029070 k( 326) = ( 0.5000000 0.5000000 0.0263158), wk = 0.0029070 k( 327) = ( 0.5000000 0.5000000 0.0526316), wk = 0.0029070 k( 328) = ( 0.5000000 0.5000000 0.0789474), wk = 0.0029070 k( 329) = ( 0.5000000 0.5000000 0.1052632), wk = 0.0029070 k( 330) = ( 0.5000000 0.5000000 0.1315790), wk = 0.0029070 k( 331) = ( 0.5000000 0.5000000 0.1578947), wk = 0.0029070 k( 332) = ( 0.5000000 0.5000000 0.1842105), wk = 0.0029070 k( 333) = ( 0.5000000 0.5000000 0.2105263), wk = 0.0029070 k( 334) = ( 0.5000000 0.5000000 0.2368421), wk = 0.0029070 k( 335) = ( 0.5000000 0.5000000 0.2631579), wk = 0.0029070 k( 336) = ( 0.5000000 0.5000000 0.2894737), wk = 0.0029070 k( 337) = ( 0.5000000 0.5000000 0.3157895), wk = 0.0029070 k( 338) = ( 0.5000000 0.5000000 0.3421053), wk = 0.0029070 k( 339) = ( 0.5000000 0.5000000 0.3684211), wk = 0.0029070 k( 340) = ( 0.5000000 0.5000000 0.3947368), wk = 0.0029070 k( 341) = ( 0.5000000 0.5000000 0.4210526), wk = 0.0029070 k( 342) = ( 0.5000000 0.5000000 0.4473684), wk = 0.0029070 k( 343) = ( 0.5000000 0.5000000 0.4736842), wk = 0.0029070 k( 344) = ( 0.5000000 0.5000000 0.5000000), wk = 0.0029070 Dense grid: 86817 G-vectors FFT dimensions: ( 45, 45, 96) Largest allocated arrays est. size (Mb) dimensions Kohn-Sham Wavefunctions 0.58 Mb ( 636, 60) NL pseudopotentials 0.99 Mb ( 318, 204) Each V/rho on FFT grid 0.09 Mb ( 6075) Each G-vector array 0.02 Mb ( 2413) G-vector shells 0.01 Mb ( 1073) Largest temporary arrays est. size (Mb) dimensions Auxiliary wavefunctions 2.33 Mb ( 636, 240) Each subspace H/S matrix 0.05 Mb ( 60, 60) Each matrix 0.37 Mb ( 204, 2, 60) The potential is recalculated from file : ./Ti2CuSb3.save/charge-density.dat Starting wfc are 42 randomized atomic wfcs + 18 random wfc Band Structure Calculation Davidson diagonalization with overlap Computing kpt #: 1 total cpu time spent up to now is 3.9 secs Computing kpt #: 2 total cpu time spent up to now is 5.6 secs Computing kpt #: 3 total cpu time spent up to now is 7.3 secs Computing kpt #: 4 total cpu time spent up to now is 9.0 secs Computing kpt #: 5 total cpu time spent up to now is 10.7 secs Computing kpt #: 6 total cpu time spent up to now is 12.4 secs Computing kpt #: 7 total cpu time spent up to now is 14.1 secs Computing kpt #: 8 total cpu time spent up to now is 15.7 secs Computing kpt #: 9 total cpu time spent up to now is 17.4 secs Computing kpt #: 10 total cpu time spent up to now is 19.1 secs Computing kpt #: 11 total cpu time spent up to now is 21.0 secs Computing kpt #: 12 total cpu time spent up to now is 22.7 secs Computing kpt #: 13 total cpu time spent up to now is 24.7 secs Computing kpt #: 14 total cpu time spent up to now is 26.7 secs Computing kpt #: 15 total cpu time spent up to now is 28.6 secs Computing kpt #: 16 total cpu time spent up to now is 30.5 secs Computing kpt #: 17 total cpu time spent up to now is 32.5 secs Computing kpt #: 18 total cpu time spent up to now is 34.3 secs Computing kpt #: 19 total cpu time spent up to now is 36.3 secs Computing kpt #: 20 total cpu time spent up to now is 38.1 secs Computing kpt #: 21 total cpu time spent up to now is 39.9 secs Computing kpt #: 22 total cpu time spent up to now is 41.8 secs Computing kpt #: 23 total cpu time spent up to now is 43.7 secs Computing kpt #: 24 total cpu time spent up to now is 45.7 secs Computing kpt #: 25 total cpu time spent up to now is 47.5 secs Computing kpt #: 26 total cpu time spent up to now is 49.3 secs Computing kpt #: 27 total cpu time spent up to now is 51.1 secs Computing kpt #: 28 total cpu time spent up to now is 52.9 secs Computing kpt #: 29 total cpu time spent up to now is 54.6 secs Computing kpt #: 30 total cpu time spent up to now is 56.3 secs Computing kpt #: 31 total cpu time spent up to now is 58.1 secs Computing kpt #: 32 total cpu time spent up to now is 59.8 secs Computing kpt #: 33 total cpu time spent up to now is 61.6 secs Computing kpt #: 34 total cpu time spent up to now is 63.3 secs Computing kpt #: 35 total cpu time spent up to now is 65.2 secs Computing kpt #: 36 total cpu time spent up to now is 67.0 secs Computing kpt #: 37 total cpu time spent up to now is 68.7 secs Computing kpt #: 38 total cpu time spent up to now is 70.5 secs Computing kpt #: 39 total cpu time spent up to now is 72.3 secs Computing kpt #: 40 total cpu time spent up to now is 74.1 secs Computing kpt #: 41 total cpu time spent up to now is 75.8 secs Computing kpt #: 42 total cpu time spent up to now is 77.6 secs Computing kpt #: 43 total cpu time spent up to now is 79.4 secs Computing kpt #: 44 total cpu time spent up to now is 81.2 secs Computing kpt #: 45 total cpu time spent up to now is 82.9 secs Computing kpt #: 46 total cpu time spent up to now is 84.7 secs Computing kpt #: 47 total cpu time spent up to now is 86.5 secs Computing kpt #: 48 total cpu time spent up to now is 88.3 secs Computing kpt #: 49 total cpu time spent up to now is 90.1 secs Computing kpt #: 50 total cpu time spent up to now is 91.9 secs Computing kpt #: 51 total cpu time spent up to now is 93.6 secs Computing kpt #: 52 total cpu time spent up to now is 95.4 secs Computing kpt #: 53 total cpu time spent up to now is 97.2 secs Computing kpt #: 54 total cpu time spent up to now is 99.0 secs Computing kpt #: 55 total cpu time spent up to now is 100.8 secs Computing kpt #: 56 total cpu time spent up to now is 102.6 secs Computing kpt #: 57 total cpu time spent up to now is 104.4 secs Computing kpt #: 58 total cpu time spent up to now is 106.2 secs Computing kpt #: 59 total cpu time spent up to now is 108.0 secs Computing kpt #: 60 total cpu time spent up to now is 109.8 secs Computing kpt #: 61 total cpu time spent up to now is 111.6 secs Computing kpt #: 62 total cpu time spent up to now is 113.4 secs Computing kpt #: 63 total cpu time spent up to now is 115.2 secs Computing kpt #: 64 total cpu time spent up to now is 117.0 secs Computing kpt #: 65 total cpu time spent up to now is 118.8 secs Computing kpt #: 66 total cpu time spent up to now is 120.6 secs Computing kpt #: 67 total cpu time spent up to now is 122.5 secs Computing kpt #: 68 total cpu time spent up to now is 124.3 secs Computing kpt #: 69 total cpu time spent up to now is 126.1 secs Computing kpt #: 70 total cpu time spent up to now is 127.9 secs Computing kpt #: 71 total cpu time spent up to now is 129.7 secs Computing kpt #: 72 total cpu time spent up to now is 131.6 secs Computing kpt #: 73 total cpu time spent up to now is 133.5 secs Computing kpt #: 74 total cpu time spent up to now is 135.3 secs Computing kpt #: 75 total cpu time spent up to now is 137.1 secs Computing kpt #: 76 total cpu time spent up to now is 138.9 secs Computing kpt #: 77 total cpu time spent up to now is 140.7 secs Computing kpt #: 78 total cpu time spent up to now is 142.5 secs Computing kpt #: 79 total cpu time spent up to now is 144.2 secs Computing kpt #: 80 total cpu time spent up to now is 146.0 secs Computing kpt #: 81 total cpu time spent up to now is 147.8 secs Computing kpt #: 82 total cpu time spent up to now is 149.5 secs Computing kpt #: 83 total cpu time spent up to now is 151.3 secs Computing kpt #: 84 total cpu time spent up to now is 153.1 secs Computing kpt #: 85 total cpu time spent up to now is 154.8 secs Computing kpt #: 86 total cpu time spent up to now is 156.6 secs Computing kpt #: 87 total cpu time spent up to now is 158.4 secs Computing kpt #: 88 total cpu time spent up to now is 160.2 secs Computing kpt #: 89 total cpu time spent up to now is 161.9 secs Computing kpt #: 90 total cpu time spent up to now is 163.7 secs Computing kpt #: 91 total cpu time spent up to now is 165.5 secs Computing kpt #: 92 total cpu time spent up to now is 167.3 secs Computing kpt #: 93 total cpu time spent up to now is 169.3 secs Computing kpt #: 94 total cpu time spent up to now is 171.5 secs Computing kpt #: 95 total cpu time spent up to now is 173.3 secs Computing kpt #: 96 total cpu time spent up to now is 175.2 secs Computing kpt #: 97 total cpu time spent up to now is 177.1 secs Computing kpt #: 98 total cpu time spent up to now is 179.0 secs Computing kpt #: 99 total cpu time spent up to now is 180.9 secs Computing kpt #: 100 total cpu time spent up to now is 182.8 secs Computing kpt #: 101 total cpu time spent up to now is 184.7 secs Computing kpt #: 102 total cpu time spent up to now is 186.6 secs Computing kpt #: 103 total cpu time spent up to now is 188.5 secs Computing kpt #: 104 total cpu time spent up to now is 190.4 secs Computing kpt #: 105 total cpu time spent up to now is 192.3 secs Computing kpt #: 106 total cpu time spent up to now is 194.1 secs Computing kpt #: 107 total cpu time spent up to now is 196.0 secs Computing kpt #: 108 total cpu time spent up to now is 197.9 secs Computing kpt #: 109 total cpu time spent up to now is 199.7 secs Computing kpt #: 110 total cpu time spent up to now is 201.6 secs Computing kpt #: 111 total cpu time spent up to now is 203.5 secs Computing kpt #: 112 total cpu time spent up to now is 205.4 secs Computing kpt #: 113 total cpu time spent up to now is 207.3 secs Computing kpt #: 114 total cpu time spent up to now is 209.1 secs Computing kpt #: 115 total cpu time spent up to now is 211.0 secs Computing kpt #: 116 total cpu time spent up to now is 212.9 secs Computing kpt #: 117 total cpu time spent up to now is 214.8 secs Computing kpt #: 118 total cpu time spent up to now is 216.7 secs Computing kpt #: 119 total cpu time spent up to now is 218.6 secs Computing kpt #: 120 total cpu time spent up to now is 220.4 secs Computing kpt #: 121 total cpu time spent up to now is 222.2 secs Computing kpt #: 122 total cpu time spent up to now is 224.1 secs Computing kpt #: 123 total cpu time spent up to now is 225.9 secs Computing kpt #: 124 total cpu time spent up to now is 227.6 secs Computing kpt #: 125 total cpu time spent up to now is 229.4 secs Computing kpt #: 126 total cpu time spent up to now is 231.0 secs Computing kpt #: 127 total cpu time spent up to now is 232.7 secs Computing kpt #: 128 total cpu time spent up to now is 234.5 secs Computing kpt #: 129 total cpu time spent up to now is 236.1 secs Computing kpt #: 130 total cpu time spent up to now is 237.8 secs Computing kpt #: 131 total cpu time spent up to now is 239.5 secs Computing kpt #: 132 total cpu time spent up to now is 241.1 secs Computing kpt #: 133 total cpu time spent up to now is 242.8 secs Computing kpt #: 134 total cpu time spent up to now is 244.5 secs Computing kpt #: 135 total cpu time spent up to now is 246.2 secs Computing kpt #: 136 total cpu time spent up to now is 247.9 secs Computing kpt #: 137 total cpu time spent up to now is 249.5 secs Computing kpt #: 138 total cpu time spent up to now is 251.2 secs Computing kpt #: 139 total cpu time spent up to now is 252.8 secs Computing kpt #: 140 total cpu time spent up to now is 254.5 secs Computing kpt #: 141 total cpu time spent up to now is 256.2 secs Computing kpt #: 142 total cpu time spent up to now is 257.9 secs Computing kpt #: 143 total cpu time spent up to now is 259.6 secs Computing kpt #: 144 total cpu time spent up to now is 261.2 secs Computing kpt #: 145 total cpu time spent up to now is 263.0 secs Computing kpt #: 146 total cpu time spent up to now is 264.7 secs Computing kpt #: 147 total cpu time spent up to now is 266.3 secs Computing kpt #: 148 total cpu time spent up to now is 268.0 secs Computing kpt #: 149 total cpu time spent up to now is 269.6 secs Computing kpt #: 150 total cpu time spent up to now is 271.2 secs Computing kpt #: 151 total cpu time spent up to now is 272.9 secs Computing kpt #: 152 total cpu time spent up to now is 274.6 secs Computing kpt #: 153 total cpu time spent up to now is 276.3 secs Computing kpt #: 154 total cpu time spent up to now is 278.0 secs Computing kpt #: 155 total cpu time spent up to now is 279.8 secs Computing kpt #: 156 total cpu time spent up to now is 281.7 secs Computing kpt #: 157 total cpu time spent up to now is 283.3 secs Computing kpt #: 158 total cpu time spent up to now is 285.0 secs Computing kpt #: 159 total cpu time spent up to now is 286.8 secs Computing kpt #: 160 total cpu time spent up to now is 288.7 secs Computing kpt #: 161 total cpu time spent up to now is 290.4 secs Computing kpt #: 162 total cpu time spent up to now is 292.1 secs Computing kpt #: 163 total cpu time spent up to now is 293.8 secs Computing kpt #: 164 total cpu time spent up to now is 295.7 secs Computing kpt #: 165 total cpu time spent up to now is 297.4 secs Computing kpt #: 166 total cpu time spent up to now is 299.2 secs Computing kpt #: 167 total cpu time spent up to now is 300.9 secs Computing kpt #: 168 total cpu time spent up to now is 302.6 secs Computing kpt #: 169 total cpu time spent up to now is 304.5 secs Computing kpt #: 170 total cpu time spent up to now is 306.4 secs Computing kpt #: 171 total cpu time spent up to now is 308.2 secs Computing kpt #: 172 total cpu time spent up to now is 310.1 secs Computing kpt #: 173 total cpu time spent up to now is 312.0 secs Computing kpt #: 174 total cpu time spent up to now is 313.9 secs Computing kpt #: 175 total cpu time spent up to now is 316.0 secs Computing kpt #: 176 total cpu time spent up to now is 318.0 secs Computing kpt #: 177 total cpu time spent up to now is 320.1 secs Computing kpt #: 178 total cpu time spent up to now is 322.1 secs Computing kpt #: 179 total cpu time spent up to now is 324.2 secs Computing kpt #: 180 total cpu time spent up to now is 326.3 secs Computing kpt #: 181 total cpu time spent up to now is 329.1 secs Computing kpt #: 182 total cpu time spent up to now is 331.2 secs Computing kpt #: 183 total cpu time spent up to now is 332.9 secs Computing kpt #: 184 total cpu time spent up to now is 334.7 secs Computing kpt #: 185 total cpu time spent up to now is 336.5 secs Computing kpt #: 186 total cpu time spent up to now is 338.2 secs Computing kpt #: 187 total cpu time spent up to now is 340.0 secs Computing kpt #: 188 total cpu time spent up to now is 341.8 secs Computing kpt #: 189 total cpu time spent up to now is 343.6 secs Computing kpt #: 190 total cpu time spent up to now is 345.4 secs Computing kpt #: 191 total cpu time spent up to now is 347.3 secs Computing kpt #: 192 total cpu time spent up to now is 349.1 secs Computing kpt #: 193 total cpu time spent up to now is 350.9 secs Computing kpt #: 194 total cpu time spent up to now is 352.7 secs Computing kpt #: 195 total cpu time spent up to now is 354.4 secs Computing kpt #: 196 total cpu time spent up to now is 356.3 secs Computing kpt #: 197 total cpu time spent up to now is 358.1 secs Computing kpt #: 198 total cpu time spent up to now is 359.9 secs Computing kpt #: 199 total cpu time spent up to now is 361.6 secs Computing kpt #: 200 total cpu time spent up to now is 363.3 secs Computing kpt #: 201 total cpu time spent up to now is 365.1 secs Computing kpt #: 202 total cpu time spent up to now is 366.7 secs Computing kpt #: 203 total cpu time spent up to now is 368.3 secs Computing kpt #: 204 total cpu time spent up to now is 369.9 secs Computing kpt #: 205 total cpu time spent up to now is 371.5 secs Computing kpt #: 206 total cpu time spent up to now is 373.1 secs Computing kpt #: 207 total cpu time spent up to now is 374.8 secs Computing kpt #: 208 total cpu time spent up to now is 376.5 secs Computing kpt #: 209 total cpu time spent up to now is 378.2 secs Computing kpt #: 210 total cpu time spent up to now is 379.9 secs Computing kpt #: 211 total cpu time spent up to now is 381.7 secs Computing kpt #: 212 total cpu time spent up to now is 383.5 secs Computing kpt #: 213 total cpu time spent up to now is 385.3 secs Computing kpt #: 214 total cpu time spent up to now is 387.1 secs Computing kpt #: 215 total cpu time spent up to now is 388.9 secs Computing kpt #: 216 total cpu time spent up to now is 390.8 secs Computing kpt #: 217 total cpu time spent up to now is 392.7 secs Computing kpt #: 218 total cpu time spent up to now is 394.5 secs Computing kpt #: 219 total cpu time spent up to now is 396.3 secs Computing kpt #: 220 total cpu time spent up to now is 398.2 secs Computing kpt #: 221 total cpu time spent up to now is 400.0 secs Computing kpt #: 222 total cpu time spent up to now is 401.9 secs Computing kpt #: 223 total cpu time spent up to now is 403.7 secs Computing kpt #: 224 total cpu time spent up to now is 405.6 secs Computing kpt #: 225 total cpu time spent up to now is 407.5 secs Computing kpt #: 226 total cpu time spent up to now is 409.3 secs Computing kpt #: 227 total cpu time spent up to now is 411.2 secs Computing kpt #: 228 total cpu time spent up to now is 413.1 secs Computing kpt #: 229 total cpu time spent up to now is 415.1 secs Computing kpt #: 230 total cpu time spent up to now is 417.0 secs Computing kpt #: 231 total cpu time spent up to now is 418.9 secs Computing kpt #: 232 total cpu time spent up to now is 421.0 secs Computing kpt #: 233 total cpu time spent up to now is 422.9 secs Computing kpt #: 234 total cpu time spent up to now is 424.9 secs Computing kpt #: 235 total cpu time spent up to now is 426.9 secs Computing kpt #: 236 total cpu time spent up to now is 428.9 secs Computing kpt #: 237 total cpu time spent up to now is 430.8 secs Computing kpt #: 238 total cpu time spent up to now is 432.6 secs Computing kpt #: 239 total cpu time spent up to now is 434.4 secs Computing kpt #: 240 total cpu time spent up to now is 436.4 secs Computing kpt #: 241 total cpu time spent up to now is 438.4 secs Computing kpt #: 242 total cpu time spent up to now is 440.2 secs Computing kpt #: 243 total cpu time spent up to now is 442.0 secs Computing kpt #: 244 total cpu time spent up to now is 443.8 secs Computing kpt #: 245 total cpu time spent up to now is 445.6 secs Computing kpt #: 246 total cpu time spent up to now is 447.4 secs Computing kpt #: 247 total cpu time spent up to now is 449.1 secs Computing kpt #: 248 total cpu time spent up to now is 450.9 secs Computing kpt #: 249 total cpu time spent up to now is 452.7 secs Computing kpt #: 250 total cpu time spent up to now is 454.6 secs Computing kpt #: 251 total cpu time spent up to now is 456.4 secs Computing kpt #: 252 total cpu time spent up to now is 458.2 secs Computing kpt #: 253 total cpu time spent up to now is 460.0 secs Computing kpt #: 254 total cpu time spent up to now is 461.8 secs Computing kpt #: 255 total cpu time spent up to now is 463.6 secs Computing kpt #: 256 total cpu time spent up to now is 465.5 secs Computing kpt #: 257 total cpu time spent up to now is 467.4 secs Computing kpt #: 258 total cpu time spent up to now is 469.7 secs Computing kpt #: 259 total cpu time spent up to now is 471.7 secs Computing kpt #: 260 total cpu time spent up to now is 473.6 secs Computing kpt #: 261 total cpu time spent up to now is 475.5 secs Computing kpt #: 262 total cpu time spent up to now is 477.4 secs Computing kpt #: 263 total cpu time spent up to now is 479.3 secs Computing kpt #: 264 total cpu time spent up to now is 481.2 secs Computing kpt #: 265 total cpu time spent up to now is 483.1 secs Computing kpt #: 266 total cpu time spent up to now is 485.0 secs Computing kpt #: 267 total cpu time spent up to now is 487.0 secs Computing kpt #: 268 total cpu time spent up to now is 488.9 secs Computing kpt #: 269 total cpu time spent up to now is 490.8 secs Computing kpt #: 270 total cpu time spent up to now is 492.7 secs Computing kpt #: 271 total cpu time spent up to now is 494.5 secs Computing kpt #: 272 total cpu time spent up to now is 496.5 secs Computing kpt #: 273 total cpu time spent up to now is 498.4 secs Computing kpt #: 274 total cpu time spent up to now is 500.3 secs Computing kpt #: 275 total cpu time spent up to now is 502.2 secs Computing kpt #: 276 total cpu time spent up to now is 504.1 secs Computing kpt #: 277 total cpu time spent up to now is 506.0 secs Computing kpt #: 278 total cpu time spent up to now is 507.9 secs Computing kpt #: 279 total cpu time spent up to now is 509.8 secs Computing kpt #: 280 total cpu time spent up to now is 511.7 secs Computing kpt #: 281 total cpu time spent up to now is 513.6 secs Computing kpt #: 282 total cpu time spent up to now is 515.5 secs Computing kpt #: 283 total cpu time spent up to now is 517.4 secs Computing kpt #: 284 total cpu time spent up to now is 519.3 secs Computing kpt #: 285 total cpu time spent up to now is 521.1 secs Computing kpt #: 286 total cpu time spent up to now is 523.0 secs Computing kpt #: 287 total cpu time spent up to now is 524.8 secs Computing kpt #: 288 total cpu time spent up to now is 526.7 secs Computing kpt #: 289 total cpu time spent up to now is 528.4 secs Computing kpt #: 290 total cpu time spent up to now is 530.2 secs Computing kpt #: 291 total cpu time spent up to now is 532.0 secs Computing kpt #: 292 total cpu time spent up to now is 533.8 secs Computing kpt #: 293 total cpu time spent up to now is 535.5 secs Computing kpt #: 294 total cpu time spent up to now is 537.3 secs Computing kpt #: 295 total cpu time spent up to now is 539.1 secs Computing kpt #: 296 total cpu time spent up to now is 540.9 secs Computing kpt #: 297 total cpu time spent up to now is 542.7 secs Computing kpt #: 298 total cpu time spent up to now is 544.5 secs Computing kpt #: 299 total cpu time spent up to now is 546.3 secs Computing kpt #: 300 total cpu time spent up to now is 548.0 secs Computing kpt #: 301 total cpu time spent up to now is 549.7 secs Computing kpt #: 302 total cpu time spent up to now is 551.5 secs Computing kpt #: 303 total cpu time spent up to now is 553.3 secs Computing kpt #: 304 total cpu time spent up to now is 555.1 secs Computing kpt #: 305 total cpu time spent up to now is 556.9 secs Computing kpt #: 306 total cpu time spent up to now is 558.6 secs Computing kpt #: 307 total cpu time spent up to now is 560.3 secs Computing kpt #: 308 total cpu time spent up to now is 562.1 secs Computing kpt #: 309 total cpu time spent up to now is 563.9 secs Computing kpt #: 310 total cpu time spent up to now is 565.6 secs Computing kpt #: 311 total cpu time spent up to now is 567.3 secs Computing kpt #: 312 total cpu time spent up to now is 569.1 secs Computing kpt #: 313 total cpu time spent up to now is 570.7 secs Computing kpt #: 314 total cpu time spent up to now is 572.4 secs Computing kpt #: 315 total cpu time spent up to now is 574.1 secs Computing kpt #: 316 total cpu time spent up to now is 575.8 secs Computing kpt #: 317 total cpu time spent up to now is 577.4 secs Computing kpt #: 318 total cpu time spent up to now is 579.0 secs Computing kpt #: 319 total cpu time spent up to now is 580.6 secs Computing kpt #: 320 total cpu time spent up to now is 582.2 secs Computing kpt #: 321 total cpu time spent up to now is 583.7 secs Computing kpt #: 322 total cpu time spent up to now is 585.3 secs Computing kpt #: 323 total cpu time spent up to now is 586.9 secs Computing kpt #: 324 total cpu time spent up to now is 588.5 secs Computing kpt #: 325 total cpu time spent up to now is 590.3 secs Computing kpt #: 326 total cpu time spent up to now is 592.1 secs Computing kpt #: 327 total cpu time spent up to now is 593.9 secs Computing kpt #: 328 total cpu time spent up to now is 595.7 secs Computing kpt #: 329 total cpu time spent up to now is 597.6 secs Computing kpt #: 330 total cpu time spent up to now is 599.5 secs Computing kpt #: 331 total cpu time spent up to now is 601.3 secs Computing kpt #: 332 total cpu time spent up to now is 603.1 secs Computing kpt #: 333 total cpu time spent up to now is 605.0 secs Computing kpt #: 334 total cpu time spent up to now is 606.9 secs Computing kpt #: 335 total cpu time spent up to now is 608.8 secs Computing kpt #: 336 total cpu time spent up to now is 610.6 secs Computing kpt #: 337 total cpu time spent up to now is 612.6 secs Computing kpt #: 338 total cpu time spent up to now is 614.4 secs Computing kpt #: 339 total cpu time spent up to now is 616.2 secs Computing kpt #: 340 total cpu time spent up to now is 618.0 secs Computing kpt #: 341 total cpu time spent up to now is 619.9 secs Computing kpt #: 342 total cpu time spent up to now is 621.6 secs Computing kpt #: 343 total cpu time spent up to now is 623.4 secs Computing kpt #: 344 total cpu time spent up to now is 625.2 secs ethr = 2.00E-08, avg # of iterations = 35.0 total cpu time spent up to now is 625.2 secs End of band structure calculation k = 0.0000 0.0000 0.0000 ( 10931 PWs) bands (ev): -48.2862 -48.2862 -48.2861 -48.2861 -24.9508 -24.9508 -24.9493 -24.9493 -24.3264 -24.3264 -24.3247 -24.3247 -24.2504 -24.2504 -24.2500 -24.2500 -2.1439 -2.1439 -0.8953 -0.8953 0.4485 0.4485 5.6698 5.6698 5.8847 5.8847 6.2438 6.2438 6.4434 6.4434 6.4875 6.4875 6.6047 6.6047 6.9215 6.9215 7.4961 7.4961 7.7357 7.7357 8.1139 8.1139 8.2195 8.2195 8.3452 8.3452 8.5141 8.5141 9.4688 9.4688 9.6414 9.6414 9.7263 9.7263 9.8858 9.8858 9.9061 9.9061 10.2801 10.2801 k = 0.0000 0.0122-0.0000 ( 10919 PWs) bands (ev): -48.2862 -48.2862 -48.2861 -48.2861 -24.9508 -24.9508 -24.9493 -24.9493 -24.3264 -24.3264 -24.3247 -24.3247 -24.2504 -24.2504 -24.2500 -24.2500 -2.1426 -2.1426 -0.8942 -0.8942 0.4492 0.4493 5.6703 5.6707 5.8778 5.8860 6.2377 6.2459 6.4413 6.4464 6.4854 6.4869 6.6040 6.6056 6.9160 6.9267 7.4904 7.4974 7.7276 7.7411 8.0662 8.0826 8.2293 8.2328 8.3694 8.3697 8.5128 8.5160 9.4609 9.4721 9.6383 9.6400 9.7248 9.7293 9.8847 9.8847 9.9071 9.9081 10.2790 10.2825 k = 0.0000 0.0244-0.0000 ( 10911 PWs) bands (ev): -48.2862 -48.2862 -48.2861 -48.2861 -24.9509 -24.9508 -24.9494 -24.9493 -24.3265 -24.3264 -24.3247 -24.3247 -24.2505 -24.2504 -24.2501 -24.2500 -2.1385 -2.1385 -0.8909 -0.8909 0.4515 0.4516 5.6721 5.6731 5.8653 5.8817 6.2281 6.2439 6.4402 6.4501 6.4805 6.4839 6.6033 6.6066 6.9101 6.9315 7.4801 7.4947 7.7178 7.7434 7.9846 8.0066 8.2380 8.2491 8.4193 8.4285 8.5155 8.5182 9.4488 9.4707 9.6307 9.6344 9.7251 9.7337 9.8812 9.8818 9.9110 9.9134 10.2793 10.2859 k = 0.0000 0.0366-0.0000 ( 10903 PWs) bands (ev): -48.2862 -48.2862 -48.2861 -48.2861 -24.9509 -24.9509 -24.9494 -24.9494 -24.3265 -24.3264 -24.3247 -24.3247 -24.2505 -24.2505 -24.2501 -24.2501 -2.1318 -2.1318 -0.8854 -0.8854 0.4553 0.4555 5.6750 5.6771 5.8471 5.8715 6.2160 6.2381 6.4394 6.4536 6.4727 6.4790 6.6027 6.6073 6.9039 6.9361 7.4640 7.4877 7.7071 7.7427 7.8944 7.9166 8.2445 8.2618 8.4578 8.4891 8.5287 8.5368 9.4325 9.4641 9.6188 9.6249 9.7273 9.7393 9.8756 9.8773 9.9179 9.9221 10.2808 10.2902 k = 0.0000 0.0488-0.0000 ( 10897 PWs) bands (ev): -48.2862 -48.2862 -48.2861 -48.2861 -24.9510 -24.9509 -24.9495 -24.9494 -24.3266 -24.3264 -24.3248 -24.3247 -24.2506 -24.2505 -24.2501 -24.2501 -2.1225 -2.1224 -0.8778 -0.8777 0.4607 0.4609 5.6785 5.6824 5.8229 5.8555 6.2020 6.2289 6.4385 6.4544 6.4622 6.4739 6.6017 6.6075 6.8975 6.9406 7.4405 7.4766 7.6954 7.7396 7.8038 7.8220 8.2525 8.2748 8.4653 8.5034 8.5838 8.5870 9.4124 9.4520 9.6027 9.6120 9.7312 9.7459 9.8689 9.8718 9.9279 9.9338 10.2835 10.2952 k = 0.0000 0.0610-0.0000 ( 10901 PWs) bands (ev): -48.2862 -48.2862 -48.2861 -48.2861 -24.9510 -24.9509 -24.9495 -24.9495 -24.3267 -24.3264 -24.3248 -24.3248 -24.2508 -24.2507 -24.2501 -24.2501 -2.1104 -2.1104 -0.8680 -0.8679 0.4674 0.4677 5.6814 5.6891 5.7924 5.8342 6.1868 6.2169 6.4358 6.4484 6.4502 6.4722 6.6000 6.6066 6.8913 6.9448 7.4070 7.4613 7.6731 7.7141 7.7373 7.7393 8.2632 8.2896 8.4585 8.4989 8.6456 8.6511 9.3889 9.4342 9.5831 9.5967 9.7366 9.7532 9.8619 9.8659 9.9410 9.9483 10.2872 10.3004 k = 0.0000 0.0732-0.0000 ( 10889 PWs) bands (ev): -48.2862 -48.2862 -48.2861 -48.2861 -24.9511 -24.9510 -24.9496 -24.9495 -24.3268 -24.3264 -24.3249 -24.3248 -24.2510 -24.2509 -24.2501 -24.2501 -2.0957 -2.0957 -0.8560 -0.8559 0.4756 0.4759 5.6814 5.6966 5.7558 5.8097 6.1708 6.2025 6.4261 6.4357 6.4417 6.4734 6.5969 6.6044 6.8856 6.9489 7.3606 7.4412 7.6021 7.6398 7.7045 7.7336 8.2770 8.3068 8.4457 8.4890 8.7030 8.7147 9.3624 9.4107 9.5607 9.5798 9.7434 9.7609 9.8550 9.8601 9.9571 9.9656 10.2916 10.3057 k = 0.0000 0.0854-0.0000 ( 10885 PWs) bands (ev): -48.2862 -48.2862 -48.2861 -48.2861 -24.9511 -24.9510 -24.9497 -24.9496 -24.3269 -24.3265 -24.3249 -24.3248 -24.2512 -24.2511 -24.2502 -24.2501 -2.0783 -2.0783 -0.8420 -0.8418 0.4850 0.4854 5.6725 5.6976 5.7197 5.7876 6.1539 6.1861 6.4083 6.4187 6.4372 6.4746 6.5916 6.6005 6.8810 6.9525 7.2993 7.4095 7.5177 7.5785 7.6980 7.7303 8.2932 8.3268 8.4288 8.4738 8.7566 8.7723 9.3335 9.3818 9.5366 9.5623 9.7511 9.7688 9.8488 9.8549 9.9761 9.9855 10.2966 10.3110 k = 0.0000 0.0976-0.0000 ( 10881 PWs) bands (ev): -48.2862 -48.2862 -48.2860 -48.2860 -24.9512 -24.9511 -24.9497 -24.9497 -24.3270 -24.3265 -24.3249 -24.3248 -24.2514 -24.2513 -24.2502 -24.2501 -2.0584 -2.0583 -0.8258 -0.8256 0.4957 0.4961 5.6465 5.6549 5.7213 5.7759 6.1357 6.1675 6.3864 6.3982 6.4324 6.4749 6.5838 6.5948 6.8780 6.9555 7.2259 7.3462 7.4637 7.5324 7.6970 7.7282 8.3096 8.3496 8.4098 8.4529 8.8054 8.8227 9.3031 9.3480 9.5122 9.5452 9.7595 9.7767 9.8434 9.8503 9.9979 10.0082 10.3019 10.3162 k = 0.0000 0.1098-0.0000 ( 10867 PWs) bands (ev): -48.2861 -48.2861 -48.2860 -48.2860 -24.9513 -24.9512 -24.9498 -24.9498 -24.3272 -24.3266 -24.3249 -24.3248 -24.2517 -24.2516 -24.2502 -24.2501 -2.0357 -2.0357 -0.8076 -0.8074 0.5074 0.5079 5.5965 5.6020 5.7322 5.7764 6.1153 6.1467 6.3615 6.3742 6.4256 6.4736 6.5733 6.5877 6.8769 6.9566 7.1467 7.2561 7.4408 7.4991 7.6984 7.7274 8.3183 8.3751 8.3960 8.4257 8.8490 8.8651 9.2717 9.3102 9.4891 9.5293 9.7683 9.7846 9.8389 9.8464 10.0227 10.0335 10.3073 10.3212 k = 0.0000 0.1220-0.0000 ( 10863 PWs) bands (ev): -48.2861 -48.2861 -48.2860 -48.2860 -24.9514 -24.9512 -24.9499 -24.9499 -24.3273 -24.3268 -24.3250 -24.3248 -24.2520 -24.2519 -24.2502 -24.2501 -2.0105 -2.0105 -0.7873 -0.7871 0.5201 0.5207 5.5304 5.5438 5.7444 5.7844 6.0914 6.1228 6.3339 6.3470 6.4162 6.4698 6.5610 6.5796 6.8774 6.9520 7.0716 7.1613 7.4305 7.4757 7.7013 7.7279 8.3046 8.3907 8.4016 8.4039 8.8872 8.8985 9.2398 9.2689 9.4693 9.5153 9.7776 9.7924 9.8352 9.8434 10.0503 10.0616 10.3123 10.3259 k = 0.0000 0.1341-0.0000 ( 10859 PWs) bands (ev): -48.2861 -48.2861 -48.2860 -48.2860 -24.9515 -24.9513 -24.9501 -24.9500 -24.3275 -24.3269 -24.3250 -24.3248 -24.2523 -24.2523 -24.2502 -24.2501 -1.9827 -1.9827 -0.7650 -0.7648 0.5336 0.5343 5.4576 5.4758 5.7571 5.7962 6.0622 6.0949 6.3039 6.3168 6.4034 6.4625 6.5481 6.5713 6.8790 6.9278 7.0191 7.0706 7.4271 7.4602 7.7051 7.7293 8.2704 8.3496 8.4241 8.4340 8.9199 8.9226 9.2076 9.2251 9.4545 9.5040 9.7873 9.8003 9.8322 9.8410 10.0808 10.0926 10.3158 10.3298 k = 0.0000 0.1463-0.0000 ( 10875 PWs) bands (ev): -48.2861 -48.2861 -48.2860 -48.2860 -24.9517 -24.9514 -24.9502 -24.9501 -24.3277 -24.3271 -24.3249 -24.3248 -24.2527 -24.2527 -24.2502 -24.2501 -1.9524 -1.9524 -0.7408 -0.7406 0.5478 0.5485 5.3788 5.4003 5.7695 5.8095 6.0260 6.0615 6.2724 6.2842 6.3870 6.4502 6.5366 6.5635 6.8755 6.8798 6.9895 7.0012 7.4290 7.4512 7.7095 7.7317 8.2255 8.3009 8.4540 8.4665 8.9369 8.9470 9.1753 9.1792 9.4461 9.4958 9.7974 9.8082 9.8299 9.8395 10.1143 10.1264 10.3161 10.3319 k = 0.0000 0.1585-0.0000 ( 10875 PWs) bands (ev): -48.2860 -48.2860 -48.2859 -48.2859 -24.9518 -24.9515 -24.9503 -24.9502 -24.3280 -24.3273 -24.3249 -24.3248 -24.2531 -24.2530 -24.2502 -24.2500 -1.9195 -1.9195 -0.7147 -0.7145 0.5624 0.5632 5.2950 5.3190 5.7801 5.8217 5.9820 6.0213 6.2405 6.2504 6.3670 6.4321 6.5279 6.5568 6.8177 6.8717 6.9282 6.9978 7.4354 7.4475 7.7142 7.7347 8.1740 8.2458 8.4875 8.5009 8.9415 8.9687 9.1319 9.1433 9.4443 9.4910 9.8080 9.8161 9.8283 9.8391 10.1507 10.1632 10.3097 10.3298 k = 0.0000 0.1707-0.0000 ( 10879 PWs) bands (ev): -48.2860 -48.2860 -48.2859 -48.2859 -24.9519 -24.9516 -24.9504 -24.9504 -24.3282 -24.3275 -24.3249 -24.3247 -24.2535 -24.2535 -24.2502 -24.2500 -1.8841 -1.8841 -0.6868 -0.6866 0.5772 0.5781 5.2071 5.2332 5.7857 5.8251 5.9355 5.9748 6.2097 6.2169 6.3436 6.4092 6.5221 6.5514 6.7664 6.8347 6.9074 6.9975 7.4455 7.4477 7.7190 7.7381 8.1183 8.1856 8.5233 8.5369 8.9366 8.9850 9.0837 9.1128 9.4484 9.4896 9.8185 9.8230 9.8280 9.8408 10.1898 10.2031 10.2936 10.3198 k = 0.0000 0.1829-0.0000 ( 10883 PWs) bands (ev): -48.2860 -48.2860 -48.2859 -48.2859 -24.9521 -24.9518 -24.9506 -24.9505 -24.3285 -24.3278 -24.3248 -24.3247 -24.2539 -24.2539 -24.2501 -24.2500 -1.8463 -1.8463 -0.6572 -0.6570 0.5920 0.5930 5.1163 5.1441 5.7773 5.7955 5.9101 5.9292 6.1809 6.1852 6.3176 6.3833 6.5185 6.5474 6.7243 6.7898 6.9055 6.9973 7.4506 7.4587 7.7235 7.7416 8.0609 8.1221 8.5607 8.5741 8.9223 8.9949 9.0364 9.0853 9.4568 9.4909 9.8230 9.8269 9.8350 9.8469 10.2307 10.2460 10.2700 10.3014 k = 0.0000 0.1951-0.0000 ( 10871 PWs) bands (ev): -48.2860 -48.2860 -48.2859 -48.2859 -24.9522 -24.9519 -24.9507 -24.9506 -24.3288 -24.3281 -24.3248 -24.3247 -24.2544 -24.2543 -24.2501 -24.2500 -1.8060 -1.8060 -0.6259 -0.6257 0.6065 0.6076 5.0236 5.0530 5.7249 5.7386 5.9010 5.9145 6.1543 6.1559 6.2895 6.3563 6.5164 6.5446 6.6913 6.7520 6.9054 6.9957 7.4545 7.4741 7.7271 7.7450 8.0051 8.0582 8.5992 8.6123 8.8991 8.9783 9.0112 9.0620 9.4679 9.4945 9.8227 9.8281 9.8484 9.8572 10.2441 10.2593 10.2921 10.2935 k = 0.0000 0.2073-0.0000 ( 10871 PWs) bands (ev): -48.2859 -48.2859 -48.2858 -48.2858 -24.9524 -24.9520 -24.9508 -24.9508 -24.3291 -24.3283 -24.3247 -24.3246 -24.2548 -24.2548 -24.2501 -24.2500 -1.7633 -1.7633 -0.5930 -0.5928 0.6204 0.6216 4.9301 4.9609 5.6346 5.6667 5.8941 5.9296 6.1290 6.1296 6.2597 6.3298 6.5152 6.5427 6.6660 6.7220 6.9038 6.9914 7.4576 7.4908 7.7292 7.7477 7.9545 7.9973 8.6384 8.6511 8.8685 8.9316 9.0124 9.0427 9.4800 9.4994 9.8219 9.8280 9.8638 9.8704 10.2199 10.2438 10.3331 10.3414 k = 0.0000 0.2195-0.0000 ( 10875 PWs) bands (ev): -48.2859 -48.2859 -48.2858 -48.2858 -24.9525 -24.9522 -24.9510 -24.9509 -24.3293 -24.3286 -24.3246 -24.3245 -24.2553 -24.2552 -24.2501 -24.2499 -1.7183 -1.7183 -0.5587 -0.5585 0.6334 0.6347 4.8368 4.8689 5.5342 5.5755 5.8966 5.9475 6.1040 6.1066 6.2284 6.3047 6.5147 6.5416 6.6473 6.6984 6.8993 6.9831 7.4581 7.5074 7.7285 7.7492 7.9136 7.9440 8.6778 8.6900 8.8327 8.8830 9.0127 9.0265 9.4919 9.5048 9.8208 9.8274 9.8811 9.8858 10.1990 10.2230 10.3837 10.3936 k = 0.0000 0.2317-0.0000 ( 10875 PWs) bands (ev): -48.2859 -48.2859 -48.2858 -48.2858 -24.9527 -24.9523 -24.9511 -24.9511 -24.3296 -24.3289 -24.3246 -24.3245 -24.2557 -24.2557 -24.2501 -24.2499 -1.6710 -1.6710 -0.5230 -0.5228 0.6451 0.6465 4.7446 4.7780 5.4279 5.4742 5.9007 5.9654 6.0806 6.0851 6.1960 6.2818 6.5145 6.5410 6.6338 6.6795 6.8908 6.9691 7.4548 7.5219 7.7240 7.7496 7.8860 7.9034 8.7163 8.7272 8.7954 8.8353 9.0107 9.0121 9.5024 9.5099 9.8197 9.8264 9.9001 9.9033 10.1822 10.2054 10.4356 10.4467 k = 0.0000 0.2439-0.0000 ( 10885 PWs) bands (ev): -48.2859 -48.2859 -48.2858 -48.2858 -24.9529 -24.9525 -24.9512 -24.9512 -24.3300 -24.3292 -24.3245 -24.3244 -24.2562 -24.2562 -24.2501 -24.2499 -1.6215 -1.6215 -0.4861 -0.4860 0.6551 0.6567 4.6545 4.6893 5.3181 5.3675 5.9024 5.9811 6.0585 6.0656 6.1629 6.2617 6.5145 6.5408 6.6244 6.6639 6.8775 6.9480 7.4484 7.5319 7.7169 7.7502 7.8725 7.8790 8.7383 8.7476 8.7820 8.7953 8.9984 9.0063 9.5111 9.5141 9.8183 9.8251 9.9209 9.9225 10.1698 10.1918 10.4580 10.4686 k = 0.0000 0.2561-0.0000 ( 10879 PWs) bands (ev): -48.2858 -48.2858 -48.2857 -48.2857 -24.9530 -24.9526 -24.9514 -24.9514 -24.3303 -24.3296 -24.3244 -24.3244 -24.2567 -24.2566 -24.2500 -24.2499 -1.5698 -1.5697 -0.4481 -0.4480 0.6631 0.6648 4.5673 4.6036 5.2067 5.2581 5.8994 5.9909 6.0373 6.0484 6.1315 6.2452 6.5146 6.5409 6.6184 6.6503 6.8591 6.9187 7.4411 7.5354 7.7122 7.7529 7.8698 7.8706 8.7014 8.7283 8.8059 8.8150 8.9849 9.0000 9.5169 9.5175 9.8166 9.8234 9.9433 9.9435 10.1617 10.1825 10.4728 10.4847 k = 0.0000 0.2683-0.0000 ( 10881 PWs) bands (ev): -48.2858 -48.2858 -48.2857 -48.2857 -24.9532 -24.9528 -24.9515 -24.9515 -24.3306 -24.3299 -24.3243 -24.3243 -24.2571 -24.2571 -24.2500 -24.2499 -1.5159 -1.5159 -0.4093 -0.4093 0.6686 0.6704 4.4837 4.5216 5.0951 5.1482 5.8896 5.9895 6.0170 6.0308 6.1085 6.2328 6.5146 6.5412 6.6150 6.6377 6.8361 6.8814 7.4362 7.5331 7.7147 7.7590 7.8717 7.8773 8.6588 8.6843 8.8405 8.8520 8.9718 8.9926 9.5180 9.5214 9.8145 9.8213 9.9659 9.9671 10.1579 10.1774 10.4884 10.5016 k = 0.0000 0.2805-0.0000 ( 10881 PWs) bands (ev): -48.2858 -48.2858 -48.2857 -48.2857 -24.9534 -24.9530 -24.9516 -24.9516 -24.3309 -24.3302 -24.3243 -24.3242 -24.2576 -24.2576 -24.2500 -24.2498 -1.4601 -1.4601 -0.3698 -0.3698 0.6713 0.6733 4.4045 4.4442 4.9844 5.0390 5.8715 5.9749 5.9975 6.0049 6.1033 6.2248 6.5142 6.5417 6.6138 6.6250 6.8099 6.8375 7.4363 7.5291 7.7245 7.7680 7.8811 7.8898 8.6154 8.6390 8.8737 8.8854 8.9614 8.9861 9.5174 9.5229 9.8121 9.8188 9.9895 9.9920 10.1579 10.1762 10.5050 10.5195 k = 0.0000 0.2927-0.0000 ( 10873 PWs) bands (ev): -48.2857 -48.2857 -48.2857 -48.2857 -24.9535 -24.9531 -24.9518 -24.9518 -24.3312 -24.3305 -24.3242 -24.3241 -24.2581 -24.2580 -24.2500 -24.2498 -1.4023 -1.4023 -0.3299 -0.3298 0.6708 0.6729 4.3300 4.3718 4.8757 4.9319 5.8441 5.9429 5.9779 5.9787 6.1115 6.2211 6.5130 6.5423 6.6114 6.6142 6.7831 6.7895 7.4423 7.5277 7.7388 7.7791 7.8958 7.9068 8.5723 8.5943 8.8979 8.9031 8.9650 8.9860 9.5150 9.5221 9.8091 9.8157 10.0140 10.0177 10.1615 10.1786 10.5226 10.5385 k = 0.0000 0.3049-0.0000 ( 10873 PWs) bands (ev): -48.2857 -48.2857 -48.2856 -48.2856 -24.9537 -24.9533 -24.9519 -24.9519 -24.3314 -24.3308 -24.3241 -24.3241 -24.2585 -24.2585 -24.2500 -24.2498 -1.3427 -1.3427 -0.2898 -0.2896 0.6667 0.6689 4.2608 4.3049 4.7701 4.8281 5.8071 5.8933 5.9580 5.9607 6.1250 6.2210 6.5102 6.5431 6.5965 6.6157 6.7402 6.7586 7.4544 7.5316 7.7555 7.7915 7.9145 7.9269 8.5296 8.5506 8.8957 8.9041 8.9912 9.0012 9.5109 9.5191 9.8057 9.8122 10.0391 10.0440 10.1683 10.1842 10.5412 10.5584 k = 0.0000 0.3171-0.0000 ( 10889 PWs) bands (ev): -48.2857 -48.2857 -48.2856 -48.2856 -24.9538 -24.9535 -24.9520 -24.9520 -24.3317 -24.3311 -24.3241 -24.3240 -24.2589 -24.2589 -24.2499 -24.2498 -1.2814 -1.2814 -0.2499 -0.2496 0.6588 0.6611 4.1969 4.2436 4.6686 4.7287 5.7607 5.8337 5.9408 5.9435 6.1398 6.2236 6.5045 6.5439 6.5815 6.6180 6.6924 6.7384 7.4720 7.5413 7.7730 7.8049 7.9364 7.9492 8.4877 8.5081 8.8770 8.8938 9.0260 9.0296 9.5054 9.5144 9.8016 9.8080 10.0644 10.0705 10.1776 10.1925 10.5609 10.5794 k = 0.0000 0.3293-0.0000 ( 10887 PWs) bands (ev): -48.2856 -48.2856 -48.2856 -48.2856 -24.9540 -24.9536 -24.9521 -24.9521 -24.3320 -24.3314 -24.3240 -24.3240 -24.2594 -24.2593 -24.2499 -24.2498 -1.2185 -1.2185 -0.2104 -0.2100 0.6468 0.6493 4.1383 4.1877 4.5727 4.6351 5.7055 5.7670 5.9247 5.9272 6.1545 6.2277 6.4944 6.5448 6.5690 6.6194 6.6492 6.7231 7.4945 7.5568 7.7910 7.8190 7.9606 7.9729 8.4467 8.4670 8.8534 8.8748 9.0627 9.0632 9.4986 9.5082 9.7969 9.8031 10.0897 10.0968 10.1892 10.2031 10.5817 10.6014 k = 0.0000 0.3415-0.0000 ( 10893 PWs) bands (ev): -48.2856 -48.2856 -48.2856 -48.2856 -24.9541 -24.9538 -24.9523 -24.9522 -24.3322 -24.3317 -24.3239 -24.3239 -24.2598 -24.2597 -24.2499 -24.2497 -1.1542 -1.1542 -0.1719 -0.1713 0.6307 0.6333 4.0844 4.1366 4.4838 4.5487 5.6426 5.6946 5.9096 5.9118 6.1684 6.2325 6.4800 6.5453 6.5608 6.6018 6.6301 6.7123 7.5211 7.5774 7.8093 7.8339 7.9865 7.9972 8.4066 8.4274 8.8264 8.8507 9.0984 9.0994 9.4910 9.5009 9.7915 9.7976 10.1144 10.1225 10.2026 10.2156 10.6035 10.6244 k = 0.0000 0.3537-0.0000 ( 10877 PWs) bands (ev): -48.2856 -48.2856 -48.2855 -48.2855 -24.9543 -24.9539 -24.9524 -24.9523 -24.3325 -24.3320 -24.3239 -24.3238 -24.2601 -24.2601 -24.2499 -24.2497 -1.0886 -1.0886 -0.1347 -0.1340 0.6105 0.6132 4.0344 4.0889 4.4044 4.4711 5.5732 5.6174 5.8955 5.8974 6.1811 6.2372 6.4634 6.5440 6.5564 6.5700 6.6324 6.7047 7.5512 7.6022 7.8282 7.8497 8.0132 8.0213 8.3677 8.3895 8.7965 8.8227 9.1337 9.1356 9.4827 9.4927 9.7855 9.7914 10.1383 10.1472 10.2174 10.2296 10.6264 10.6485 k = 0.0000 0.3659-0.0000 ( 10883 PWs) bands (ev): -48.2856 -48.2856 -48.2855 -48.2855 -24.9544 -24.9541 -24.9525 -24.9524 -24.3327 -24.3322 -24.3238 -24.3238 -24.2605 -24.2605 -24.2498 -24.2497 -1.0221 -1.0220 -0.0995 -0.0986 0.5864 0.5893 3.9872 4.0425 4.3370 4.4042 5.4986 5.5366 5.8823 5.8840 6.1923 6.2413 6.4471 6.5296 6.5546 6.5546 6.6365 6.6995 7.5842 7.6305 7.8479 7.8667 8.0403 8.0444 8.3298 8.3535 8.7637 8.7914 9.1685 9.1709 9.4741 9.4840 9.7787 9.7845 10.1609 10.1705 10.2333 10.2448 10.6503 10.6735 k = 0.0000 0.3780-0.0000 ( 10871 PWs) bands (ev): -48.2856 -48.2855 -48.2855 -48.2855 -24.9545 -24.9542 -24.9526 -24.9525 -24.3329 -24.3325 -24.3237 -24.3237 -24.2608 -24.2608 -24.2498 -24.2497 -0.9547 -0.9546 -0.0669 -0.0659 0.5591 0.5620 3.9414 3.9950 4.2845 4.3498 5.4204 5.4533 5.8702 5.8716 6.2020 6.2443 6.4328 6.5054 6.5534 6.5541 6.6410 6.6959 7.6194 7.6613 7.8691 7.8850 8.0657 8.0671 8.2931 8.3198 8.7283 8.7570 9.2023 9.2050 9.4654 9.4751 9.7713 9.7768 10.1818 10.1919 10.2500 10.2608 10.6752 10.6994 k = 0.0000 0.3902-0.0000 ( 10859 PWs) bands (ev): -48.2855 -48.2855 -48.2855 -48.2855 -24.9546 -24.9543 -24.9526 -24.9526 -24.3331 -24.3327 -24.3237 -24.3237 -24.2612 -24.2611 -24.2498 -24.2497 -0.8868 -0.8868 -0.0379 -0.0366 0.5291 0.5321 3.8962 3.9453 4.2485 4.3092 5.3399 5.3689 5.8591 5.8604 6.2100 6.2462 6.4212 6.4836 6.5541 6.5545 6.6456 6.6933 7.6561 7.6938 7.8920 7.9051 8.0842 8.0931 8.2577 8.2890 8.6903 8.7198 9.2348 9.2377 9.4569 9.4661 9.7633 9.7686 10.2009 10.2110 10.2674 10.2772 10.7007 10.7258 k = 0.0000 0.4024-0.0000 ( 10857 PWs) bands (ev): -48.2855 -48.2855 -48.2855 -48.2855 -24.9547 -24.9545 -24.9527 -24.9527 -24.3333 -24.3329 -24.3236 -24.3236 -24.2614 -24.2614 -24.2498 -24.2497 -0.8189 -0.8189 -0.0135 -0.0120 0.4976 0.5007 3.8515 3.8940 4.2286 4.2826 5.2588 5.2844 5.8491 5.8502 6.2165 6.2467 6.4125 6.4653 6.5552 6.5552 6.6502 6.6914 7.6937 7.7269 7.9172 7.9270 8.0986 8.1179 8.2237 8.2623 8.6499 8.6800 9.2657 9.2688 9.4488 9.4574 9.7547 9.7598 10.2179 10.2277 10.2848 10.2936 10.7267 10.7523 k = 0.0000 0.4146-0.0000 ( 10861 PWs) bands (ev): -48.2855 -48.2855 -48.2855 -48.2855 -24.9548 -24.9546 -24.9528 -24.9528 -24.3334 -24.3331 -24.3236 -24.3236 -24.2617 -24.2617 -24.2497 -24.2497 -0.7515 -0.7514 0.0051 0.0067 0.4661 0.4693 3.8078 3.8430 4.2226 4.2693 5.1783 5.2012 5.8403 5.8412 6.2216 6.2462 6.4063 6.4503 6.5562 6.5564 6.6546 6.6899 7.7313 7.7598 7.9451 7.9509 8.1069 8.1407 8.1918 8.2417 8.6073 8.6378 9.2948 9.2979 9.4413 9.4492 9.7458 9.7505 10.2328 10.2419 10.3019 10.3095 10.7527 10.7784 k = 0.0000 0.4268-0.0000 ( 10847 PWs) bands (ev): -48.2855 -48.2855 -48.2854 -48.2854 -24.9549 -24.9547 -24.9528 -24.9528 -24.3336 -24.3333 -24.3236 -24.3235 -24.2619 -24.2619 -24.2497 -24.2497 -0.6852 -0.6851 0.0163 0.0181 0.4365 0.4395 3.7664 3.7947 4.2280 4.2676 5.1000 5.1205 5.8326 5.8334 6.2254 6.2449 6.4024 6.4382 6.5572 6.5575 6.6589 6.6885 7.7683 7.7916 7.9755 7.9765 8.1074 8.1508 8.1729 8.2293 8.5629 8.5937 9.3217 9.3248 9.4346 9.4416 9.7366 9.7410 10.2456 10.2538 10.3180 10.3244 10.7781 10.8033 k = 0.0000 0.4390-0.0000 ( 10845 PWs) bands (ev): -48.2855 -48.2855 -48.2854 -48.2854 -24.9549 -24.9548 -24.9529 -24.9529 -24.3337 -24.3334 -24.3235 -24.3235 -24.2621 -24.2621 -24.2497 -24.2496 -0.6210 -0.6208 0.0190 0.0208 0.4107 0.4136 3.7290 3.7511 4.2423 4.2754 5.0256 5.0440 5.8260 5.8267 6.2281 6.2432 6.4002 6.4286 6.5582 6.5586 6.6630 6.6873 7.8039 7.8219 8.0020 8.0073 8.1016 8.1270 8.1889 8.2251 8.5170 8.5479 9.3459 9.3489 9.4289 9.4349 9.7276 9.7316 10.2565 10.2635 10.3326 10.3378 10.8023 10.8260 k = 0.0000 0.4512-0.0000 ( 10848 PWs) bands (ev): -48.2855 -48.2855 -48.2854 -48.2854 -24.9550 -24.9548 -24.9529 -24.9529 -24.3338 -24.3336 -24.3235 -24.3235 -24.2623 -24.2622 -24.2497 -24.2496 -0.5603 -0.5602 0.0127 0.0144 0.3904 0.3929 3.6968 3.7134 4.2628 4.2900 4.9572 4.9733 5.8207 5.8212 6.2301 6.2412 6.3994 6.4211 6.5591 6.5594 6.6667 6.6860 7.8376 7.8504 8.0212 8.0361 8.0980 8.1041 8.2090 8.2271 8.4702 8.5010 9.3670 9.3698 9.4245 9.4292 9.7192 9.7225 10.2654 10.2712 10.3451 10.3492 10.8244 10.8455 k = 0.0000 0.4634-0.0000 ( 10858 PWs) bands (ev): -48.2854 -48.2854 -48.2854 -48.2854 -24.9550 -24.9549 -24.9530 -24.9530 -24.3338 -24.3337 -24.3235 -24.3235 -24.2624 -24.2624 -24.2497 -24.2496 -0.5054 -0.5053 -0.0010 0.0004 0.3762 0.3782 3.6709 3.6828 4.2867 4.3081 4.8974 4.9110 5.8165 5.8169 6.2315 6.2392 6.3995 6.4152 6.5598 6.5601 6.6702 6.6845 7.8692 7.8770 8.0233 8.0441 8.1022 8.1089 8.2301 8.2330 8.4230 8.4537 9.3841 9.3866 9.4214 9.4249 9.7117 9.7144 10.2725 10.2770 10.3553 10.3584 10.8436 10.8609 k = 0.0000 0.4756-0.0000 ( 10860 PWs) bands (ev): -48.2854 -48.2854 -48.2854 -48.2854 -24.9550 -24.9550 -24.9530 -24.9530 -24.3338 -24.3337 -24.3235 -24.3235 -24.2625 -24.2625 -24.2497 -24.2496 -0.4598 -0.4596 -0.0184 -0.0173 0.3675 0.3689 3.6524 3.6600 4.3105 4.3256 4.8501 4.8602 5.8135 5.8138 6.2326 6.2375 6.4004 6.4105 6.5604 6.5606 6.6734 6.6828 7.8981 7.9016 8.0109 8.0263 8.1233 8.1304 8.2435 8.2541 8.3766 8.4068 9.3963 9.3984 9.4202 9.4223 9.7059 9.7078 10.2778 10.2808 10.3630 10.3650 10.8590 10.8713 k = 0.0000 0.4878-0.0000 ( 10860 PWs) bands (ev): -48.2854 -48.2854 -48.2854 -48.2854 -24.9550 -24.9550 -24.9530 -24.9530 -24.3339 -24.3338 -24.3235 -24.3235 -24.2625 -24.2625 -24.2497 -24.2496 -0.4284 -0.4283 -0.0333 -0.0327 0.3631 0.3638 3.6417 3.6454 4.3296 4.3376 4.8199 4.8255 5.8118 5.8119 6.2336 6.2359 6.4020 6.4069 6.5608 6.5609 6.6762 6.6809 7.9222 7.9225 7.9956 8.0044 8.1432 8.1480 8.2624 8.2833 8.3326 8.3617 9.4031 9.4044 9.4209 9.4217 9.7024 9.7033 10.2812 10.2828 10.3678 10.3688 10.8700 10.8764 k = 0.0000 0.5000-0.0000 ( 10866 PWs) bands (ev): -48.2854 -48.2854 -48.2854 -48.2854 -24.9550 -24.9550 -24.9530 -24.9530 -24.3338 -24.3338 -24.3235 -24.3235 -24.2625 -24.2625 -24.2496 -24.2496 -0.4170 -0.4170 -0.0391 -0.0391 0.3621 0.3621 3.6393 3.6393 4.3395 4.3395 4.8112 4.8112 5.8112 5.8112 6.2347 6.2347 6.4041 6.4041 6.5610 6.5610 6.6787 6.6787 7.9332 7.9332 7.9903 7.9903 8.1526 8.1526 8.2921 8.2921 8.3206 8.3206 9.4054 9.4054 9.4218 9.4218 9.7014 9.7014 10.2829 10.2829 10.3698 10.3698 10.8759 10.8759 k = 0.0000 0.5000-0.0000 ( 10866 PWs) bands (ev): -48.2854 -48.2854 -48.2854 -48.2854 -24.9550 -24.9550 -24.9530 -24.9530 -24.3338 -24.3338 -24.3235 -24.3235 -24.2625 -24.2625 -24.2496 -24.2496 -0.4170 -0.4170 -0.0391 -0.0391 0.3621 0.3621 3.6393 3.6393 4.3395 4.3395 4.8112 4.8112 5.8112 5.8112 6.2347 6.2347 6.4041 6.4041 6.5610 6.5610 6.6787 6.6787 7.9332 7.9332 7.9903 7.9903 8.1526 8.1526 8.2921 8.2921 8.3206 8.3206 9.4054 9.4054 9.4218 9.4218 9.7014 9.7014 10.2829 10.2829 10.3698 10.3698 10.8759 10.8759 k = 0.0122 0.5000-0.0000 ( 10856 PWs) bands (ev): -48.2854 -48.2854 -48.2854 -48.2854 -24.9550 -24.9550 -24.9530 -24.9530 -24.3338 -24.3338 -24.3235 -24.3234 -24.2625 -24.2625 -24.2497 -24.2497 -0.4160 -0.4160 -0.0383 -0.0382 0.3627 0.3628 3.6407 3.6409 4.3399 4.3414 4.8107 4.8132 5.8108 5.8111 6.2328 6.2367 6.4041 6.4043 6.5576 6.5645 6.6785 6.6790 7.9273 7.9287 7.9852 7.9909 8.1467 8.1551 8.2883 8.2928 8.3206 8.3252 9.4022 9.4042 9.4181 9.4218 9.6998 9.7003 10.2829 10.2836 10.3702 10.3703 10.8721 10.8799 k = 0.0244 0.5000-0.0000 ( 10860 PWs) bands (ev): -48.2854 -48.2854 -48.2854 -48.2854 -24.9551 -24.9550 -24.9531 -24.9530 -24.3338 -24.3338 -24.3236 -24.3234 -24.2626 -24.2625 -24.2498 -24.2497 -0.4132 -0.4131 -0.0357 -0.0355 0.3646 0.3648 3.6452 3.6455 4.3427 4.3456 4.8116 4.8165 5.8098 5.8105 6.2311 6.2389 6.4043 6.4046 6.5544 6.5681 6.6785 6.6794 7.9119 7.9138 7.9746 7.9877 8.1388 8.1539 8.2846 8.2893 8.3229 8.3340 9.3936 9.3988 9.4117 9.4179 9.6954 9.6965 10.2836 10.2850 10.3716 10.3717 10.8683 10.8840 k = 0.0366 0.5000-0.0000 ( 10860 PWs) bands (ev): -48.2854 -48.2854 -48.2854 -48.2854 -24.9551 -24.9550 -24.9531 -24.9530 -24.3338 -24.3338 -24.3237 -24.3234 -24.2626 -24.2625 -24.2499 -24.2498 -0.4084 -0.4083 -0.0313 -0.0312 0.3679 0.3682 3.6526 3.6531 4.3477 4.3522 4.8138 4.8213 5.8083 5.8094 6.2297 6.2413 6.4046 6.4052 6.5513 6.5719 6.6785 6.6799 7.8875 7.8891 7.9578 7.9806 8.1301 8.1499 8.2820 8.2828 8.3259 8.3440 9.3786 9.3888 9.4034 9.4104 9.6882 9.6898 10.2850 10.2870 10.3739 10.3741 10.8639 10.8882 k = 0.0488 0.5000-0.0000 ( 10870 PWs) bands (ev): -48.2854 -48.2854 -48.2854 -48.2854 -24.9551 -24.9550 -24.9532 -24.9530 -24.3338 -24.3338 -24.3238 -24.3235 -24.2626 -24.2625 -24.2500 -24.2499 -0.4018 -0.4017 -0.0253 -0.0250 0.3724 0.3729 3.6630 3.6637 4.3551 4.3611 4.8174 4.8274 5.8062 5.8076 6.2284 6.2438 6.4051 6.4058 6.5484 6.5758 6.6787 6.6805 7.8547 7.8560 7.9344 7.9687 8.1214 8.1444 8.2745 8.2797 8.3291 8.3529 9.3569 9.3735 9.3933 9.4001 9.6781 9.6802 10.2870 10.2897 10.3770 10.3773 10.8585 10.8921 k = 0.0610 0.5000-0.0000 ( 10862 PWs) bands (ev): -48.2854 -48.2854 -48.2854 -48.2854 -24.9552 -24.9551 -24.9533 -24.9530 -24.3338 -24.3337 -24.3240 -24.3235 -24.2626 -24.2624 -24.2502 -24.2500 -0.3933 -0.3931 -0.0175 -0.0172 0.3783 0.3789 3.6764 3.6772 4.3647 4.3723 4.8222 4.8349 5.8036 5.8053 6.2274 6.2463 6.4056 6.4067 6.5457 6.5797 6.6789 6.6812 7.8142 7.8157 7.9046 7.9514 8.1133 8.1386 8.2646 8.2769 8.3317 8.3595 9.3285 9.3518 9.3813 9.3878 9.6651 9.6676 10.2896 10.2929 10.3809 10.3813 10.8510 10.8948 k = 0.0732 0.5000-0.0000 ( 10854 PWs) bands (ev): -48.2854 -48.2854 -48.2854 -48.2854 -24.9552 -24.9551 -24.9534 -24.9531 -24.3338 -24.3337 -24.3241 -24.3236 -24.2626 -24.2624 -24.2504 -24.2502 -0.3829 -0.3827 -0.0080 -0.0077 0.3854 0.3861 3.6927 3.6938 4.3765 4.3858 4.8282 4.8436 5.8005 5.8024 6.2265 6.2489 6.4062 6.4076 6.5432 6.5838 6.6792 6.6820 7.7669 7.7694 7.8685 7.9281 8.1060 8.1331 8.2536 8.2731 8.3332 8.3631 9.2932 9.3233 9.3676 9.3737 9.6491 9.6520 10.2927 10.2967 10.3855 10.3860 10.8404 10.8947 k = 0.0854 0.5000-0.0000 ( 10848 PWs) bands (ev): -48.2854 -48.2854 -48.2854 -48.2853 -24.9553 -24.9551 -24.9535 -24.9531 -24.3337 -24.3337 -24.3243 -24.3237 -24.2626 -24.2624 -24.2506 -24.2504 -0.3707 -0.3705 0.0031 0.0035 0.3938 0.3945 3.7121 3.7133 4.3904 4.4016 4.8353 4.8536 5.7967 5.7988 6.2258 6.2515 6.4068 6.4086 6.5408 6.5879 6.6796 6.6829 7.7137 7.7183 7.8266 7.8986 8.0996 8.1280 8.2416 8.2681 8.3330 8.3632 9.2507 9.2877 9.3522 9.3582 9.6300 9.6333 10.2963 10.3009 10.3907 10.3912 10.8254 10.8889 k = 0.0976 0.5000-0.0000 ( 10836 PWs) bands (ev): -48.2854 -48.2854 -48.2853 -48.2853 -24.9553 -24.9552 -24.9536 -24.9532 -24.3337 -24.3336 -24.3245 -24.3239 -24.2626 -24.2624 -24.2509 -24.2506 -0.3567 -0.3564 0.0159 0.0163 0.4033 0.4042 3.7343 3.7357 4.4064 4.4195 4.8433 4.8646 5.7924 5.7946 6.2252 6.2539 6.4072 6.4096 6.5386 6.5920 6.6801 6.6839 7.6557 7.6633 7.7791 7.8632 8.0937 8.1232 8.2287 8.2618 8.3307 8.3596 9.2009 9.2447 9.3354 9.3413 9.6077 9.6114 10.3003 10.3055 10.3963 10.3968 10.8049 10.8728 k = 0.1098 0.5000-0.0000 ( 10840 PWs) bands (ev): -48.2853 -48.2853 -48.2853 -48.2853 -24.9554 -24.9552 -24.9538 -24.9533 -24.3336 -24.3336 -24.3247 -24.3240 -24.2626 -24.2623 -24.2512 -24.2509 -0.3408 -0.3406 0.0302 0.0307 0.4140 0.4149 3.7596 3.7611 4.4244 4.4395 4.8522 4.8766 5.7875 5.7897 6.2248 6.2560 6.4074 6.4107 6.5366 6.5962 6.6806 6.6850 7.5938 7.6051 7.7266 7.8221 8.0881 8.1183 8.2150 8.2543 8.3263 8.3522 9.1437 9.1943 9.3174 9.3232 9.5822 9.5862 10.3046 10.3104 10.4023 10.4029 10.7792 10.8435 k = 0.1220 0.5000-0.0000 ( 10844 PWs) bands (ev): -48.2853 -48.2853 -48.2853 -48.2853 -24.9555 -24.9553 -24.9539 -24.9534 -24.3336 -24.3335 -24.3250 -24.3242 -24.2625 -24.2623 -24.2515 -24.2512 -0.3233 -0.3230 0.0462 0.0466 0.4257 0.4268 3.7877 3.7894 4.4443 4.4616 4.8617 4.8895 5.7820 5.7840 6.2243 6.2578 6.4073 6.4116 6.5347 6.6004 6.6811 6.6860 7.5290 7.5446 7.6695 7.7759 8.0826 8.1131 8.2005 8.2457 8.3195 8.3411 9.0793 9.1367 9.2981 9.3038 9.5535 9.5579 10.3090 10.3153 10.4085 10.4091 10.7494 10.8037 k = 0.1341 0.5000-0.0000 ( 10840 PWs) bands (ev): -48.2853 -48.2853 -48.2853 -48.2853 -24.9556 -24.9553 -24.9540 -24.9535 -24.3335 -24.3334 -24.3252 -24.3244 -24.2625 -24.2623 -24.2518 -24.2515 -0.3039 -0.3036 0.0636 0.0641 0.4385 0.4397 3.8187 3.8206 4.4660 4.4857 4.8717 4.9030 5.7758 5.7776 6.2238 6.2591 6.4066 6.4124 6.5330 6.6045 6.6817 6.6871 7.4622 7.4826 7.6084 7.7253 8.0768 8.1072 8.1851 8.2360 8.3105 8.3262 9.0083 9.0722 9.2777 9.2831 9.5215 9.5263 10.3134 10.3203 10.4148 10.4155 10.7176 10.7597 k = 0.1463 0.5000-0.0000 ( 10852 PWs) bands (ev): -48.2853 -48.2853 -48.2852 -48.2852 -24.9556 -24.9554 -24.9542 -24.9536 -24.3335 -24.3334 -24.3255 -24.3246 -24.2625 -24.2623 -24.2522 -24.2519 -0.2830 -0.2826 0.0825 0.0830 0.4523 0.4535 3.8525 3.8546 4.4893 4.5117 4.8820 4.9170 5.7689 5.7703 6.2232 6.2596 6.4053 6.4130 6.5313 6.6085 6.6823 6.6882 7.3943 7.4198 7.5441 7.6711 8.0703 8.1002 8.1689 8.2252 8.2994 8.3077 8.9311 9.0016 9.2560 9.2609 9.4866 9.4920 10.3179 10.3251 10.4212 10.4219 10.6860 10.7166 k = 0.1585 0.5000-0.0000 ( 10856 PWs) bands (ev): -48.2852 -48.2852 -48.2852 -48.2852 -24.9557 -24.9554 -24.9543 -24.9537 -24.3334 -24.3333 -24.3258 -24.3248 -24.2625 -24.2622 -24.2526 -24.2522 -0.2603 -0.2600 0.1029 0.1034 0.4669 0.4681 3.8892 3.8915 4.5141 4.5394 4.8924 4.9313 5.7614 5.7621 6.2223 6.2591 6.4031 6.4134 6.5295 6.6125 6.6829 6.6892 7.3263 7.3570 7.4773 7.6139 8.0631 8.0918 8.1517 8.2134 8.2856 8.2865 8.8488 8.9258 9.2325 9.2366 9.4490 9.4552 10.3222 10.3297 10.4276 10.4284 10.6562 10.6771 k = 0.1707 0.5000-0.0000 ( 10860 PWs) bands (ev): -48.2852 -48.2852 -48.2852 -48.2852 -24.9558 -24.9555 -24.9545 -24.9538 -24.3333 -24.3332 -24.3260 -24.3251 -24.2625 -24.2622 -24.2530 -24.2526 -0.2361 -0.2358 0.1245 0.1250 0.4823 0.4836 3.9287 3.9311 4.5403 4.5687 4.9026 4.9456 5.7529 5.7532 6.2210 6.2573 6.3999 6.4136 6.5276 6.6163 6.6835 6.6901 7.2593 7.2953 7.4090 7.5547 8.0547 8.0816 8.1337 8.2006 8.2599 8.2718 8.7624 8.8462 9.2064 9.2092 9.4097 9.4169 10.3262 10.3340 10.4339 10.4347 10.6293 10.6425 k = 0.1829 0.5000-0.0000 ( 10856 PWs) bands (ev): -48.2852 -48.2852 -48.2852 -48.2852 -24.9559 -24.9556 -24.9547 -24.9540 -24.3332 -24.3331 -24.3263 -24.3253 -24.2625 -24.2622 -24.2534 -24.2530 -0.2104 -0.2101 0.1475 0.1479 0.4984 0.4997 3.9710 3.9736 4.5675 4.5994 4.9124 4.9597 5.7428 5.7443 6.2190 6.2536 6.3952 6.4135 6.5254 6.6198 6.6842 6.6908 7.1942 7.2354 7.3400 7.4945 8.0449 8.0691 8.1146 8.1869 8.2306 8.2555 8.6732 8.7641 9.1762 9.1773 9.3698 9.3785 10.3301 10.3378 10.4401 10.4410 10.6058 10.6131 k = 0.1951 0.5000-0.0000 ( 10852 PWs) bands (ev): -48.2852 -48.2852 -48.2851 -48.2851 -24.9560 -24.9557 -24.9548 -24.9541 -24.3332 -24.3331 -24.3266 -24.3256 -24.2624 -24.2621 -24.2538 -24.2534 -0.1832 -0.1829 0.1716 0.1720 0.5151 0.5165 4.0159 4.0187 4.5956 4.6314 4.9216 4.9733 5.7315 5.7347 6.2160 6.2476 6.3890 6.4133 6.5227 6.6229 6.6848 6.6912 7.1321 7.1783 7.2714 7.4342 8.0335 8.0539 8.0944 8.1722 8.1976 8.2376 8.5827 8.6813 9.1389 9.1399 9.3316 9.3418 10.3338 10.3413 10.4461 10.4471 10.5859 10.5890 k = 0.2073 0.5000-0.0000 ( 10832 PWs) bands (ev): -48.2851 -48.2851 -48.2851 -48.2851 -24.9561 -24.9558 -24.9550 -24.9543 -24.3331 -24.3330 -24.3270 -24.3259 -24.2624 -24.2621 -24.2543 -24.2539 -0.1547 -0.1543 0.1968 0.1972 0.5322 0.5337 4.0635 4.0664 4.6243 4.6643 4.9298 4.9859 5.7192 5.7244 6.2117 6.2387 6.3812 6.4130 6.5191 6.6257 6.6855 6.6912 7.0743 7.1248 7.2046 7.3750 8.0200 8.0357 8.0730 8.1561 8.1605 8.2178 8.4930 8.5997 9.0921 9.0952 9.2970 9.3088 10.3373 10.3446 10.4519 10.4530 10.5694 10.5697 k = 0.2195 0.5000-0.0000 ( 10840 PWs) bands (ev): -48.2851 -48.2851 -48.2851 -48.2851 -24.9562 -24.9559 -24.9552 -24.9544 -24.3330 -24.3329 -24.3273 -24.3262 -24.2624 -24.2621 -24.2547 -24.2543 -0.1248 -0.1244 0.2230 0.2234 0.5498 0.5512 4.1136 4.1168 4.6532 4.6979 4.9367 4.9974 5.7058 5.7135 6.2056 6.2264 6.3716 6.4127 6.5143 6.6278 6.6862 6.6908 7.0216 7.0759 7.1408 7.3178 8.0041 8.0142 8.0501 8.1193 8.1379 8.1954 8.4071 8.5214 9.0361 9.0409 9.2675 9.2803 10.3409 10.3477 10.4575 10.4588 10.5547 10.5561 k = 0.2317 0.5000-0.0000 ( 10848 PWs) bands (ev): -48.2851 -48.2851 -48.2851 -48.2850 -24.9563 -24.9560 -24.9554 -24.9546 -24.3329 -24.3328 -24.3276 -24.3265 -24.2623 -24.2620 -24.2552 -24.2548 -0.0937 -0.0933 0.2501 0.2504 0.5675 0.5689 4.1663 4.1697 4.6820 4.7318 4.9421 5.0072 5.6913 5.7021 6.1973 6.2103 6.3604 6.4125 6.5076 6.6292 6.6869 6.6897 6.9750 7.0321 7.0814 7.2639 7.9852 7.9889 8.0247 8.0745 8.1152 8.1691 8.3298 8.4485 8.9709 8.9770 9.2431 9.2564 10.3446 10.3510 10.4629 10.4644 10.5434 10.5458 k = 0.2439 0.5000-0.0000 ( 10840 PWs) bands (ev): -48.2850 -48.2850 -48.2850 -48.2850 -24.9564 -24.9561 -24.9555 -24.9548 -24.3328 -24.3327 -24.3279 -24.3268 -24.2623 -24.2620 -24.2556 -24.2552 -0.0614 -0.0611 0.2779 0.2782 0.5853 0.5868 4.2215 4.2250 4.7102 4.7656 4.9457 5.0150 5.6758 5.6904 6.1863 6.1904 6.3481 6.4124 6.4986 6.6298 6.6875 6.6880 6.9351 6.9938 7.0282 7.2144 7.9592 7.9617 7.9941 8.0297 8.0823 8.1394 8.2680 8.3826 8.8974 8.9045 9.2230 9.2363 10.3486 10.3546 10.4681 10.4697 10.5353 10.5379 k = 0.2561 0.5000-0.0000 ( 10838 PWs) bands (ev): -48.2850 -48.2850 -48.2850 -48.2850 -24.9565 -24.9562 -24.9557 -24.9550 -24.3327 -24.3326 -24.3282 -24.3271 -24.2623 -24.2619 -24.2561 -24.2557 -0.0281 -0.0278 0.3064 0.3067 0.6031 0.6045 4.2789 4.2827 4.7372 4.7987 4.9471 5.0204 5.6595 5.6784 6.1670 6.1722 6.3351 6.4121 6.4870 6.6295 6.6855 6.6879 6.9019 6.9611 6.9827 7.1705 7.9233 7.9273 7.9561 7.9931 8.0337 8.1112 8.2248 8.3250 8.8168 8.8248 9.2064 9.2193 10.3532 10.3588 10.4729 10.4748 10.5298 10.5321 k = 0.2683 0.5000-0.0000 ( 10836 PWs) bands (ev): -48.2850 -48.2850 -48.2850 -48.2850 -24.9566 -24.9562 -24.9559 -24.9551 -24.3327 -24.3326 -24.3285 -24.3274 -24.2622 -24.2619 -24.2565 -24.2561 0.0061 0.0064 0.3354 0.3356 0.6206 0.6220 4.3386 4.3425 4.7627 4.8304 4.9462 5.0230 5.6427 5.6664 6.1407 6.1553 6.3218 6.4108 6.4732 6.6282 6.6823 6.6880 6.8751 6.9338 6.9462 7.1334 7.8732 7.8778 7.9220 7.9633 7.9773 8.0861 8.1950 8.2757 8.7302 8.7390 9.1925 9.2049 10.3584 10.3637 10.4776 10.4797 10.5263 10.5281 k = 0.2805 0.5000-0.0000 ( 10828 PWs) bands (ev): -48.2849 -48.2849 -48.2849 -48.2849 -24.9567 -24.9563 -24.9561 -24.9553 -24.3326 -24.3325 -24.3288 -24.3277 -24.2622 -24.2619 -24.2570 -24.2566 0.0411 0.0414 0.3648 0.3649 0.6377 0.6391 4.4004 4.4045 4.7859 4.8600 4.9428 5.0225 5.6257 5.6545 6.1126 6.1360 6.3086 6.4063 6.4594 6.6258 6.6786 6.6877 6.8539 6.9114 6.9195 7.1038 7.8082 7.8198 7.8896 7.9254 7.9351 8.0616 8.1722 8.2338 8.6384 8.6483 9.1807 9.1925 10.3644 10.3696 10.4819 10.4843 10.5244 10.5256 k = 0.2927 0.5000-0.0000 ( 10828 PWs) bands (ev): -48.2849 -48.2849 -48.2849 -48.2849 -24.9568 -24.9564 -24.9562 -24.9555 -24.3325 -24.3324 -24.3291 -24.3281 -24.2621 -24.2619 -24.2574 -24.2570 0.0768 0.0770 0.3943 0.3944 0.6542 0.6555 4.4641 4.4685 4.8062 4.8866 4.9368 5.0186 5.6092 5.6432 6.0841 6.1152 6.2957 6.3949 6.4499 6.6222 6.6747 6.6868 6.8374 6.8932 6.9025 7.0823 7.7396 7.7521 7.8556 7.8806 7.9069 8.0365 8.1530 8.1981 8.5426 8.5538 9.1708 9.1818 10.3712 10.3765 10.4859 10.4887 10.5237 10.5242 k = 0.3049 0.5000-0.0000 ( 10812 PWs) bands (ev): -48.2849 -48.2849 -48.2849 -48.2849 -24.9568 -24.9565 -24.9564 -24.9557 -24.3324 -24.3323 -24.3294 -24.3284 -24.2621 -24.2618 -24.2578 -24.2575 0.1131 0.1133 0.4238 0.4239 0.6699 0.6713 4.5296 4.5342 4.8232 4.9091 4.9281 5.0112 5.5937 5.6324 6.0565 6.0944 6.2831 6.3755 6.4466 6.6175 6.6708 6.6856 6.8248 6.8785 6.8944 7.0690 7.6703 7.6808 7.8194 7.8398 7.8781 8.0100 8.1355 8.1674 8.4437 8.4568 9.1624 9.1726 10.3789 10.3844 10.4897 10.4928 10.5237 10.5240 k = 0.3171 0.5000-0.0000 ( 10822 PWs) bands (ev): -48.2848 -48.2848 -48.2848 -48.2848 -24.9569 -24.9566 -24.9565 -24.9558 -24.3323 -24.3323 -24.3297 -24.3287 -24.2621 -24.2618 -24.2582 -24.2579 0.1497 0.1498 0.4532 0.4532 0.6847 0.6860 4.5965 4.6014 4.8364 4.9168 4.9266 5.0003 5.5798 5.6222 6.0311 6.0750 6.2708 6.3517 6.4475 6.6118 6.6671 6.6842 6.8152 6.8666 6.8938 7.0637 7.6021 7.6099 7.7814 7.8004 7.8484 7.9816 8.1188 8.1404 8.3427 8.3585 9.1554 9.1647 10.3874 10.3933 10.4932 10.4966 10.5240 10.5251 k = 0.3293 0.5000-0.0000 ( 10818 PWs) bands (ev): -48.2848 -48.2848 -48.2848 -48.2848 -24.9570 -24.9567 -24.9567 -24.9560 -24.3323 -24.3322 -24.3299 -24.3290 -24.2620 -24.2618 -24.2586 -24.2583 0.1865 0.1867 0.4821 0.4822 0.6984 0.6996 4.6644 4.6699 4.8456 4.9033 4.9381 4.9862 5.5682 5.6126 6.0094 6.0584 6.2588 6.3267 6.4505 6.6054 6.6637 6.6826 6.8079 6.8568 6.8995 7.0656 7.5363 7.5417 7.7419 7.7614 7.8176 7.9503 8.1024 8.1160 8.2410 8.2609 9.1496 9.1580 10.3968 10.4031 10.4964 10.5001 10.5250 10.5267 k = 0.3415 0.5000-0.0000 ( 10818 PWs) bands (ev): -48.2848 -48.2848 -48.2848 -48.2848 -24.9571 -24.9568 -24.9568 -24.9562 -24.3322 -24.3321 -24.3301 -24.3293 -24.2620 -24.2617 -24.2590 -24.2587 0.2234 0.2235 0.5105 0.5106 0.7107 0.7119 4.7326 4.7393 4.8510 4.8879 4.9425 4.9698 5.5588 5.6032 5.9925 6.0458 6.2474 6.3023 6.4546 6.5986 6.6606 6.6811 6.8021 6.8483 6.9104 7.0740 7.4738 7.4773 7.7014 7.7225 7.7855 7.9150 8.0850 8.0913 8.1419 8.1674 9.1450 9.1525 10.4067 10.4135 10.4993 10.5032 10.5266 10.5288 k = 0.3537 0.5000-0.0000 ( 10826 PWs) bands (ev): -48.2848 -48.2848 -48.2848 -48.2848 -24.9572 -24.9569 -24.9569 -24.9563 -24.3321 -24.3321 -24.3304 -24.3296 -24.2619 -24.2617 -24.2594 -24.2591 0.2602 0.2602 0.5380 0.5382 0.7216 0.7227 4.7981 4.8089 4.8542 4.8722 4.9370 4.9544 5.5516 5.5938 5.9815 6.0383 6.2367 6.2798 6.4594 6.5917 6.6580 6.6795 6.7970 6.8404 6.9258 7.0878 7.4153 7.4174 7.6604 7.6833 7.7517 7.8729 8.0300 8.0549 8.0829 8.0931 9.1413 9.1479 10.4172 10.4244 10.5018 10.5059 10.5286 10.5312 k = 0.3659 0.5000-0.0000 ( 10822 PWs) bands (ev): -48.2847 -48.2847 -48.2847 -48.2847 -24.9572 -24.9570 -24.9570 -24.9565 -24.3320 -24.3320 -24.3306 -24.3298 -24.2619 -24.2617 -24.2597 -24.2594 0.2966 0.2966 0.5646 0.5648 0.7307 0.7318 4.8345 4.8505 4.8771 4.8878 4.9204 4.9437 5.5458 5.5841 5.9772 6.0362 6.2272 6.2597 6.4646 6.5849 6.6556 6.6779 6.7922 6.8327 6.9449 7.1063 7.3613 7.3625 7.6192 7.6440 7.7155 7.8200 7.9352 7.9897 8.0622 8.0658 9.1385 9.1442 10.4280 10.4356 10.5041 10.5082 10.5313 10.5341 k = 0.3780 0.5000-0.0000 ( 10826 PWs) bands (ev): -48.2847 -48.2847 -48.2847 -48.2847 -24.9573 -24.9571 -24.9571 -24.9566 -24.3320 -24.3320 -24.3308 -24.3301 -24.2618 -24.2617 -24.2600 -24.2598 0.3323 0.3324 0.5899 0.5902 0.7381 0.7391 4.8263 4.8404 4.8944 4.9266 4.9502 4.9540 5.5409 5.5740 5.9799 6.0397 6.2189 6.2422 6.4700 6.5784 6.6536 6.6761 6.7869 6.8245 6.9671 7.1283 7.3121 7.3129 7.5780 7.6042 7.6758 7.7542 7.8439 7.9284 8.0455 8.0500 9.1366 9.1414 10.4388 10.4466 10.5059 10.5099 10.5344 10.5374 k = 0.3902 0.5000-0.0000 ( 10818 PWs) bands (ev): -48.2847 -48.2847 -48.2847 -48.2847 -24.9574 -24.9572 -24.9572 -24.9568 -24.3320 -24.3319 -24.3309 -24.3303 -24.2618 -24.2617 -24.2603 -24.2601 0.3672 0.3673 0.6137 0.6140 0.7435 0.7445 4.8081 4.8325 4.8703 4.9140 5.0167 5.0183 5.5365 5.5639 5.9894 6.0481 6.2124 6.2275 6.4757 6.5722 6.6518 6.6741 6.7808 6.8153 6.9918 7.1527 7.2686 7.2689 7.5361 7.5631 7.6307 7.6799 7.7624 7.8785 8.0308 8.0363 9.1353 9.1393 10.4493 10.4571 10.5073 10.5111 10.5383 10.5413 k = 0.4024 0.5000-0.0000 ( 10812 PWs) bands (ev): -48.2847 -48.2847 -48.2847 -48.2847 -24.9574 -24.9573 -24.9572 -24.9569 -24.3319 -24.3319 -24.3311 -24.3305 -24.2618 -24.2617 -24.2605 -24.2604 0.4011 0.4012 0.6358 0.6361 0.7470 0.7478 4.7891 4.8236 4.8453 4.8972 5.0815 5.0827 5.5327 5.5543 6.0049 6.0603 6.2078 6.2156 6.4815 6.5663 6.6503 6.6718 6.7735 6.8048 7.0181 7.1764 7.2309 7.2330 7.4917 7.5182 7.5797 7.6067 7.6953 7.8357 8.0176 8.0237 9.1345 9.1379 10.4592 10.4668 10.5080 10.5116 10.5428 10.5459 k = 0.4146 0.5000-0.0000 ( 10800 PWs) bands (ev): -48.2847 -48.2847 -48.2847 -48.2847 -24.9575 -24.9574 -24.9573 -24.9570 -24.3319 -24.3318 -24.3312 -24.3308 -24.2618 -24.2617 -24.2607 -24.2606 0.4335 0.4336 0.6559 0.6563 0.7483 0.7491 4.7709 4.8142 4.8206 4.8792 5.1426 5.1431 5.5304 5.5464 6.0249 6.0748 6.2055 6.2063 6.4874 6.5607 6.6491 6.6693 6.7647 6.7926 7.0449 7.1797 7.1996 7.2244 7.4405 7.4642 7.5298 7.5454 7.6426 7.7965 8.0060 8.0122 9.1343 9.1370 10.4681 10.4751 10.5080 10.5112 10.5481 10.5511 k = 0.4268 0.5000-0.0000 ( 10808 PWs) bands (ev): -48.2846 -48.2846 -48.2846 -48.2846 -24.9575 -24.9574 -24.9573 -24.9571 -24.3319 -24.3318 -24.3312 -24.3309 -24.2617 -24.2617 -24.2609 -24.2608 0.4641 0.4643 0.6739 0.6742 0.7477 0.7485 4.7542 4.7971 4.8052 4.8611 5.1973 5.1979 5.5306 5.5413 6.0476 6.0896 6.1998 6.2059 6.4934 6.5555 6.6484 6.6665 6.7542 6.7785 7.0696 7.1566 7.1767 7.2474 7.3811 7.4016 7.4898 7.5001 7.5994 7.7589 7.9959 8.0019 9.1344 9.1365 10.4758 10.4820 10.5072 10.5100 10.5541 10.5571 k = 0.4390 0.5000-0.0000 ( 10794 PWs) bands (ev): -48.2846 -48.2846 -48.2846 -48.2846 -24.9576 -24.9575 -24.9574 -24.9572 -24.3319 -24.3318 -24.3313 -24.3311 -24.2618 -24.2617 -24.2610 -24.2610 0.4924 0.4926 0.6896 0.6898 0.7453 0.7460 4.7395 4.7756 4.7971 4.8438 5.2431 5.2449 5.5346 5.5406 6.0708 6.1031 6.1963 6.2089 6.4996 6.5506 6.6482 6.6637 6.7421 6.7628 7.0866 7.1333 7.1667 7.2746 7.3194 7.3396 7.4602 7.4652 7.5627 7.7222 7.9873 7.9928 9.1347 9.1363 10.4822 10.4874 10.5055 10.5080 10.5606 10.5633 k = 0.4512 0.5000-0.0000 ( 10800 PWs) bands (ev): -48.2846 -48.2846 -48.2846 -48.2846 -24.9576 -24.9575 -24.9574 -24.9573 -24.3319 -24.3318 -24.3314 -24.3312 -24.2618 -24.2617 -24.2611 -24.2611 0.5179 0.5181 0.7026 0.7029 0.7414 0.7420 4.7275 4.7565 4.7906 4.8279 5.2787 5.2817 5.5429 5.5452 6.0922 6.1140 6.1962 6.2139 6.5060 6.5463 6.6488 6.6611 6.7288 6.7457 7.0900 7.1137 7.1720 7.2617 7.2880 7.3004 7.4366 7.4376 7.5330 7.6859 7.9804 7.9850 9.1351 9.1363 10.4872 10.4912 10.5033 10.5054 10.5671 10.5691 k = 0.4634 0.5000-0.0000 ( 10808 PWs) bands (ev): -48.2846 -48.2846 -48.2846 -48.2846 -24.9576 -24.9575 -24.9575 -24.9574 -24.3319 -24.3318 -24.3314 -24.3313 -24.2618 -24.2617 -24.2612 -24.2612 0.5398 0.5400 0.7130 0.7132 0.7365 0.7370 4.7185 4.7403 4.7861 4.8141 5.3039 5.3073 5.5544 5.5546 6.1094 6.1220 6.1997 6.2193 6.5126 6.5425 6.6504 6.6591 6.7151 6.7283 7.0852 7.0983 7.1766 7.2133 7.2606 7.3211 7.4129 7.4172 7.5147 7.6501 7.9751 7.9787 9.1356 9.1364 10.4909 10.4937 10.5010 10.5025 10.5730 10.5739 k = 0.4756 0.5000-0.0000 ( 10808 PWs) bands (ev): -48.2846 -48.2846 -48.2846 -48.2846 -24.9576 -24.9575 -24.9575 -24.9574 -24.3319 -24.3318 -24.3314 -24.3314 -24.2618 -24.2618 -24.2613 -24.2612 0.5571 0.5573 0.7204 0.7206 0.7317 0.7320 4.7129 4.7274 4.7839 4.8026 5.3198 5.3227 5.5655 5.5667 6.1212 6.1272 6.2063 6.2231 6.5192 6.5390 6.6532 6.6583 6.7024 6.7118 7.0796 7.0869 7.1637 7.1766 7.2688 7.3355 7.3935 7.3942 7.5129 7.6151 7.9715 7.9739 9.1360 9.1365 10.4934 10.4947 10.4994 10.5000 10.5769 10.5772 k = 0.4878 0.5000-0.0000 ( 10808 PWs) bands (ev): -48.2846 -48.2846 -48.2846 -48.2846 -24.9576 -24.9576 -24.9575 -24.9575 -24.3319 -24.3318 -24.3314 -24.3314 -24.2618 -24.2618 -24.2613 -24.2613 0.5683 0.5684 0.7249 0.7249 0.7281 0.7283 4.7109 4.7182 4.7844 4.7937 5.3286 5.3302 5.5746 5.5755 6.1277 6.1299 6.2141 6.2237 6.5255 6.5354 6.6567 6.6586 6.6932 6.6984 7.0763 7.0796 7.1487 7.1533 7.2945 7.3407 7.3717 7.3785 7.5271 7.5818 7.9695 7.9708 9.1363 9.1366 10.4944 10.4946 10.4987 10.4988 10.5781 10.5788 k = 0.5000 0.5000-0.0000 ( 10828 PWs) bands (ev): -48.2846 -48.2846 -48.2846 -48.2846 -24.9576 -24.9576 -24.9575 -24.9575 -24.3319 -24.3319 -24.3314 -24.3314 -24.2618 -24.2618 -24.2613 -24.2613 0.5723 0.5723 0.7259 0.7259 0.7273 0.7273 4.7126 4.7126 4.7877 4.7877 5.3319 5.3319 5.5784 5.5784 6.1303 6.1303 6.2205 6.2205 6.5310 6.5310 6.6588 6.6588 6.6912 6.6912 7.0761 7.0761 7.1442 7.1442 7.3232 7.3232 7.3684 7.3684 7.5516 7.5516 7.9693 7.9693 9.1365 9.1365 10.4944 10.4944 10.4986 10.4986 10.5787 10.5787 k = 0.5000 0.5000-0.0000 ( 10828 PWs) bands (ev): -48.2846 -48.2846 -48.2846 -48.2846 -24.9576 -24.9576 -24.9575 -24.9575 -24.3319 -24.3319 -24.3314 -24.3314 -24.2618 -24.2618 -24.2613 -24.2613 0.5723 0.5723 0.7259 0.7259 0.7273 0.7273 4.7126 4.7126 4.7877 4.7877 5.3319 5.3319 5.5784 5.5784 6.1303 6.1303 6.2205 6.2205 6.5310 6.5310 6.6588 6.6588 6.6912 6.6912 7.0761 7.0761 7.1442 7.1442 7.3232 7.3232 7.3684 7.3684 7.5516 7.5516 7.9693 7.9693 9.1365 9.1365 10.4944 10.4944 10.4986 10.4986 10.5787 10.5787 k = 0.4912 0.4912-0.0000 ( 10812 PWs) bands (ev): -48.2846 -48.2846 -48.2846 -48.2846 -24.9576 -24.9576 -24.9575 -24.9575 -24.3319 -24.3318 -24.3314 -24.3314 -24.2618 -24.2618 -24.2613 -24.2613 0.5682 0.5683 0.7257 0.7257 0.7274 0.7274 4.7109 4.7183 4.7844 4.7939 5.3286 5.3302 5.5744 5.5755 6.1276 6.1299 6.2135 6.2241 6.5254 6.5354 6.6571 6.6583 6.6932 6.6987 7.0763 7.0793 7.1496 7.1532 7.2933 7.3443 7.3663 7.3815 7.5268 7.5824 7.9696 7.9708 9.1363 9.1366 10.4943 10.4945 10.4985 10.4991 10.5780 10.5790 k = 0.4825 0.4825-0.0000 ( 10784 PWs) bands (ev): -48.2846 -48.2846 -48.2846 -48.2846 -24.9576 -24.9575 -24.9575 -24.9574 -24.3319 -24.3318 -24.3314 -24.3314 -24.2618 -24.2618 -24.2613 -24.2612 0.5560 0.5562 0.7243 0.7245 0.7284 0.7286 4.7131 4.7277 4.7842 4.8030 5.3200 5.3230 5.5641 5.5666 6.1203 6.1267 6.2032 6.2263 6.5190 6.5385 6.6554 6.6569 6.7021 6.7129 7.0786 7.0835 7.1716 7.1738 7.2658 7.3535 7.3706 7.4026 7.5139 7.6164 7.9716 7.9741 9.1360 9.1365 10.4923 10.4937 10.4997 10.5016 10.5761 10.5785 k = 0.4737 0.4737-0.0000 ( 10784 PWs) bands (ev): -48.2846 -48.2846 -48.2846 -48.2846 -24.9576 -24.9575 -24.9575 -24.9574 -24.3319 -24.3317 -24.3314 -24.3313 -24.2618 -24.2617 -24.2613 -24.2612 0.5363 0.5366 0.7212 0.7216 0.7305 0.7308 4.7190 4.7402 4.7874 4.8149 5.3058 5.3096 5.5497 5.5543 6.1067 6.1187 6.1919 6.2295 6.5122 6.5403 6.6558 6.6571 6.7138 6.7306 7.0807 7.0862 7.1873 7.2088 7.2621 7.3579 7.3807 7.4194 7.5209 7.6523 7.9754 7.9790 9.1357 9.1365 10.4877 10.4904 10.5034 10.5063 10.5729 10.5765 k = 0.4649 0.4649-0.0000 ( 10778 PWs) bands (ev): -48.2846 -48.2846 -48.2846 -48.2846 -24.9576 -24.9575 -24.9574 -24.9573 -24.3319 -24.3317 -24.3313 -24.3313 -24.2618 -24.2616 -24.2612 -24.2611 0.5097 0.5100 0.7163 0.7168 0.7335 0.7339 4.7284 4.7544 4.7952 4.8296 5.2857 5.2894 5.5340 5.5417 6.0860 6.1021 6.1840 6.2353 6.5051 6.5414 6.6585 6.6594 6.7262 6.7497 7.0816 7.0876 7.1716 7.2516 7.3013 7.3632 7.4005 7.4354 7.5468 7.6893 7.9810 7.9856 9.1354 9.1366 10.4800 10.4844 10.5091 10.5127 10.5701 10.5739 k = 0.4561 0.4561-0.0000 ( 10787 PWs) bands (ev): -48.2846 -48.2846 -48.2846 -48.2846 -24.9576 -24.9575 -24.9573 -24.9573 -24.3319 -24.3316 -24.3313 -24.3313 -24.2617 -24.2616 -24.2611 -24.2610 0.4767 0.4770 0.7092 0.7097 0.7373 0.7378 4.7409 4.7681 4.8092 4.8466 5.2599 5.2630 5.5194 5.5315 6.0587 6.0748 6.1820 6.2445 6.4981 6.5421 6.6629 6.6633 6.7376 6.7684 7.0811 7.0883 7.1484 7.2786 7.3486 7.3806 7.4419 7.4665 7.5829 7.7271 7.9883 7.9937 9.1354 9.1369 10.4688 10.4751 10.5166 10.5208 10.5691 10.5723 k = 0.4474 0.4474-0.0000 ( 10795 PWs) bands (ev): -48.2846 -48.2846 -48.2846 -48.2846 -24.9575 -24.9574 -24.9573 -24.9572 -24.3319 -24.3315 -24.3312 -24.3312 -24.2617 -24.2615 -24.2611 -24.2609 0.4379 0.4382 0.6997 0.7002 0.7418 0.7424 4.7564 4.7796 4.8303 4.8653 5.2299 5.2322 5.5070 5.5248 6.0262 6.0388 6.1850 6.2567 6.4912 6.5430 6.6684 6.6685 6.7471 6.7850 7.0790 7.0886 7.1287 7.2814 7.3819 7.4080 7.5153 7.5259 7.6247 7.7658 7.9974 8.0034 9.1358 9.1378 10.4543 10.4625 10.5256 10.5304 10.5707 10.5730 k = 0.4386 0.4386-0.0000 ( 10793 PWs) bands (ev): -48.2847 -48.2847 -48.2847 -48.2847 -24.9575 -24.9574 -24.9572 -24.9571 -24.3319 -24.3315 -24.3311 -24.3311 -24.2616 -24.2613 -24.2610 -24.2608 0.3937 0.3940 0.6876 0.6882 0.7471 0.7478 4.7743 4.7893 4.8570 4.8845 5.1984 5.2005 5.4969 5.5216 5.9899 5.9962 6.1911 6.2715 6.4845 6.5442 6.6745 6.6745 6.7541 6.7977 7.0754 7.0887 7.1158 7.2749 7.4071 7.4335 7.6066 7.6100 7.6738 7.8054 8.0082 8.0146 9.1369 9.1394 10.4370 10.4468 10.5362 10.5413 10.5754 10.5765 k = 0.4298 0.4298-0.0000 ( 10795 PWs) bands (ev): -48.2847 -48.2847 -48.2847 -48.2847 -24.9574 -24.9573 -24.9571 -24.9570 -24.3319 -24.3314 -24.3311 -24.3310 -24.2615 -24.2612 -24.2609 -24.2607 0.3447 0.3450 0.6730 0.6736 0.7530 0.7538 4.7944 4.7974 4.8874 4.9016 5.1687 5.1725 5.4883 5.5216 5.9491 5.9514 6.1990 6.2883 6.4778 6.5459 6.6807 6.6807 6.7585 6.8053 7.0725 7.0888 7.1094 7.2679 7.4312 7.4579 7.6812 7.7154 7.7460 7.8469 8.0207 8.0273 9.1386 9.1417 10.4177 10.4286 10.5482 10.5535 10.5830 10.5832 k = 0.4211 0.4211-0.0000 ( 10801 PWs) bands (ev): -48.2847 -48.2847 -48.2847 -48.2847 -24.9574 -24.9572 -24.9570 -24.9569 -24.3318 -24.3313 -24.3310 -24.3309 -24.2614 -24.2611 -24.2607 -24.2605 0.2913 0.2916 0.6558 0.6564 0.7594 0.7603 4.8034 4.8161 4.9130 4.9195 5.1448 5.1542 5.4802 5.5240 5.8986 5.9122 6.2080 6.3067 6.4711 6.5482 6.6863 6.6866 6.7607 6.8077 7.0731 7.0888 7.1079 7.2638 7.4560 7.4826 7.7352 7.8220 7.8489 7.8953 8.0350 8.0418 9.1413 9.1451 10.3970 10.4087 10.5617 10.5669 10.5931 10.5939 k = 0.4123 0.4123-0.0000 ( 10809 PWs) bands (ev): -48.2847 -48.2847 -48.2847 -48.2847 -24.9573 -24.9572 -24.9568 -24.9568 -24.3318 -24.3312 -24.3309 -24.3309 -24.2612 -24.2609 -24.2606 -24.2604 0.2340 0.2342 0.6360 0.6366 0.7662 0.7672 4.8062 4.8381 4.9156 4.9509 5.1316 5.1512 5.4714 5.5280 5.8462 5.8739 6.2175 6.3262 6.4643 6.5511 6.6905 6.6909 6.7621 6.8062 7.0770 7.0888 7.1108 7.2635 7.4820 7.5079 7.7827 7.9021 7.9633 7.9744 8.0523 8.0595 9.1450 9.1495 10.3754 10.3875 10.5767 10.5809 10.6064 10.6081 k = 0.4035 0.4035-0.0000 ( 10815 PWs) bands (ev): -48.2848 -48.2848 -48.2847 -48.2847 -24.9572 -24.9571 -24.9567 -24.9566 -24.3318 -24.3311 -24.3307 -24.3307 -24.2611 -24.2607 -24.2605 -24.2602 0.1731 0.1733 0.6135 0.6141 0.7734 0.7745 4.8046 4.8560 4.9131 4.9791 5.1338 5.1652 5.4604 5.5329 5.7929 5.8382 6.2271 6.3467 6.4574 6.5544 6.6921 6.6924 6.7648 6.8032 7.0816 7.0888 7.1193 7.2672 7.5090 7.5338 7.8289 7.9521 8.0561 8.0565 8.1025 8.1053 9.1497 9.1550 10.3535 10.3657 10.5930 10.5946 10.6210 10.6228 k = 0.3947 0.3947-0.0000 ( 10815 PWs) bands (ev): -48.2848 -48.2848 -48.2848 -48.2848 -24.9571 -24.9570 -24.9566 -24.9565 -24.3317 -24.3310 -24.3306 -24.3306 -24.2609 -24.2605 -24.2603 -24.2600 0.1091 0.1093 0.5886 0.5892 0.7808 0.7820 4.7981 4.8578 4.9214 5.0029 5.1534 5.1930 5.4462 5.5375 5.7407 5.8068 6.2365 6.3677 6.4503 6.5581 6.6890 6.6908 6.7705 6.8016 7.0845 7.0889 7.1341 7.2746 7.5365 7.5598 7.8748 7.9963 8.0796 8.0842 8.2204 8.2207 9.1556 9.1618 10.3315 10.3436 10.6041 10.6106 10.6205 10.6299 k = 0.3860 0.3860-0.0000 ( 10829 PWs) bands (ev): -48.2848 -48.2848 -48.2848 -48.2848 -24.9570 -24.9568 -24.9564 -24.9563 -24.3316 -24.3309 -24.3305 -24.3305 -24.2608 -24.2603 -24.2601 -24.2598 0.0425 0.0426 0.5611 0.5617 0.7883 0.7896 4.7878 4.8433 4.9451 5.0245 5.1875 5.2303 5.4277 5.5394 5.6925 5.7812 6.2455 6.3891 6.4429 6.5620 6.6818 6.6856 6.7798 6.8033 7.0858 7.0890 7.1536 7.2852 7.5640 7.5853 7.9206 8.0399 8.0991 8.1046 8.3453 8.3456 9.1627 9.1698 10.3096 10.3215 10.6066 10.6173 10.6305 10.6439 k = 0.3772 0.3772-0.0000 ( 10821 PWs) bands (ev): -48.2848 -48.2848 -48.2848 -48.2848 -24.9569 -24.9567 -24.9563 -24.9562 -24.3315 -24.3308 -24.3304 -24.3304 -24.2606 -24.2601 -24.2599 -24.2596 -0.0264 -0.0263 0.5312 0.5318 0.7958 0.7971 4.7757 4.8246 4.9755 5.0467 5.2313 5.2738 5.4048 5.5331 5.6545 5.7623 6.2540 6.4105 6.4355 6.5661 6.6715 6.6774 6.7923 6.8087 7.0863 7.0892 7.1761 7.2985 7.5910 7.6099 7.9661 8.0838 8.1189 8.1256 8.4705 8.4708 9.1710 9.1791 10.2881 10.2996 10.6047 10.6139 10.6506 10.6621 k = 0.3684 0.3684-0.0000 ( 10833 PWs) bands (ev): -48.2849 -48.2849 -48.2849 -48.2849 -24.9568 -24.9566 -24.9561 -24.9560 -24.3315 -24.3306 -24.3303 -24.3302 -24.2604 -24.2599 -24.2597 -24.2594 -0.0972 -0.0971 0.4990 0.4996 0.8030 0.8045 4.7640 4.8070 5.0091 5.0705 5.2814 5.3208 5.3782 5.5120 5.6348 5.7500 6.2619 6.4254 6.4345 6.5699 6.6596 6.6677 6.8072 6.8174 7.0863 7.0895 7.2005 7.3140 7.6167 7.6329 8.0108 8.1281 8.1395 8.1483 8.5940 8.5944 9.1804 9.1896 10.2670 10.2781 10.6005 10.6091 10.6718 10.6824 k = 0.3596 0.3596-0.0000 ( 10829 PWs) bands (ev): -48.2849 -48.2849 -48.2849 -48.2849 -24.9566 -24.9564 -24.9560 -24.9558 -24.3314 -24.3305 -24.3301 -24.3301 -24.2602 -24.2597 -24.2595 -24.2592 -0.1696 -0.1695 0.4646 0.4652 0.8100 0.8115 4.7542 4.7925 5.0450 5.0954 5.3352 5.3502 5.3672 5.4804 5.6323 5.7439 6.2692 6.4186 6.4551 6.5731 6.6470 6.6581 6.8240 6.8287 7.0862 7.0900 7.2259 7.3313 7.6406 7.6537 8.0538 8.1597 8.1737 8.1743 8.7144 8.7148 9.1910 9.2013 10.2463 10.2569 10.5948 10.6031 10.6940 10.7039 k = 0.3509 0.3509-0.0000 ( 10823 PWs) bands (ev): -48.2849 -48.2849 -48.2849 -48.2849 -24.9565 -24.9563 -24.9558 -24.9557 -24.3313 -24.3303 -24.3300 -24.3300 -24.2599 -24.2594 -24.2593 -24.2589 -0.2431 -0.2430 0.4281 0.4286 0.8165 0.8181 4.7477 4.7823 5.0823 5.1192 5.3232 5.3925 5.3926 5.4667 5.6391 5.7429 6.2761 6.4104 6.4768 6.5752 6.6345 6.6499 6.8420 6.8424 7.0861 7.0906 7.2521 7.3500 7.6622 7.6720 8.0938 8.1811 8.2029 8.2206 8.8305 8.8309 9.2027 9.2142 10.2260 10.2361 10.5879 10.5960 10.7171 10.7263 k = 0.3421 0.3421-0.0000 ( 10827 PWs) bands (ev): -48.2850 -48.2850 -48.2850 -48.2850 -24.9563 -24.9561 -24.9556 -24.9555 -24.3312 -24.3302 -24.3298 -24.3298 -24.2597 -24.2592 -24.2590 -24.2587 -0.3175 -0.3174 0.3896 0.3902 0.8223 0.8240 4.7451 4.7769 5.1203 5.1374 5.3042 5.3695 5.4515 5.5034 5.6503 5.7461 6.2827 6.4020 6.4985 6.5755 6.6228 6.6444 6.8570 6.8622 7.0860 7.0915 7.2787 7.3698 7.6812 7.6874 8.1295 8.2026 8.2370 8.2679 8.9412 8.9416 9.2155 9.2283 10.2061 10.2156 10.5799 10.5880 10.7408 10.7496 k = 0.3333 0.3333-0.0000 ( 10843 PWs) bands (ev): -48.2850 -48.2850 -48.2850 -48.2850 -24.9562 -24.9560 -24.9554 -24.9553 -24.3310 -24.3300 -24.3297 -24.3297 -24.2594 -24.2589 -24.2588 -24.2584 -0.3924 -0.3924 0.3494 0.3499 0.8274 0.8292 4.7470 4.7766 5.1427 5.1566 5.3009 5.3359 5.5117 5.5566 5.6640 5.7525 6.2892 6.3935 6.5197 6.5738 6.6126 6.6422 6.8734 6.8833 7.0860 7.0928 7.3055 7.3906 7.6974 7.6997 8.1605 8.2243 8.2763 8.3161 9.0458 9.0459 9.2293 9.2434 10.1865 10.1954 10.5709 10.5790 10.7652 10.7733 k = 0.3246 0.3246-0.0000 ( 10835 PWs) bands (ev): -48.2851 -48.2851 -48.2850 -48.2850 -24.9560 -24.9558 -24.9552 -24.9551 -24.3309 -24.3299 -24.3295 -24.3295 -24.2592 -24.2586 -24.2585 -24.2582 -0.4677 -0.4676 0.3075 0.3080 0.8316 0.8334 4.7537 4.7815 5.1324 5.1848 5.3120 5.3170 5.5726 5.6127 5.6793 5.7614 6.2959 6.3850 6.5390 6.5702 6.6058 6.6433 6.8911 6.9054 7.0863 7.0945 7.3323 7.4120 7.7089 7.7108 8.1874 8.2460 8.3201 8.3652 9.1432 9.1435 9.2440 9.2598 10.1669 10.1753 10.5611 10.5692 10.7900 10.7974 k = 0.3158 0.3158-0.0000 ( 10839 PWs) bands (ev): -48.2851 -48.2851 -48.2851 -48.2851 -24.9559 -24.9556 -24.9551 -24.9549 -24.3308 -24.3297 -24.3294 -24.3293 -24.2589 -24.2583 -24.2582 -24.2579 -0.5429 -0.5429 0.2642 0.2647 0.8347 0.8366 4.7653 4.7917 5.1123 5.1906 5.3147 5.3471 5.6335 5.6688 5.6959 5.7724 6.3033 6.3768 6.5524 6.5657 6.6067 6.6473 6.9100 6.9284 7.0869 7.0969 7.3590 7.4341 7.7151 7.7217 8.2114 8.2675 8.3670 8.4151 9.2320 9.2339 9.2597 9.2780 10.1473 10.1552 10.5504 10.5586 10.8151 10.8216 k = 0.3070 0.3070-0.0000 ( 10843 PWs) bands (ev): -48.2851 -48.2851 -48.2851 -48.2851 -24.9557 -24.9554 -24.9549 -24.9547 -24.3307 -24.3296 -24.3292 -24.3292 -24.2586 -24.2580 -24.2580 -24.2576 -0.6180 -0.6180 0.2197 0.2202 0.8367 0.8386 4.7819 4.8072 5.0890 5.1740 5.3450 5.3853 5.6938 5.7117 5.7252 5.7850 6.3117 6.3688 6.5556 6.5609 6.6199 6.6535 6.9300 6.9520 7.0879 7.1001 7.3856 7.4565 7.7188 7.7304 8.2333 8.2888 8.4158 8.4657 9.2759 9.2898 9.3168 9.3204 10.1275 10.1350 10.5389 10.5473 10.8402 10.8457 k = 0.2982 0.2982-0.0000 ( 10843 PWs) bands (ev): -48.2852 -48.2852 -48.2851 -48.2851 -24.9555 -24.9552 -24.9547 -24.9545 -24.3305 -24.3294 -24.3291 -24.3290 -24.2583 -24.2577 -24.2577 -24.2573 -0.6927 -0.6926 0.1741 0.1746 0.8373 0.8393 4.8034 4.8278 5.0662 5.1503 5.3883 5.4283 5.7302 5.7524 5.7770 5.7992 6.3216 6.3612 6.5520 6.5565 6.6423 6.6618 6.9509 6.9759 7.0895 7.1046 7.4118 7.4793 7.7203 7.7376 8.2537 8.3095 8.4658 8.5169 9.2931 9.3106 9.3918 9.3926 10.1074 10.1145 10.5268 10.5353 10.8650 10.8692 k = 0.2895 0.2895-0.0000 ( 10841 PWs) bands (ev): -48.2852 -48.2852 -48.2852 -48.2852 -24.9553 -24.9550 -24.9545 -24.9543 -24.3304 -24.3292 -24.3289 -24.3288 -24.2581 -24.2574 -24.2574 -24.2570 -0.7667 -0.7667 0.1277 0.1282 0.8366 0.8385 4.8296 4.8532 5.0458 5.1271 5.4372 5.4745 5.7486 5.8049 5.8184 5.8253 6.3333 6.3543 6.5464 6.5529 6.6695 6.6721 6.9726 6.9993 7.0919 7.1111 7.4376 7.5022 7.7206 7.7440 8.2730 8.3296 8.5166 8.5685 9.3108 9.3302 9.4590 9.4591 10.0868 10.0937 10.5141 10.5226 10.8892 10.8915 k = 0.2807 0.2807-0.0000 ( 10847 PWs) bands (ev): -48.2853 -48.2853 -48.2852 -48.2852 -24.9551 -24.9549 -24.9542 -24.9541 -24.3302 -24.3291 -24.3287 -24.3286 -24.2577 -24.2571 -24.2571 -24.2567 -0.8399 -0.8399 0.0806 0.0811 0.8344 0.8364 4.8602 4.8833 5.0290 5.1073 5.4894 5.5229 5.7675 5.8274 5.8658 5.8684 6.3471 6.3482 6.5405 6.5502 6.6848 6.6998 6.9948 7.0213 7.0956 7.1206 7.4630 7.5252 7.7204 7.7506 8.2912 8.3489 8.5677 8.6205 9.3290 9.3499 9.5180 9.5188 10.0656 10.0724 10.5007 10.5094 10.9115 10.9118 k = 0.2719 0.2719-0.0000 ( 10849 PWs) bands (ev): -48.2853 -48.2853 -48.2853 -48.2853 -24.9550 -24.9547 -24.9540 -24.9538 -24.3301 -24.3289 -24.3286 -24.3285 -24.2574 -24.2568 -24.2568 -24.2564 -0.9122 -0.9121 0.0331 0.0336 0.8307 0.8326 4.8947 4.9175 5.0169 5.0921 5.5438 5.5729 5.7866 5.8442 5.9054 5.9159 6.3431 6.3627 6.5352 6.5487 6.7001 6.7327 7.0169 7.0404 7.1011 7.1344 7.4878 7.5482 7.7208 7.7584 8.3084 8.3673 8.6189 8.6727 9.3477 9.3700 9.5698 9.5713 10.0436 10.0504 10.4868 10.4955 10.9271 10.9313 k = 0.2632 0.2632-0.0000 ( 10861 PWs) bands (ev): -48.2854 -48.2854 -48.2853 -48.2853 -24.9548 -24.9545 -24.9538 -24.9536 -24.3299 -24.3287 -24.3284 -24.3283 -24.2571 -24.2565 -24.2565 -24.2561 -0.9833 -0.9833 -0.0146 -0.0141 0.8254 0.8273 4.9311 4.9547 5.0115 5.0831 5.6000 5.6237 5.8061 5.8614 5.9355 5.9621 6.3395 6.3796 6.5307 6.5482 6.7186 6.7676 7.0380 7.0558 7.1095 7.1535 7.5122 7.5709 7.7230 7.7683 8.3247 8.3844 8.6699 8.7249 9.3666 9.3904 9.6145 9.6168 10.0208 10.0278 10.4724 10.4811 10.9345 10.9442 k = 0.2544 0.2544-0.0000 ( 10859 PWs) bands (ev): -48.2854 -48.2854 -48.2854 -48.2854 -24.9546 -24.9543 -24.9536 -24.9534 -24.3298 -24.3286 -24.3282 -24.3281 -24.2568 -24.2562 -24.2562 -24.2558 -1.0531 -1.0531 -0.0624 -0.0619 0.8185 0.8204 4.9634 4.9924 5.0190 5.0827 5.6575 5.6747 5.8257 5.8790 5.9589 6.0037 6.3377 6.3967 6.5271 6.5489 6.7405 6.8039 7.0569 7.0677 7.1223 7.1779 7.5364 7.5933 7.7284 7.7813 8.3400 8.4003 8.7207 8.7771 9.3858 9.4110 9.6527 9.6559 9.9969 10.0044 10.4575 10.4662 10.9268 10.9443 k = 0.2456 0.2456-0.0000 ( 10859 PWs) bands (ev): -48.2855 -48.2855 -48.2854 -48.2854 -24.9544 -24.9541 -24.9534 -24.9532 -24.3296 -24.3284 -24.3280 -24.3279 -24.2565 -24.2559 -24.2558 -24.2555 -1.1215 -1.1215 -0.1100 -0.1095 0.8101 0.8120 4.9808 5.0238 5.0500 5.0976 5.7159 5.7250 5.8457 5.8972 5.9761 6.0407 6.3381 6.4129 6.5247 6.5503 6.7654 6.8408 7.0727 7.0769 7.1405 7.2065 7.5607 7.6151 7.7384 7.7982 8.3544 8.4147 8.7709 8.8290 9.4051 9.4317 9.6846 9.6888 9.9720 9.9802 10.4422 10.4508 10.8979 10.9259 k = 0.2368 0.2368-0.0000 ( 10851 PWs) bands (ev): -48.2855 -48.2855 -48.2854 -48.2854 -24.9542 -24.9539 -24.9532 -24.9530 -24.3295 -24.3283 -24.3279 -24.3278 -24.2562 -24.2556 -24.2555 -24.2552 -1.1884 -1.1883 -0.1573 -0.1568 0.8002 0.8021 4.9907 5.0432 5.0969 5.1332 5.7731 5.7745 5.8661 5.9162 5.9881 6.0732 6.3412 6.4275 6.5233 6.5524 6.7926 6.8770 7.0849 7.0861 7.1637 7.2383 7.5857 7.6364 7.7547 7.8199 8.3677 8.4275 8.8204 8.8806 9.4244 9.4524 9.7106 9.7162 9.9460 9.9554 10.4265 10.4349 10.8541 10.8871 k = 0.2281 0.2281-0.0000 ( 10851 PWs) bands (ev): -48.2855 -48.2855 -48.2855 -48.2855 -24.9540 -24.9537 -24.9530 -24.9527 -24.3293 -24.3281 -24.3277 -24.3276 -24.2559 -24.2552 -24.2552 -24.2549 -1.2536 -1.2535 -0.2041 -0.2037 0.7889 0.7906 5.0018 5.0574 5.1507 5.1825 5.8172 5.8315 5.8878 5.9362 5.9964 6.1026 6.3472 6.4402 6.5231 6.5549 6.8206 6.9113 7.0924 7.0986 7.1907 7.2724 7.6119 7.6567 7.7786 7.8469 8.3801 8.4385 8.8692 8.9316 9.4436 9.4731 9.7308 9.7382 9.9189 9.9301 10.4103 10.4185 10.8055 10.8395 k = 0.2193 0.2193-0.0000 ( 10859 PWs) bands (ev): -48.2856 -48.2856 -48.2855 -48.2855 -24.9538 -24.9535 -24.9527 -24.9525 -24.3291 -24.3280 -24.3275 -24.3274 -24.2555 -24.2549 -24.2549 -24.2546 -1.3170 -1.3170 -0.2503 -0.2498 0.7762 0.7779 5.0164 5.0724 5.2087 5.2389 5.8553 5.8805 5.9147 5.9573 6.0043 6.1308 6.3564 6.4511 6.5240 6.5575 6.8478 6.9420 7.1003 7.1115 7.2202 7.3085 7.6395 7.6761 7.8113 7.8799 8.3916 8.4478 8.9171 8.9819 9.4627 9.4935 9.7448 9.7549 9.8913 9.9052 10.3938 10.4016 10.7570 10.7904 k = 0.2105 0.2105-0.0000 ( 10861 PWs) bands (ev): -48.2856 -48.2856 -48.2856 -48.2856 -24.9536 -24.9533 -24.9525 -24.9523 -24.3290 -24.3278 -24.3273 -24.3272 -24.2552 -24.2546 -24.2546 -24.2543 -1.3786 -1.3786 -0.2957 -0.2952 0.7622 0.7639 5.0349 5.0907 5.2698 5.2995 5.8856 5.9116 5.9484 5.9789 6.0204 6.1600 6.3689 6.4606 6.5259 6.5601 6.8729 6.9679 7.1094 7.1256 7.2517 7.3462 7.6686 7.6942 7.8536 7.9197 8.4023 8.4553 8.9639 9.0314 9.4815 9.5136 9.7517 9.7652 9.8644 9.8820 10.3768 10.3842 10.7105 10.7424 k = 0.2018 0.2018-0.0000 ( 10863 PWs) bands (ev): -48.2857 -48.2857 -48.2856 -48.2856 -24.9534 -24.9531 -24.9523 -24.9521 -24.3288 -24.3277 -24.3271 -24.3271 -24.2549 -24.2543 -24.2543 -24.2540 -1.4382 -1.4382 -0.3401 -0.3397 0.7472 0.7487 5.0575 5.1127 5.3332 5.3629 5.9080 5.9328 5.9668 5.9997 6.0593 6.1919 6.3853 6.4690 6.5289 6.5627 6.8948 6.9881 7.1203 7.1410 7.2848 7.3853 7.6985 7.7109 7.9057 7.9668 8.4123 8.4612 9.0096 9.0798 9.4999 9.5334 9.7492 9.7659 9.8421 9.8632 10.3594 10.3662 10.6669 10.6966 k = 0.1930 0.1930-0.0000 ( 10867 PWs) bands (ev): -48.2857 -48.2857 -48.2856 -48.2856 -24.9532 -24.9529 -24.9521 -24.9519 -24.3287 -24.3276 -24.3269 -24.3269 -24.2546 -24.2540 -24.2540 -24.2537 -1.4958 -1.4958 -0.3835 -0.3830 0.7312 0.7326 5.0840 5.1385 5.3982 5.4283 5.9232 5.9493 5.9721 6.0187 6.1140 6.2262 6.4063 6.4768 6.5328 6.5654 6.9135 7.0022 7.1335 7.1576 7.3193 7.4258 7.7258 7.7283 7.9672 8.0219 8.4218 8.4656 9.0540 9.1270 9.5180 9.5527 9.7350 9.7511 9.8302 9.8512 10.3416 10.3477 10.6265 10.6534 k = 0.1842 0.1842-0.0000 ( 10863 PWs) bands (ev): -48.2858 -48.2858 -48.2857 -48.2857 -24.9531 -24.9528 -24.9519 -24.9517 -24.3285 -24.3275 -24.3268 -24.3267 -24.2543 -24.2537 -24.2537 -24.2534 -1.5513 -1.5513 -0.4256 -0.4252 0.7143 0.7157 5.1144 5.1682 5.4638 5.4946 5.9328 5.9561 5.9808 6.0361 6.1733 6.2605 6.4334 6.4843 6.5377 6.5685 6.9293 7.0109 7.1493 7.1755 7.3549 7.4674 7.7386 7.7571 8.0373 8.0847 8.4312 8.4691 9.0970 9.1728 9.5356 9.5714 9.7099 9.7222 9.8279 9.8456 10.3233 10.3287 10.5895 10.6131 k = 0.1754 0.1754-0.0000 ( 10871 PWs) bands (ev): -48.2858 -48.2858 -48.2857 -48.2857 -24.9529 -24.9526 -24.9517 -24.9515 -24.3284 -24.3274 -24.3266 -24.3266 -24.2540 -24.2534 -24.2534 -24.2531 -1.6046 -1.6046 -0.4665 -0.4661 0.6969 0.6982 5.1482 5.2013 5.5288 5.5603 5.9384 5.9542 5.9964 6.0528 6.2332 6.2916 6.4678 6.4916 6.5438 6.5724 6.9429 7.0151 7.1674 7.1943 7.3916 7.5101 7.7492 7.7841 8.1144 8.1545 8.4409 8.4722 9.1386 9.2169 9.5528 9.5893 9.6769 9.6854 9.8292 9.8437 10.3045 10.3090 10.5561 10.5755 k = 0.1667 0.1667-0.0000 ( 10865 PWs) bands (ev): -48.2858 -48.2858 -48.2857 -48.2857 -24.9527 -24.9524 -24.9515 -24.9513 -24.3282 -24.3272 -24.3264 -24.3264 -24.2537 -24.2531 -24.2531 -24.2529 -1.6557 -1.6557 -0.5059 -0.5055 0.6789 0.6802 5.1852 5.2377 5.5914 5.6237 5.9421 5.9512 6.0138 6.0696 6.2919 6.3177 6.4990 6.5082 6.5525 6.5776 6.9551 7.0159 7.1879 7.2141 7.4293 7.5539 7.7573 7.8089 8.1967 8.2290 8.4519 8.4768 9.1786 9.2591 9.5695 9.6056 9.6391 9.6437 9.8312 9.8434 10.2850 10.2886 10.5259 10.5408 k = 0.1579 0.1579-0.0000 ( 10875 PWs) bands (ev): -48.2859 -48.2859 -48.2858 -48.2858 -24.9525 -24.9523 -24.9513 -24.9511 -24.3281 -24.3271 -24.3263 -24.3262 -24.2534 -24.2529 -24.2528 -24.2526 -1.7045 -1.7044 -0.5438 -0.5435 0.6607 0.6618 5.2251 5.2770 5.6490 5.6813 5.9468 5.9516 6.0318 6.0872 6.3389 6.3472 6.5068 6.5411 6.5763 6.5852 6.9670 7.0143 7.2107 7.2351 7.4678 7.5985 7.7627 7.8311 8.2808 8.3038 8.4662 8.4864 9.2171 9.2992 9.5856 9.5918 9.5984 9.6262 9.8330 9.8436 10.2649 10.2675 10.4990 10.5087 k = 0.1491 0.1491-0.0000 ( 10875 PWs) bands (ev): -48.2859 -48.2859 -48.2858 -48.2858 -24.9524 -24.9521 -24.9511 -24.9509 -24.3279 -24.3270 -24.3261 -24.3261 -24.2531 -24.2526 -24.2526 -24.2523 -1.7509 -1.7508 -0.5802 -0.5798 0.6423 0.6434 5.2675 5.3189 5.6978 5.7285 5.9559 5.9596 6.0507 6.1061 6.3560 6.3965 6.5158 6.5536 6.5968 6.6259 6.9793 7.0110 7.2360 7.2573 7.5069 7.6439 7.7656 7.8506 8.3593 8.3681 8.4900 8.5113 9.2538 9.3365 9.5456 9.5496 9.6017 9.6408 9.8345 9.8439 10.2440 10.2455 10.4749 10.4791 k = 0.1404 0.1404-0.0000 ( 10871 PWs) bands (ev): -48.2859 -48.2859 -48.2858 -48.2858 -24.9522 -24.9520 -24.9509 -24.9508 -24.3278 -24.3269 -24.3259 -24.3259 -24.2528 -24.2523 -24.2523 -24.2521 -1.7949 -1.7949 -0.6148 -0.6144 0.6240 0.6250 5.3119 5.3628 5.7336 5.7600 5.9733 5.9789 6.0715 6.1269 6.3703 6.4355 6.5268 6.5612 6.6148 6.6842 6.9934 7.0067 7.2641 7.2812 7.5463 7.6900 7.7659 7.8675 8.4065 8.4156 8.5389 8.5659 9.2887 9.3702 9.4949 9.4989 9.6172 9.6556 9.8357 9.8442 10.2224 10.2227 10.4520 10.4534 k = 0.1316 0.1316-0.0000 ( 10875 PWs) bands (ev): -48.2860 -48.2860 -48.2859 -48.2859 -24.9521 -24.9518 -24.9508 -24.9506 -24.3277 -24.3269 -24.3258 -24.3258 -24.2526 -24.2521 -24.2521 -24.2519 -1.8364 -1.8364 -0.6476 -0.6473 0.6059 0.6068 5.3580 5.4084 5.7543 5.7748 5.9997 6.0078 6.0964 6.1504 6.3826 6.4611 6.5400 6.5677 6.6416 6.7461 7.0017 7.0103 7.2951 7.3068 7.5855 7.7356 7.7647 7.8819 8.4232 8.4446 8.6168 8.6452 9.3215 9.3936 9.4407 9.4523 9.6323 9.6695 9.8366 9.8444 10.1988 10.2000 10.4271 10.4341 k = 0.1228 0.1228-0.0000 ( 10871 PWs) bands (ev): -48.2860 -48.2860 -48.2859 -48.2859 -24.9519 -24.9517 -24.9506 -24.9504 -24.3275 -24.3268 -24.3257 -24.3257 -24.2523 -24.2519 -24.2518 -24.2516 -1.8755 -1.8755 -0.6787 -0.6784 0.5882 0.5890 5.4051 5.4552 5.7622 5.7772 6.0317 6.0384 6.1284 6.1776 6.3934 6.4751 6.5531 6.5738 6.6761 6.8104 6.9964 7.0315 7.3291 7.3344 7.6239 7.7559 7.7870 7.8946 8.4315 8.4611 8.7073 8.7348 9.3491 9.3684 9.3866 9.4480 9.6471 9.6824 9.8375 9.8447 10.1738 10.1767 10.4044 10.4165 k = 0.1140 0.1140-0.0000 ( 10871 PWs) bands (ev): -48.2860 -48.2860 -48.2859 -48.2859 -24.9518 -24.9516 -24.9504 -24.9503 -24.3274 -24.3267 -24.3255 -24.3255 -24.2521 -24.2517 -24.2516 -24.2514 -1.9120 -1.9120 -0.7078 -0.7075 0.5710 0.5718 5.4529 5.5026 5.7616 5.7724 6.0637 6.0641 6.1683 6.2092 6.4029 6.4820 6.5646 6.5793 6.7141 6.8761 6.9914 7.0588 7.3641 7.3662 7.6602 7.7505 7.8335 7.9065 8.4375 8.4735 8.8009 8.8277 9.3105 9.3162 9.3877 9.4701 9.6616 9.6942 9.8385 9.8452 10.1478 10.1526 10.3838 10.4005 k = 0.1053 0.1053-0.0000 ( 10867 PWs) bands (ev): -48.2861 -48.2861 -48.2860 -48.2860 -24.9517 -24.9515 -24.9503 -24.9501 -24.3273 -24.3266 -24.3254 -24.3254 -24.2519 -24.2515 -24.2514 -24.2512 -1.9460 -1.9459 -0.7350 -0.7347 0.5545 0.5552 5.5008 5.5500 5.7559 5.7639 6.0846 6.0924 6.2125 6.2444 6.4115 6.4849 6.5745 6.5844 6.7509 6.9409 6.9889 7.0937 7.3959 7.4063 7.6929 7.7429 7.8810 7.9196 8.4434 8.4839 8.8936 8.9203 9.2457 9.2523 9.4148 9.4927 9.6757 9.7047 9.8398 9.8459 10.1208 10.1276 10.3653 10.3856 k = 0.0965 0.0965-0.0000 ( 10869 PWs) bands (ev): -48.2861 -48.2861 -48.2860 -48.2860 -24.9515 -24.9514 -24.9501 -24.9500 -24.3272 -24.3266 -24.3253 -24.3253 -24.2517 -24.2513 -24.2512 -24.2510 -1.9773 -1.9773 -0.7602 -0.7599 0.5388 0.5395 5.5481 5.5966 5.7477 5.7538 6.1017 6.1171 6.2568 6.2812 6.4193 6.4856 6.5829 6.5888 6.7834 6.9725 7.0210 7.1368 7.4300 7.4490 7.7199 7.7344 7.9285 7.9360 8.4500 8.4931 8.9826 9.0100 9.1773 9.1846 9.4415 9.5131 9.6892 9.7138 9.8414 9.8471 10.0930 10.1018 10.3488 10.3716 k = 0.0877 0.0877-0.0000 ( 10865 PWs) bands (ev): -48.2861 -48.2861 -48.2860 -48.2860 -24.9514 -24.9513 -24.9500 -24.9499 -24.3271 -24.3265 -24.3252 -24.3252 -24.2515 -24.2511 -24.2510 -24.2508 -2.0060 -2.0060 -0.7833 -0.7831 0.5241 0.5246 5.5941 5.6416 5.7385 5.7434 6.1170 6.1384 6.2986 6.3172 6.4263 6.4848 6.5901 6.5927 6.8107 6.9702 7.0882 7.1877 7.4666 7.4939 7.7262 7.7394 7.9578 7.9753 8.4572 8.5012 9.0597 9.0824 9.1187 9.1201 9.4674 9.5309 9.7019 9.7213 9.8435 9.8488 10.0648 10.0754 10.3343 10.3585 k = 0.0789 0.0789-0.0000 ( 10873 PWs) bands (ev): -48.2861 -48.2861 -48.2860 -48.2860 -24.9513 -24.9512 -24.9499 -24.9498 -24.3270 -24.3265 -24.3251 -24.3251 -24.2513 -24.2510 -24.2508 -24.2507 -2.0321 -2.0320 -0.8044 -0.8042 0.5104 0.5109 5.6376 5.6825 5.7297 5.7351 6.1314 6.1573 6.3364 6.3504 6.4327 6.4829 6.5958 6.5960 6.8327 6.9655 7.1578 7.2440 7.5065 7.5406 7.7195 7.7512 7.9859 8.0212 8.4651 8.5080 9.0242 9.0284 9.1540 9.1815 9.4925 9.5465 9.7135 9.7272 9.8463 9.8511 10.0368 10.0488 10.3216 10.3461 k = 0.0702 0.0702-0.0000 ( 10877 PWs) bands (ev): -48.2862 -48.2862 -48.2860 -48.2860 -24.9512 -24.9511 -24.9498 -24.9497 -24.3269 -24.3264 -24.3250 -24.3250 -24.2511 -24.2508 -24.2507 -24.2505 -2.0554 -2.0554 -0.8233 -0.8231 0.4979 0.4983 5.6756 5.7067 5.7244 5.7413 6.1454 6.1744 6.3696 6.3795 6.4385 6.4801 6.5982 6.6007 6.8504 6.9605 7.2262 7.3021 7.5508 7.5878 7.7167 7.7568 8.0191 8.0653 8.4732 8.5136 8.9460 8.9514 9.2223 9.2537 9.5170 9.5603 9.7235 9.7312 9.8499 9.8541 10.0099 10.0223 10.3108 10.3345 k = 0.0614 0.0614-0.0000 ( 10885 PWs) bands (ev): -48.2862 -48.2862 -48.2861 -48.2861 -24.9512 -24.9510 -24.9497 -24.9496 -24.3268 -24.3264 -24.3250 -24.3249 -24.2510 -24.2507 -24.2505 -24.2504 -2.0761 -2.0761 -0.8401 -0.8399 0.4866 0.4870 5.6941 5.7039 5.7363 5.7716 6.1594 6.1901 6.3981 6.4035 6.4444 6.4766 6.6000 6.6041 6.8648 6.9556 7.2908 7.3572 7.6016 7.6319 7.7230 7.7585 8.0555 8.1071 8.4812 8.5175 8.8644 8.8697 9.2828 9.3176 9.5411 9.5727 9.7314 9.7333 9.8542 9.8579 9.9849 9.9968 10.3017 10.3238 k = 0.0526 0.0526-0.0000 ( 10883 PWs) bands (ev): -48.2862 -48.2862 -48.2861 -48.2861 -24.9511 -24.9510 -24.9496 -24.9495 -24.3267 -24.3264 -24.3249 -24.3249 -24.2508 -24.2506 -24.2504 -24.2503 -2.0940 -2.0940 -0.8547 -0.8545 0.4767 0.4770 5.6919 5.6963 5.7663 5.8035 6.1735 6.2046 6.4211 6.4220 6.4512 6.4726 6.6012 6.6064 6.8767 6.9507 7.3489 7.4048 7.6600 7.6632 7.7497 7.7594 8.0930 8.1457 8.4886 8.5199 8.7804 8.7850 9.3336 9.3709 9.5645 9.5847 9.7335 9.7369 9.8592 9.8623 9.9627 9.9732 10.2942 10.3140 k = 0.0439 0.0439-0.0000 ( 10895 PWs) bands (ev): -48.2862 -48.2862 -48.2861 -48.2861 -24.9510 -24.9509 -24.9495 -24.9495 -24.3266 -24.3264 -24.3248 -24.3248 -24.2507 -24.2505 -24.2503 -24.2502 -2.1092 -2.1092 -0.8670 -0.8669 0.4682 0.4684 5.6861 5.6888 5.7970 5.8313 6.1878 6.2177 6.4315 6.4411 6.4599 6.4685 6.6020 6.6076 6.8868 6.9460 7.3975 7.4418 7.6799 7.7198 7.7682 7.8004 8.1299 8.1799 8.4950 8.5205 8.6947 8.6983 9.3745 9.4125 9.5866 9.5967 9.7321 9.7396 9.8649 9.8673 9.9441 9.9524 10.2883 10.3053 k = 0.0351 0.0351-0.0000 ( 10901 PWs) bands (ev): -48.2862 -48.2862 -48.2861 -48.2861 -24.9510 -24.9509 -24.9495 -24.9494 -24.3266 -24.3264 -24.3248 -24.3248 -24.2506 -24.2505 -24.2502 -24.2501 -2.1217 -2.1217 -0.8772 -0.8771 0.4611 0.4613 5.6804 5.6823 5.8244 5.8539 6.2020 6.2290 6.4365 6.4537 6.4665 6.4695 6.6025 6.6078 6.8954 6.9413 7.4351 7.4680 7.6921 7.7430 7.8220 7.8653 8.1642 8.2083 8.4998 8.5191 8.6086 8.6109 9.4062 9.4421 9.6062 9.6090 9.7296 9.7395 9.8708 9.8725 9.9294 9.9353 10.2839 10.2977 k = 0.0263 0.0263-0.0000 ( 10905 PWs) bands (ev): -48.2862 -48.2862 -48.2861 -48.2861 -24.9509 -24.9509 -24.9494 -24.9494 -24.3265 -24.3264 -24.3247 -24.3247 -24.2505 -24.2504 -24.2501 -24.2501 -2.1314 -2.1314 -0.8851 -0.8850 0.4556 0.4558 5.6758 5.6770 5.8472 5.8706 6.2157 6.2379 6.4387 6.4543 6.4728 6.4777 6.6029 6.6074 6.9030 6.9366 7.4618 7.4847 7.7044 7.7453 7.9022 7.9377 8.1941 8.2291 8.4981 8.5078 8.5285 8.5331 9.4303 9.4606 9.6210 9.6221 9.7270 9.7370 9.8765 9.8776 9.9186 9.9223 10.2809 10.2913 k = 0.0175 0.0175-0.0000 ( 10909 PWs) bands (ev): -48.2862 -48.2862 -48.2861 -48.2861 -24.9509 -24.9508 -24.9494 -24.9493 -24.3265 -24.3264 -24.3247 -24.3247 -24.2505 -24.2504 -24.2501 -24.2501 -2.1383 -2.1383 -0.8908 -0.8907 0.4516 0.4517 5.6723 5.6732 5.8651 5.8813 6.2278 6.2438 6.4400 6.4504 6.4803 6.4836 6.6033 6.6066 6.9098 6.9318 7.4794 7.4940 7.7166 7.7443 7.9865 8.0131 8.2165 8.2391 8.4368 8.4369 8.5113 8.5192 9.4481 9.4699 9.6312 9.6335 9.7252 9.7333 9.8813 9.8819 9.9113 9.9134 10.2793 10.2863 k = 0.0088 0.0088-0.0000 ( 10913 PWs) bands (ev): -48.2862 -48.2862 -48.2861 -48.2861 -24.9508 -24.9508 -24.9493 -24.9493 -24.3264 -24.3264 -24.3247 -24.3247 -24.2504 -24.2504 -24.2501 -24.2500 -2.1425 -2.1425 -0.8941 -0.8941 0.4492 0.4493 5.6703 5.6707 5.8777 5.8860 6.2375 6.2459 6.4413 6.4465 6.4854 6.4869 6.6039 6.6057 6.9159 6.9268 7.4903 7.4974 7.7273 7.7413 8.0657 8.0828 8.2253 8.2330 8.3715 8.3717 8.5124 8.5162 9.4608 9.4721 9.6383 9.6399 9.7249 9.7293 9.8846 9.8848 9.9072 9.9081 10.2790 10.2825 k = 0.0000 0.0000 0.0000 ( 10931 PWs) bands (ev): -48.2862 -48.2862 -48.2861 -48.2861 -24.9508 -24.9508 -24.9493 -24.9493 -24.3264 -24.3264 -24.3247 -24.3247 -24.2504 -24.2504 -24.2500 -24.2500 -2.1439 -2.1439 -0.8953 -0.8953 0.4485 0.4485 5.6698 5.6698 5.8847 5.8847 6.2438 6.2438 6.4434 6.4434 6.4875 6.4875 6.6047 6.6047 6.9215 6.9215 7.4961 7.4961 7.7357 7.7357 8.1139 8.1139 8.2195 8.2195 8.3452 8.3452 8.5141 8.5141 9.4688 9.4688 9.6414 9.6414 9.7263 9.7263 9.8858 9.8858 9.9061 9.9061 10.2801 10.2801 k = 0.0000 0.0000 0.0000 ( 10931 PWs) bands (ev): -48.2862 -48.2862 -48.2861 -48.2861 -24.9508 -24.9508 -24.9493 -24.9493 -24.3264 -24.3264 -24.3247 -24.3247 -24.2504 -24.2504 -24.2500 -24.2500 -2.1439 -2.1439 -0.8953 -0.8953 0.4485 0.4485 5.6698 5.6698 5.8847 5.8847 6.2438 6.2438 6.4434 6.4434 6.4875 6.4875 6.6047 6.6047 6.9215 6.9215 7.4961 7.4961 7.7357 7.7357 8.1139 8.1139 8.2195 8.2195 8.3452 8.3452 8.5141 8.5141 9.4688 9.4688 9.6414 9.6414 9.7263 9.7263 9.8858 9.8858 9.9061 9.9061 10.2801 10.2801 k = 0.0000 0.0000 0.0119 ( 10915 PWs) bands (ev): -48.2862 -48.2862 -48.2861 -48.2861 -24.9508 -24.9508 -24.9493 -24.9493 -24.3264 -24.3264 -24.3247 -24.3247 -24.2504 -24.2504 -24.2500 -24.2500 -2.1429 -2.1429 -0.8990 -0.8990 0.4525 0.4525 5.6478 5.6478 5.8997 5.8997 6.2459 6.2459 6.4440 6.4440 6.4884 6.4884 6.6047 6.6047 6.9257 6.9257 7.4961 7.4961 7.7360 7.7360 8.1132 8.1132 8.2199 8.2199 8.3448 8.3448 8.5134 8.5134 9.4695 9.4695 9.6431 9.6431 9.7246 9.7246 9.8857 9.8857 9.9062 9.9062 10.2752 10.2752 k = 0.0000 0.0000 0.0239 ( 10927 PWs) bands (ev): -48.2862 -48.2862 -48.2861 -48.2861 -24.9508 -24.9508 -24.9493 -24.9493 -24.3264 -24.3264 -24.3247 -24.3247 -24.2504 -24.2504 -24.2500 -24.2500 -2.1399 -2.1399 -0.9099 -0.9099 0.4642 0.4642 5.5949 5.5949 5.9320 5.9320 6.2519 6.2519 6.4456 6.4456 6.4911 6.4911 6.6048 6.6048 6.9383 6.9383 7.4964 7.4964 7.7369 7.7369 8.1112 8.1112 8.2213 8.2213 8.3436 8.3436 8.5115 8.5115 9.4713 9.4713 9.6482 9.6482 9.7196 9.7196 9.8854 9.8854 9.9065 9.9065 10.2611 10.2611 k = 0.0000 0.0000 0.0358 ( 10915 PWs) bands (ev): -48.2862 -48.2862 -48.2861 -48.2861 -24.9508 -24.9508 -24.9493 -24.9493 -24.3264 -24.3264 -24.3247 -24.3247 -24.2504 -24.2504 -24.2500 -24.2500 -2.1349 -2.1349 -0.9276 -0.9276 0.4832 0.4832 5.5274 5.5274 5.9659 5.9659 6.2611 6.2611 6.4480 6.4480 6.4958 6.4958 6.6049 6.6049 6.9594 6.9594 7.4968 7.4968 7.7383 7.7383 8.1080 8.1080 8.2236 8.2236 8.3417 8.3417 8.5083 8.5083 9.4736 9.4736 9.6565 9.6565 9.7115 9.7115 9.8849 9.8849 9.9070 9.9070 10.2401 10.2401 k = 0.0000 0.0000 0.0478 ( 10907 PWs) bands (ev): -48.2862 -48.2862 -48.2861 -48.2861 -24.9508 -24.9508 -24.9494 -24.9494 -24.3264 -24.3264 -24.3247 -24.3247 -24.2504 -24.2504 -24.2500 -24.2500 -2.1280 -2.1280 -0.9513 -0.9513 0.5086 0.5086 5.4531 5.4531 5.9952 5.9952 6.2723 6.2723 6.4506 6.4506 6.5025 6.5025 6.6050 6.6050 6.9891 6.9891 7.4976 7.4976 7.7404 7.7404 8.1038 8.1038 8.2269 8.2269 8.3391 8.3391 8.5039 8.5039 9.4754 9.4754 9.6674 9.6674 9.7013 9.7013 9.8843 9.8843 9.9077 9.9077 10.2150 10.2150 k = 0.0000 0.0000 0.0597 ( 10891 PWs) bands (ev): -48.2862 -48.2862 -48.2861 -48.2861 -24.9508 -24.9508 -24.9494 -24.9494 -24.3264 -24.3264 -24.3247 -24.3247 -24.2504 -24.2504 -24.2500 -24.2500 -2.1192 -2.1192 -0.9800 -0.9800 0.5393 0.5393 5.3758 5.3758 6.0185 6.0185 6.2839 6.2839 6.4530 6.4530 6.5110 6.5110 6.6052 6.6052 7.0268 7.0268 7.4988 7.4988 7.7430 7.7430 8.0985 8.0985 8.2313 8.2313 8.3359 8.3359 8.4985 8.4985 9.4744 9.4744 9.6760 9.6760 9.6947 9.6947 9.8835 9.8835 9.9085 9.9085 10.1886 10.1886 k = 0.0000 0.0000 0.0717 ( 10887 PWs) bands (ev): -48.2862 -48.2862 -48.2861 -48.2861 -24.9508 -24.9508 -24.9494 -24.9494 -24.3263 -24.3263 -24.3247 -24.3247 -24.2504 -24.2504 -24.2500 -24.2500 -2.1085 -2.1085 -1.0128 -1.0128 0.5743 0.5743 5.2976 5.2976 6.0365 6.0365 6.2947 6.2947 6.4551 6.4551 6.5206 6.5206 6.6053 6.6053 7.0718 7.0718 7.5007 7.5007 7.7461 7.7461 8.0926 8.0926 8.2367 8.2367 8.3322 8.3322 8.4923 8.4923 9.4674 9.4674 9.6704 9.6704 9.7059 9.7059 9.8827 9.8827 9.9093 9.9093 10.1633 10.1633 k = 0.0000 0.0000 0.0836 ( 10899 PWs) bands (ev): -48.2862 -48.2862 -48.2861 -48.2861 -24.9508 -24.9508 -24.9494 -24.9494 -24.3263 -24.3263 -24.3248 -24.3248 -24.2504 -24.2504 -24.2501 -24.2501 -2.0962 -2.0962 -1.0487 -1.0487 0.6122 0.6122 5.2200 5.2200 6.0501 6.0501 6.3042 6.3042 6.4567 6.4567 6.5304 6.5304 6.6055 6.6055 7.1224 7.1224 7.5037 7.5037 7.7497 7.7497 8.0862 8.0862 8.2433 8.2433 8.3282 8.3282 8.4855 8.4855 9.4505 9.4505 9.6633 9.6633 9.7253 9.7253 9.8819 9.8819 9.9102 9.9102 10.1408 10.1408 k = 0.0000 0.0000 0.0956 ( 10883 PWs) bands (ev): -48.2862 -48.2862 -48.2861 -48.2861 -24.9507 -24.9507 -24.9494 -24.9494 -24.3263 -24.3263 -24.3248 -24.3248 -24.2504 -24.2504 -24.2501 -24.2501 -2.0823 -2.0823 -1.0868 -1.0868 0.6521 0.6521 5.1442 5.1442 6.0606 6.0606 6.3121 6.3121 6.4581 6.4581 6.5398 6.5398 6.6057 6.6057 7.1762 7.1762 7.5083 7.5083 7.7537 7.7537 8.0796 8.0796 8.2513 8.2513 8.3240 8.3240 8.4784 8.4784 9.4210 9.4210 9.6623 9.6623 9.7477 9.7477 9.8810 9.8810 9.9112 9.9112 10.1220 10.1220 k = 0.0000 0.0000 0.1075 ( 10883 PWs) bands (ev): -48.2862 -48.2862 -48.2861 -48.2861 -24.9507 -24.9507 -24.9495 -24.9495 -24.3263 -24.3263 -24.3248 -24.3248 -24.2504 -24.2504 -24.2501 -24.2501 -2.0669 -2.0669 -1.1261 -1.1261 0.6928 0.6928 5.0713 5.0713 6.0688 6.0688 6.3185 6.3185 6.4591 6.4591 6.5483 6.5483 6.6060 6.6060 7.2305 7.2305 7.5154 7.5154 7.7581 7.7581 8.0731 8.0731 8.2607 8.2607 8.3197 8.3197 8.4715 8.4715 9.3791 9.3791 9.6680 9.6680 9.7722 9.7722 9.8802 9.8802 9.9121 9.9121 10.1073 10.1073 k = 0.0000 0.0000 0.1194 ( 10882 PWs) bands (ev): -48.2862 -48.2862 -48.2861 -48.2861 -24.9507 -24.9507 -24.9495 -24.9495 -24.3262 -24.3262 -24.3248 -24.3248 -24.2504 -24.2504 -24.2501 -24.2501 -2.0504 -2.0504 -1.1659 -1.1659 0.7333 0.7333 5.0020 5.0020 6.0753 6.0753 6.3236 6.3236 6.4601 6.4601 6.5558 6.5558 6.6062 6.6062 7.2820 7.2820 7.5265 7.5265 7.7628 7.7628 8.0671 8.0671 8.2715 8.2715 8.3154 8.3154 8.4654 8.4654 9.3268 9.3268 9.6790 9.6790 9.7981 9.7981 9.8794 9.8794 9.9131 9.9131 10.0962 10.0962 k = 0.0000 0.0000 0.1314 ( 10878 PWs) bands (ev): -48.2862 -48.2862 -48.2861 -48.2861 -24.9507 -24.9507 -24.9495 -24.9495 -24.3262 -24.3262 -24.3249 -24.3249 -24.2504 -24.2504 -24.2501 -24.2501 -2.0329 -2.0329 -1.2053 -1.2053 0.7725 0.7725 4.9373 4.9373 6.0805 6.0805 6.3277 6.3277 6.4608 6.4608 6.5623 6.5623 6.6064 6.6064 7.3267 7.3267 7.5432 7.5432 7.7677 7.7677 8.0619 8.0619 8.2835 8.2835 8.3113 8.3113 8.4610 8.4610 9.2668 9.2668 9.6935 9.6935 9.8247 9.8247 9.8787 9.8787 9.9141 9.9141 10.0884 10.0884 k = 0.0000 0.0000 0.1433 ( 10870 PWs) bands (ev): -48.2862 -48.2862 -48.2861 -48.2861 -24.9506 -24.9506 -24.9495 -24.9495 -24.3262 -24.3262 -24.3249 -24.3249 -24.2504 -24.2504 -24.2501 -24.2501 -2.0149 -2.0149 -1.2435 -1.2435 0.8097 0.8097 4.8780 4.8780 6.0848 6.0848 6.3310 6.3310 6.4615 6.4615 6.5677 6.5677 6.6066 6.6066 7.3617 7.3617 7.5666 7.5666 7.7725 7.7725 8.0580 8.0580 8.2958 8.2958 8.3080 8.3080 8.4596 8.4596 9.2014 9.2014 9.7097 9.7097 9.8513 9.8513 9.8782 9.8782 9.9154 9.9154 10.0832 10.0832 k = 0.0000 0.0000 0.1553 ( 10854 PWs) bands (ev): -48.2862 -48.2862 -48.2861 -48.2861 -24.9506 -24.9506 -24.9496 -24.9496 -24.3261 -24.3261 -24.3249 -24.3249 -24.2503 -24.2503 -24.2501 -24.2501 -1.9968 -1.9968 -1.2798 -1.2798 0.8439 0.8439 4.8248 4.8248 6.0883 6.0883 6.3336 6.3336 6.4620 6.4620 6.5722 6.5722 6.6068 6.6068 7.3862 7.3862 7.5956 7.5956 7.7770 7.7770 8.0555 8.0555 8.3017 8.3017 8.3113 8.3113 8.4633 8.4633 9.1325 9.1325 9.7265 9.7265 9.8738 9.8738 9.8808 9.8808 9.9172 9.9172 10.0800 10.0800 k = 0.0000 0.0000 0.1672 ( 10850 PWs) bands (ev): -48.2862 -48.2862 -48.2861 -48.2861 -24.9506 -24.9506 -24.9496 -24.9496 -24.3261 -24.3261 -24.3250 -24.3250 -24.2503 -24.2503 -24.2501 -24.2501 -1.9792 -1.9792 -1.3132 -1.3132 0.8744 0.8744 4.7785 4.7785 6.0911 6.0911 6.3357 6.3357 6.4625 6.4625 6.5759 6.5759 6.6070 6.6070 7.4021 7.4021 7.6268 7.6268 7.7811 7.7811 8.0546 8.0546 8.2994 8.2994 8.3213 8.3213 8.4746 8.4746 9.0617 9.0617 9.7428 9.7428 9.8761 9.8761 9.8995 9.8995 9.9216 9.9216 10.0783 10.0783 k = 0.0000 0.0000 0.1792 ( 10850 PWs) bands (ev): -48.2862 -48.2862 -48.2861 -48.2861 -24.9506 -24.9506 -24.9496 -24.9496 -24.3261 -24.3261 -24.3250 -24.3250 -24.2503 -24.2503 -24.2501 -24.2501 -1.9628 -1.9628 -1.3428 -1.3428 0.9004 0.9004 4.7395 4.7395 6.0933 6.0933 6.3373 6.3373 6.4628 6.4628 6.5787 6.5787 6.6071 6.6071 7.4121 7.4121 7.6562 7.6562 7.7842 7.7842 8.0553 8.0553 8.2968 8.2968 8.3287 8.3287 8.4955 8.4955 8.9905 8.9905 9.7577 9.7577 9.8758 9.8758 9.9099 9.9099 9.9346 9.9346 10.0776 10.0776 k = 0.0000 0.0000 0.1911 ( 10834 PWs) bands (ev): -48.2862 -48.2862 -48.2861 -48.2861 -24.9505 -24.9505 -24.9496 -24.9496 -24.3261 -24.3261 -24.3250 -24.3250 -24.2503 -24.2503 -24.2501 -24.2501 -1.9486 -1.9486 -1.3675 -1.3675 0.9213 0.9213 4.7086 4.7086 6.0950 6.0950 6.3385 6.3385 6.4631 6.4631 6.5809 6.5809 6.6072 6.6072 7.4182 7.4182 7.6811 7.6811 7.7863 7.7863 8.0570 8.0570 8.2947 8.2947 8.3329 8.3329 8.5262 8.5262 8.9208 8.9208 9.7702 9.7702 9.8756 9.8756 9.9127 9.9127 9.9518 9.9518 10.0776 10.0776 k = 0.0000 0.0000 0.2031 ( 10806 PWs) bands (ev): -48.2862 -48.2862 -48.2861 -48.2861 -24.9505 -24.9505 -24.9496 -24.9496 -24.3261 -24.3261 -24.3250 -24.3250 -24.2503 -24.2503 -24.2501 -24.2501 -1.9374 -1.9374 -1.3862 -1.3862 0.9366 0.9366 4.6862 4.6862 6.0962 6.0962 6.3393 6.3393 6.4633 6.4633 6.5825 6.5825 6.6073 6.6073 7.4219 7.4219 7.6999 7.6999 7.7872 7.7872 8.0591 8.0591 8.2931 8.2931 8.3347 8.3347 8.5642 8.5642 8.8554 8.8554 9.7798 9.7798 9.8753 9.8753 9.9138 9.9138 9.9661 9.9661 10.0778 10.0778 k = 0.0000 0.0000 0.2150 ( 10806 PWs) bands (ev): -48.2862 -48.2862 -48.2861 -48.2861 -24.9505 -24.9505 -24.9496 -24.9496 -24.3261 -24.3261 -24.3250 -24.3250 -24.2503 -24.2503 -24.2501 -24.2501 -1.9302 -1.9302 -1.3980 -1.3980 0.9459 0.9459 4.6726 4.6726 6.0969 6.0969 6.3398 6.3398 6.4635 6.4635 6.5834 6.5834 6.6074 6.6074 7.4239 7.4239 7.7116 7.7116 7.7874 7.7874 8.0607 8.0607 8.2922 8.2922 8.3352 8.3352 8.6027 8.6027 8.8007 8.8007 9.7857 9.7857 9.8752 9.8752 9.9143 9.9143 9.9753 9.9753 10.0780 10.0780 k = 0.0000 0.0000 0.2270 ( 10790 PWs) bands (ev): -48.2862 -48.2862 -48.2861 -48.2861 -24.9505 -24.9505 -24.9496 -24.9496 -24.3260 -24.3260 -24.3250 -24.3250 -24.2503 -24.2503 -24.2501 -24.2501 -1.9278 -1.9278 -1.4020 -1.4020 0.9491 0.9491 4.6680 4.6680 6.0971 6.0971 6.3399 6.3399 6.4635 6.4635 6.5837 6.5837 6.6074 6.6074 7.4245 7.4245 7.7156 7.7156 7.7874 7.7874 8.0614 8.0614 8.2918 8.2918 8.3353 8.3353 8.6224 8.6224 8.7757 8.7757 9.7878 9.7878 9.8751 9.8751 9.9144 9.9144 9.9785 9.9785 10.0781 10.0781 k = 0.0000 0.0000 0.2270 ( 10790 PWs) bands (ev): -48.2862 -48.2862 -48.2861 -48.2861 -24.9505 -24.9505 -24.9496 -24.9496 -24.3260 -24.3260 -24.3250 -24.3250 -24.2503 -24.2503 -24.2501 -24.2501 -1.9278 -1.9278 -1.4020 -1.4020 0.9491 0.9491 4.6680 4.6680 6.0971 6.0971 6.3399 6.3399 6.4635 6.4635 6.5837 6.5837 6.6074 6.6074 7.4245 7.4245 7.7156 7.7156 7.7874 7.7874 8.0614 8.0614 8.2918 8.2918 8.3353 8.3353 8.6224 8.6224 8.7757 8.7757 9.7878 9.7878 9.8751 9.8751 9.9144 9.9144 9.9785 9.9785 10.0781 10.0781 k = 0.0000 0.0122 0.2270 ( 10804 PWs) bands (ev): -48.2862 -48.2862 -48.2861 -48.2861 -24.9505 -24.9505 -24.9497 -24.9496 -24.3261 -24.3260 -24.3250 -24.3250 -24.2504 -24.2503 -24.2501 -24.2501 -1.9264 -1.9264 -1.4008 -1.4008 0.9495 0.9495 4.6689 4.6692 6.0948 6.0984 6.3393 6.3396 6.4610 6.4632 6.5824 6.5837 6.6070 6.6070 7.4076 7.4281 7.6957 7.7241 7.7839 7.7861 8.0498 8.0516 8.2563 8.2570 8.3734 8.3785 8.6220 8.6287 8.7817 8.7872 9.7675 9.7693 9.8793 9.8803 9.9139 9.9139 9.9901 9.9928 10.0791 10.0802 k = 0.0000 0.0244 0.2270 ( 10824 PWs) bands (ev): -48.2862 -48.2862 -48.2861 -48.2861 -24.9506 -24.9505 -24.9497 -24.9497 -24.3261 -24.3260 -24.3251 -24.3250 -24.2504 -24.2503 -24.2502 -24.2501 -1.9225 -1.9225 -1.3972 -1.3972 0.9507 0.9508 4.6719 4.6726 6.0912 6.0984 6.3377 6.3382 6.4558 6.4600 6.5798 6.5824 6.6058 6.6061 7.3771 7.4165 7.6667 7.7213 7.7740 7.7825 8.0100 8.0223 8.2236 8.2246 8.4265 8.4316 8.6280 8.6361 8.8082 8.8142 9.7251 9.7278 9.8821 9.8852 9.9113 9.9117 10.0233 10.0270 10.0838 10.0860 k = 0.0000 0.0366 0.2270 ( 10836 PWs) bands (ev): -48.2862 -48.2862 -48.2861 -48.2861 -24.9506 -24.9505 -24.9497 -24.9497 -24.3262 -24.3260 -24.3251 -24.3250 -24.2505 -24.2504 -24.2502 -24.2501 -1.9159 -1.9159 -1.3911 -1.3911 0.9528 0.9530 4.6771 4.6780 6.0863 6.0972 6.3350 6.3356 6.4480 6.4538 6.5758 6.5796 6.6038 6.6048 7.3324 7.3860 7.6342 7.7103 7.7547 7.7767 7.9449 7.9802 8.2108 8.2149 8.4745 8.4783 8.6371 8.6400 8.8539 8.8550 9.6754 9.6784 9.8799 9.8856 9.9062 9.9070 10.0649 10.0673 10.0961 10.0980 k = 0.0000 0.0488 0.2270 ( 10848 PWs) bands (ev): -48.2862 -48.2862 -48.2861 -48.2861 -24.9506 -24.9506 -24.9498 -24.9497 -24.3263 -24.3260 -24.3251 -24.3250 -24.2506 -24.2505 -24.2502 -24.2501 -1.9067 -1.9067 -1.3827 -1.3826 0.9557 0.9559 4.6843 4.6855 6.0799 6.0946 6.3310 6.3313 6.4376 6.4444 6.5702 6.5750 6.6011 6.6032 7.2734 7.3342 7.6019 7.6954 7.7217 7.7581 7.8773 7.9414 8.2132 8.2203 8.5152 8.5171 8.6405 8.6464 8.9061 8.9125 9.6233 9.6263 9.8748 9.8830 9.8988 9.9000 10.0907 10.0938 10.1307 10.1328 k = 0.0000 0.0610 0.2270 ( 10850 PWs) bands (ev): -48.2862 -48.2862 -48.2861 -48.2861 -24.9507 -24.9506 -24.9498 -24.9498 -24.3264 -24.3260 -24.3252 -24.3251 -24.2508 -24.2507 -24.2502 -24.2502 -1.8949 -1.8949 -1.3718 -1.3718 0.9594 0.9596 4.6935 4.6950 6.0717 6.0903 6.3249 6.3253 6.4247 6.4319 6.5628 6.5683 6.5977 6.6016 7.2026 7.2641 7.5623 7.6722 7.6806 7.7086 7.8416 7.9173 8.2250 8.2341 8.5469 8.5481 8.6408 8.6548 8.9629 8.9765 9.5706 9.5736 9.8679 9.8786 9.8898 9.8913 10.1052 10.1107 10.1802 10.1832 k = 0.0000 0.0732 0.2270 ( 10858 PWs) bands (ev): -48.2862 -48.2862 -48.2861 -48.2861 -24.9508 -24.9507 -24.9499 -24.9498 -24.3265 -24.3260 -24.3252 -24.3251 -24.2509 -24.2509 -24.2502 -24.2502 -1.8804 -1.8804 -1.3586 -1.3586 0.9637 0.9640 4.7047 4.7066 6.0613 6.0840 6.3154 6.3172 6.4092 6.4163 6.5532 6.5589 6.5937 6.6001 7.1237 7.1825 7.4999 7.5952 7.6506 7.6828 7.8346 7.9070 8.2429 8.2535 8.5636 8.5725 8.6457 8.6629 9.0204 9.0406 9.5185 9.5215 9.8601 9.8728 9.8796 9.8813 10.1209 10.1281 10.2325 10.2359 k = 0.0000 0.0854 0.2270 ( 10850 PWs) bands (ev): -48.2862 -48.2862 -48.2861 -48.2861 -24.9509 -24.9507 -24.9499 -24.9499 -24.3266 -24.3261 -24.3252 -24.3251 -24.2512 -24.2511 -24.2502 -24.2501 -1.8634 -1.8634 -1.3430 -1.3430 0.9686 0.9689 4.7177 4.7200 6.0482 6.0753 6.3012 6.3056 6.3910 6.3977 6.5411 6.5461 6.5892 6.5988 7.0419 7.0965 7.4153 7.4927 7.6365 7.6743 7.8366 7.9052 8.2652 8.2770 8.5643 8.5872 8.6590 8.6721 9.0748 9.1005 9.4680 9.4713 9.8517 9.8653 9.8695 9.8704 10.1391 10.1477 10.2850 10.2889 k = 0.0000 0.0976 0.2270 ( 10850 PWs) bands (ev): -48.2861 -48.2861 -48.2860 -48.2860 -24.9509 -24.9508 -24.9500 -24.9500 -24.3268 -24.3262 -24.3252 -24.3251 -24.2514 -24.2513 -24.2502 -24.2501 -1.8437 -1.8437 -1.3251 -1.3251 0.9739 0.9743 4.7327 4.7353 6.0314 6.0634 6.2800 6.2886 6.3701 6.3762 6.5262 6.5292 6.5842 6.5975 6.9625 7.0127 7.3200 7.3860 7.6312 7.6698 7.8413 7.9081 8.2907 8.3039 8.5523 8.5911 8.6777 8.6836 9.1223 9.1528 9.4206 9.4243 9.8431 9.8545 9.8592 9.8620 10.1598 10.1694 10.3366 10.3416 k = 0.0000 0.1098 0.2270 ( 10868 PWs) bands (ev): -48.2861 -48.2861 -48.2860 -48.2860 -24.9511 -24.9509 -24.9501 -24.9501 -24.3269 -24.3264 -24.3252 -24.3250 -24.2517 -24.2516 -24.2502 -24.2501 -1.8215 -1.8215 -1.3049 -1.3049 0.9795 0.9800 4.7493 4.7523 6.0100 6.0474 6.2484 6.2632 6.3462 6.3519 6.5084 6.5093 6.5788 6.5965 6.8909 6.9368 7.2218 7.2801 7.6301 7.6675 7.8465 7.9133 8.3184 8.3335 8.5323 8.5850 8.6968 8.6977 9.1590 9.1930 9.3795 9.3835 9.8345 9.8424 9.8485 9.8558 10.1824 10.1925 10.3867 10.3936 k = 0.0000 0.1220 0.2270 ( 10872 PWs) bands (ev): -48.2861 -48.2861 -48.2860 -48.2860 -24.9512 -24.9509 -24.9502 -24.9502 -24.3271 -24.3265 -24.3252 -24.3250 -24.2520 -24.2520 -24.2502 -24.2501 -1.7967 -1.7967 -1.2825 -1.2824 0.9854 0.9859 4.7674 4.7709 5.9823 6.0261 6.2027 6.2257 6.3195 6.3251 6.4853 6.4918 6.5731 6.5955 6.8311 6.8730 7.1253 7.1780 7.6314 7.6670 7.8510 7.9195 8.3461 8.3654 8.5077 8.5704 8.7107 8.7170 9.1790 9.2128 9.3528 9.3543 9.8255 9.8302 9.8393 9.8506 10.2060 10.2160 10.4349 10.4447 k = 0.0000 0.1341 0.2270 ( 10866 PWs) bands (ev): -48.2861 -48.2861 -48.2860 -48.2860 -24.9513 -24.9510 -24.9503 -24.9503 -24.3274 -24.3267 -24.3251 -24.3250 -24.2524 -24.2523 -24.2502 -24.2501 -1.7694 -1.7694 -1.2578 -1.2578 0.9912 0.9918 4.7869 4.7909 5.9465 5.9976 6.1404 6.1729 6.2906 6.2964 6.4631 6.4760 6.5670 6.5945 6.7847 6.8231 7.0340 7.0826 7.6339 7.6676 7.8540 7.9255 8.3689 8.3986 8.4840 8.5489 8.7242 8.7351 9.1764 9.2035 9.3426 9.3488 9.8156 9.8181 9.8327 9.8466 10.2292 10.2382 10.4811 10.4945 k = 0.0000 0.1463 0.2270 ( 10860 PWs) bands (ev): -48.2861 -48.2861 -48.2860 -48.2860 -24.9514 -24.9511 -24.9504 -24.9504 -24.3276 -24.3269 -24.3251 -24.3249 -24.2527 -24.2527 -24.2502 -24.2501 -1.7396 -1.7395 -1.2310 -1.2309 0.9968 0.9975 4.8075 4.8120 5.9000 5.9593 6.0634 6.1052 6.2605 6.2664 6.4444 6.4633 6.5607 6.5935 6.7503 6.7860 6.9509 6.9961 7.6371 7.6690 7.8542 7.9302 8.3728 8.4316 8.4752 8.5229 8.7369 8.7517 9.1543 9.1739 9.3458 9.3595 9.8052 9.8064 9.8292 9.8444 10.2505 10.2576 10.5251 10.5425 k = 0.0000 0.1585 0.2270 ( 10856 PWs) bands (ev): -48.2860 -48.2860 -48.2859 -48.2859 -24.9516 -24.9513 -24.9505 -24.9505 -24.3279 -24.3272 -24.3250 -24.3249 -24.2531 -24.2531 -24.2502 -24.2500 -1.7072 -1.7072 -1.2020 -1.2020 1.0021 1.0027 4.8289 4.8340 5.8405 5.9065 5.9781 6.0265 6.2302 6.2361 6.4300 6.4540 6.5541 6.5923 6.7251 6.7587 6.8782 6.9206 7.6405 7.6710 7.8507 7.9319 8.3488 8.4558 8.4913 8.5013 8.7486 8.7666 9.1230 9.1375 9.3548 9.3726 9.7949 9.7953 9.8286 9.8443 10.2682 10.2728 10.5677 10.5872 k = 0.0000 0.1707 0.2270 ( 10844 PWs) bands (ev): -48.2860 -48.2860 -48.2859 -48.2859 -24.9517 -24.9514 -24.9506 -24.9506 -24.3281 -24.3274 -24.3250 -24.3248 -24.2535 -24.2535 -24.2502 -24.2500 -1.6724 -1.6724 -1.1710 -1.1710 1.0066 1.0074 4.8505 4.8564 5.7667 5.8312 5.8959 5.9418 6.2007 6.2065 6.4193 6.4476 6.5471 6.5909 6.7064 6.7377 6.8176 6.8571 7.6437 7.6729 7.8422 7.9287 8.3110 8.4413 8.5149 8.5194 8.7590 8.7798 9.0897 9.1006 9.3637 9.3829 9.7850 9.7851 9.8308 9.8465 10.2812 10.2832 10.6097 10.6229 k = 0.0000 0.1829 0.2270 ( 10848 PWs) bands (ev): -48.2860 -48.2860 -48.2859 -48.2859 -24.9519 -24.9515 -24.9508 -24.9507 -24.3284 -24.3277 -24.3249 -24.3248 -24.2539 -24.2539 -24.2501 -24.2500 -1.6351 -1.6351 -1.1380 -1.1380 1.0103 1.0111 4.8715 4.8784 5.6795 5.7347 5.8198 5.8549 6.1727 6.1781 6.4113 6.4434 6.5397 6.5891 6.6919 6.7195 6.7705 6.8058 7.6459 7.6743 7.8275 7.9181 8.2711 8.4088 8.5437 8.5497 8.7682 8.7909 9.0583 9.0667 9.3701 9.3891 9.7757 9.7759 9.8360 9.8512 10.2887 10.2893 10.6482 10.6520 k = 0.0000 0.1951 0.2270 ( 10856 PWs) bands (ev): -48.2860 -48.2860 -48.2859 -48.2859 -24.9520 -24.9517 -24.9509 -24.9509 -24.3287 -24.3280 -24.3248 -24.3247 -24.2544 -24.2543 -24.2501 -24.2500 -1.5954 -1.5954 -1.1031 -1.1031 1.0127 1.0136 4.8906 4.8990 5.5823 5.6294 5.7425 5.7679 6.1462 6.1511 6.4052 6.4408 6.5320 6.5866 6.6802 6.6996 6.7392 6.7658 7.6463 7.6736 7.8063 7.8973 8.2356 8.3758 8.5705 8.5779 8.7762 8.7998 9.0318 9.0383 9.3734 9.3913 9.7673 9.7677 9.8440 9.8587 10.2902 10.2928 10.6710 10.6948 k = 0.0000 0.2073 0.2270 ( 10852 PWs) bands (ev): -48.2859 -48.2859 -48.2858 -48.2858 -24.9522 -24.9518 -24.9510 -24.9510 -24.3290 -24.3283 -24.3248 -24.3247 -24.2548 -24.2548 -24.2501 -24.2500 -1.5534 -1.5533 -1.0664 -1.0664 1.0137 1.0146 4.9057 4.9163 5.4799 5.5235 5.6620 5.6816 6.1212 6.1256 6.4005 6.4395 6.5241 6.5836 6.6703 6.6776 6.7220 6.7357 7.6427 7.6675 7.7806 7.8657 8.2085 8.3459 8.5905 8.6004 8.7836 8.8063 9.0125 9.0180 9.3736 9.3898 9.7599 9.7605 9.8548 9.8688 10.2887 10.2928 10.6934 10.7375 k = 0.0000 0.2195 0.2270 ( 10852 PWs) bands (ev): -48.2859 -48.2859 -48.2858 -48.2858 -24.9524 -24.9520 -24.9511 -24.9511 -24.3293 -24.3286 -24.3247 -24.3246 -24.2553 -24.2552 -24.2501 -24.2499 -1.5090 -1.5089 -1.0280 -1.0279 1.0128 1.0138 4.9127 4.9264 5.3780 5.4229 5.5798 5.5979 6.0975 6.1014 6.3967 6.4391 6.5160 6.5800 6.6580 6.6614 6.7120 6.7140 7.6310 7.6488 7.7574 7.8277 8.1907 8.3208 8.6006 8.6138 8.7910 8.8113 9.0025 9.0080 9.3709 9.3851 9.7537 9.7544 9.8685 9.8815 10.2851 10.2905 10.7147 10.7734 k = 0.0000 0.2317 0.2270 ( 10864 PWs) bands (ev): -48.2859 -48.2859 -48.2858 -48.2858 -24.9526 -24.9521 -24.9513 -24.9512 -24.3296 -24.3289 -24.3246 -24.3245 -24.2557 -24.2557 -24.2501 -24.2499 -1.4623 -1.4622 -0.9880 -0.9879 1.0098 1.0109 4.9047 4.9226 5.2846 5.3353 5.4988 5.5189 6.0748 6.0782 6.3935 6.4389 6.5082 6.5762 6.6424 6.6531 6.6990 6.7054 7.6041 7.6102 7.7447 7.7928 8.1804 8.3006 8.5990 8.6157 8.7986 8.8157 9.0033 9.0093 9.3657 9.3778 9.7486 9.7494 9.8847 9.8966 10.2806 10.2869 10.7338 10.7820 k = 0.0000 0.2439 0.2270 ( 10868 PWs) bands (ev): -48.2858 -48.2858 -48.2858 -48.2858 -24.9527 -24.9523 -24.9514 -24.9514 -24.3299 -24.3292 -24.3245 -24.3245 -24.2562 -24.2562 -24.2501 -24.2499 -1.4133 -1.4132 -0.9465 -0.9464 1.0043 1.0054 4.8723 4.8934 5.2100 5.2692 5.4223 5.4480 6.0530 6.0560 6.3906 6.4384 6.5009 6.5730 6.6299 6.6450 6.6895 6.7008 7.5542 7.5564 7.7416 7.7703 8.1748 8.2844 8.5866 8.6059 8.8052 8.8199 9.0148 9.0214 9.3582 9.3683 9.7446 9.7455 9.9033 9.9141 10.2760 10.2830 10.7502 10.7807 k = 0.0000 0.2561 0.2270 ( 10870 PWs) bands (ev): -48.2858 -48.2858 -48.2857 -48.2857 -24.9529 -24.9525 -24.9515 -24.9515 -24.3302 -24.3295 -24.3244 -24.3244 -24.2567 -24.2566 -24.2500 -24.2499 -1.3622 -1.3621 -0.9037 -0.9035 0.9959 0.9971 4.8105 4.8311 5.1593 5.2258 5.3564 5.3905 6.0320 6.0346 6.3873 6.4362 6.4949 6.5708 6.6193 6.6369 6.6846 6.6979 7.4875 7.4911 7.7436 7.7604 8.1714 8.2709 8.5659 8.5867 8.8095 8.8230 9.0356 9.0425 9.3489 9.3572 9.7417 9.7427 9.9241 9.9337 10.2719 10.2794 10.7643 10.7794 k = 0.0000 0.2683 0.2270 ( 10866 PWs) bands (ev): -48.2858 -48.2858 -48.2857 -48.2857 -24.9531 -24.9527 -24.9516 -24.9516 -24.3305 -24.3299 -24.3244 -24.3243 -24.2572 -24.2571 -24.2500 -24.2499 -1.3089 -1.3088 -0.8597 -0.8595 0.9844 0.9857 4.7248 4.7421 5.1217 5.1900 5.3123 5.3521 6.0117 6.0140 6.3832 6.4305 6.4913 6.5704 6.6090 6.6289 6.6834 6.6965 7.4151 7.4156 7.7483 7.7584 8.1681 8.2585 8.5397 8.5611 8.8111 8.8243 9.0632 9.0702 9.3382 9.3448 9.7399 9.7410 9.9470 9.9552 10.2689 10.2769 10.7767 10.7799 k = 0.0000 0.2805 0.2270 ( 10846 PWs) bands (ev): -48.2858 -48.2858 -48.2857 -48.2857 -24.9533 -24.9528 -24.9518 -24.9517 -24.3308 -24.3302 -24.3243 -24.3242 -24.2576 -24.2576 -24.2500 -24.2498 -1.2536 -1.2534 -0.8147 -0.8144 0.9693 0.9707 4.6250 4.6387 5.0836 5.1449 5.2988 5.3356 5.9921 5.9942 6.3772 6.4193 6.4908 6.5720 6.5983 6.6210 6.6854 6.6966 7.3363 7.3405 7.7545 7.7608 8.1634 8.2457 8.5101 8.5317 8.8102 8.8235 9.0955 9.1025 9.3265 9.3315 9.7392 9.7404 9.9716 9.9786 10.2674 10.2759 10.7826 10.7883 k = 0.0000 0.2927 0.2270 ( 10842 PWs) bands (ev): -48.2857 -48.2857 -48.2857 -48.2857 -24.9534 -24.9530 -24.9519 -24.9518 -24.3311 -24.3305 -24.3242 -24.3242 -24.2581 -24.2580 -24.2500 -24.2498 -1.1963 -1.1961 -0.7689 -0.7685 0.9506 0.9520 4.5184 4.5291 5.0420 5.0937 5.3063 5.3370 5.9734 5.9752 6.3680 6.4015 6.4930 6.5752 6.5869 6.6137 6.6905 6.6986 7.2572 7.2668 7.7617 7.7658 8.1561 8.2309 8.4788 8.5003 8.8075 8.8207 9.1302 9.1372 9.3143 9.3177 9.7395 9.7408 9.9978 10.0034 10.2678 10.2765 10.7877 10.7997 k = 0.0000 0.3049 0.2270 ( 10842 PWs) bands (ev): -48.2857 -48.2857 -48.2856 -48.2856 -24.9536 -24.9532 -24.9520 -24.9520 -24.3314 -24.3308 -24.3241 -24.3241 -24.2585 -24.2585 -24.2499 -24.2498 -1.1370 -1.1368 -0.7225 -0.7221 0.9278 0.9293 4.4093 4.4178 5.0001 5.0443 5.3237 5.3498 5.9554 5.9571 6.3537 6.3760 6.4970 6.5712 6.5836 6.6074 6.6985 6.7025 7.1818 7.1965 7.7696 7.7724 8.1452 8.2129 8.4467 8.4678 8.8036 8.8165 9.1656 9.1729 9.3021 9.3040 9.7408 9.7422 10.0253 10.0297 10.2701 10.2791 10.7950 10.8114 k = 0.0000 0.3171 0.2270 ( 10842 PWs) bands (ev): -48.2857 -48.2857 -48.2856 -48.2856 -24.9538 -24.9534 -24.9521 -24.9521 -24.3317 -24.3311 -24.3240 -24.3240 -24.2590 -24.2589 -24.2499 -24.2498 -1.0760 -1.0757 -0.6758 -0.6752 0.9008 0.9023 4.3002 4.3070 4.9614 5.0003 5.3456 5.3686 5.9383 5.9398 6.3320 6.3422 6.5017 6.5581 6.5908 6.6027 6.7089 6.7097 7.1128 7.1316 7.7782 7.7801 8.1299 8.1907 8.4146 8.4349 8.7994 8.8115 9.1999 9.2080 9.2909 9.2910 9.7430 9.7444 10.0538 10.0570 10.2744 10.2836 10.8042 10.8238 k = 0.0000 0.3293 0.2270 ( 10850 PWs) bands (ev): -48.2856 -48.2856 -48.2856 -48.2856 -24.9539 -24.9536 -24.9522 -24.9522 -24.3320 -24.3314 -24.3240 -24.3240 -24.2594 -24.2593 -24.2499 -24.2497 -1.0133 -1.0129 -0.6289 -0.6283 0.8695 0.8711 4.1929 4.1982 4.9282 4.9634 5.3692 5.3905 5.9221 5.9234 6.2993 6.3005 6.5061 6.5449 6.5999 6.6002 6.7183 6.7241 7.0522 7.0739 7.7874 7.7886 8.1097 8.1637 8.3827 8.4020 8.7954 8.8064 9.2289 9.2384 9.2821 9.2846 9.7459 9.7474 10.0832 10.0853 10.2806 10.2899 10.8152 10.8368 k = 0.0000 0.3415 0.2270 ( 10864 PWs) bands (ev): -48.2856 -48.2856 -48.2856 -48.2856 -24.9541 -24.9537 -24.9523 -24.9523 -24.3322 -24.3317 -24.3239 -24.3239 -24.2598 -24.2598 -24.2499 -24.2497 -0.9490 -0.9486 -0.5823 -0.5815 0.8338 0.8355 4.0884 4.0926 4.9017 4.9343 5.3932 5.4136 5.9068 5.9080 6.2472 6.2573 6.5096 6.5335 6.6001 6.6096 6.7315 6.7421 7.0011 7.0241 7.7970 7.7978 8.0842 8.1316 8.3512 8.3692 8.7922 8.8019 9.2405 9.2483 9.2930 9.2944 9.7496 9.7512 10.1131 10.1141 10.2885 10.2980 10.8277 10.8505 k = 0.0000 0.3537 0.2270 ( 10876 PWs) bands (ev): -48.2856 -48.2856 -48.2855 -48.2855 -24.9542 -24.9539 -24.9524 -24.9524 -24.3325 -24.3320 -24.3238 -24.3238 -24.2602 -24.2601 -24.2498 -24.2497 -0.8834 -0.8828 -0.5361 -0.5351 0.7938 0.7955 3.9876 3.9910 4.8826 4.9133 5.4167 5.4367 5.8925 5.8935 6.1865 6.2025 6.5119 6.5244 6.6023 6.6191 6.7494 6.7640 6.9597 6.9826 7.8070 7.8076 8.0537 8.0944 8.3200 8.3365 8.7902 8.7984 9.2350 9.2395 9.3202 9.3213 9.7539 9.7555 10.1432 10.1433 10.2980 10.3075 10.8414 10.8647 k = 0.0000 0.3659 0.2270 ( 10864 PWs) bands (ev): -48.2856 -48.2856 -48.2855 -48.2855 -24.9544 -24.9540 -24.9525 -24.9525 -24.3327 -24.3322 -24.3238 -24.3238 -24.2605 -24.2605 -24.2498 -24.2497 -0.8166 -0.8159 -0.4907 -0.4896 0.7495 0.7513 3.8915 3.8942 4.8714 4.9008 5.4389 5.4591 5.8793 5.8801 6.1186 6.1373 6.5130 6.5176 6.6062 6.6276 6.7722 6.7900 6.9272 6.9486 7.8173 7.8176 8.0183 8.0527 8.2892 8.3041 8.7895 8.7962 9.2247 9.2275 9.3492 9.3513 9.7586 9.7602 10.1724 10.1732 10.3085 10.3181 10.8561 10.8794 k = 0.0000 0.3780 0.2270 ( 10852 PWs) bands (ev): -48.2855 -48.2855 -48.2855 -48.2855 -24.9545 -24.9542 -24.9526 -24.9526 -24.3329 -24.3325 -24.3237 -24.3237 -24.2609 -24.2608 -24.2498 -24.2497 -0.7488 -0.7480 -0.4465 -0.4450 0.7012 0.7030 3.8006 3.8028 4.8681 4.8966 5.4594 5.4803 5.8671 5.8678 6.0450 6.0642 6.5128 6.5132 6.6111 6.6347 6.8000 6.8201 6.9025 6.9213 7.8275 7.8275 7.9789 8.0072 8.2588 8.2720 8.7902 8.7955 9.2133 9.2152 9.3774 9.3799 9.7637 9.7654 10.2013 10.2027 10.3199 10.3295 10.8714 10.8943 k = 0.0000 0.3902 0.2270 ( 10856 PWs) bands (ev): -48.2855 -48.2855 -48.2855 -48.2855 -24.9546 -24.9543 -24.9527 -24.9526 -24.3331 -24.3327 -24.3237 -24.3237 -24.2612 -24.2611 -24.2498 -24.2497 -0.6806 -0.6796 -0.4035 -0.4017 0.6490 0.6508 3.7158 3.7174 4.8727 4.9006 5.4776 5.5000 5.8559 5.8565 5.9677 5.9855 6.5094 6.5128 6.6167 6.6405 6.8312 6.8543 6.8855 6.8996 7.8355 7.8364 7.9375 7.9597 8.2289 8.2405 8.7922 8.7961 9.2020 9.2033 9.4037 9.4063 9.7691 9.7707 10.2294 10.2315 10.3317 10.3412 10.8870 10.9091 k = 0.0000 0.4024 0.2270 ( 10850 PWs) bands (ev): -48.2855 -48.2855 -48.2855 -48.2855 -24.9547 -24.9544 -24.9527 -24.9527 -24.3333 -24.3329 -24.3236 -24.3236 -24.2614 -24.2614 -24.2498 -24.2497 -0.6123 -0.6111 -0.3620 -0.3599 0.5932 0.5951 3.6375 3.6389 4.8851 4.9127 5.4929 5.5179 5.8459 5.8464 5.8887 5.9033 6.5071 6.5121 6.6223 6.6451 6.8536 6.8802 6.8866 6.8946 7.8348 7.8386 7.9018 7.9162 8.1997 8.2097 8.7950 8.7979 9.1912 9.1920 9.4277 9.4302 9.7745 9.7760 10.2564 10.2591 10.3435 10.3529 10.9028 10.9237 k = 0.0000 0.4146 0.2270 ( 10856 PWs) bands (ev): -48.2855 -48.2855 -48.2855 -48.2855 -24.9548 -24.9546 -24.9528 -24.9528 -24.3334 -24.3331 -24.3236 -24.3236 -24.2617 -24.2617 -24.2497 -24.2496 -0.5449 -0.5434 -0.3219 -0.3193 0.5343 0.5363 3.5666 3.5676 4.9050 4.9325 5.5044 5.5337 5.8102 5.8189 5.8371 5.8378 6.5056 6.5112 6.6277 6.6486 6.8503 6.8677 6.9210 6.9352 7.8074 7.8161 7.8903 7.8955 8.1714 8.1799 8.7985 8.8006 9.1810 9.1815 9.4491 9.4515 9.7799 9.7813 10.2819 10.2851 10.3549 10.3641 10.9182 10.9377 k = 0.0000 0.4268 0.2270 ( 10854 PWs) bands (ev): -48.2855 -48.2855 -48.2854 -48.2854 -24.9549 -24.9547 -24.9528 -24.9528 -24.3336 -24.3333 -24.3235 -24.3235 -24.2619 -24.2619 -24.2497 -24.2496 -0.4796 -0.4777 -0.2827 -0.2795 0.4727 0.4747 3.5036 3.5044 4.9321 4.9598 5.5101 5.5475 5.7351 5.7354 5.8293 5.8297 6.5046 6.5102 6.6327 6.6512 6.8433 6.8569 6.9653 6.9799 7.7598 7.7678 7.8974 7.8996 8.1439 8.1511 8.8024 8.8038 9.1717 9.1720 9.4678 9.4699 9.7850 9.7862 10.3054 10.3092 10.3655 10.3744 10.9331 10.9509 k = 0.0000 0.4390 0.2270 ( 10854 PWs) bands (ev): -48.2855 -48.2855 -48.2854 -48.2854 -24.9549 -24.9548 -24.9529 -24.9529 -24.3337 -24.3334 -24.3235 -24.3235 -24.2621 -24.2621 -24.2497 -24.2496 -0.4188 -0.4164 -0.2429 -0.2392 0.4089 0.4110 3.4491 3.4497 4.9660 4.9940 5.5047 5.5588 5.6523 5.6704 5.8228 5.8231 6.5041 6.5092 6.6373 6.6530 6.8376 6.8483 7.0131 7.0270 7.7063 7.7117 7.9100 7.9115 8.1175 8.1236 8.8063 8.8072 9.1634 9.1636 9.4837 9.4855 9.7897 9.7908 10.3266 10.3308 10.3749 10.3835 10.9471 10.9627 k = 0.0000 0.4512 0.2270 ( 10848 PWs) bands (ev): -48.2855 -48.2855 -48.2854 -48.2854 -24.9550 -24.9548 -24.9529 -24.9529 -24.3338 -24.3336 -24.3235 -24.3235 -24.2623 -24.2623 -24.2497 -24.2496 -0.3655 -0.3630 -0.2001 -0.1960 0.3436 0.3458 3.4036 3.4041 5.0062 5.0347 5.4785 5.5584 5.5811 5.6260 5.8174 5.8176 6.5039 6.5082 6.6414 6.6541 6.8333 6.8416 7.0626 7.0751 7.6513 7.6543 7.9249 7.9262 8.0922 8.0973 8.8100 8.8105 9.1564 9.1564 9.4967 9.4982 9.7938 9.7947 10.3450 10.3495 10.3828 10.3909 10.9597 10.9728 k = 0.0000 0.4634 0.2270 ( 10852 PWs) bands (ev): -48.2854 -48.2854 -48.2854 -48.2854 -24.9550 -24.9549 -24.9530 -24.9530 -24.3338 -24.3337 -24.3235 -24.3235 -24.2624 -24.2624 -24.2497 -24.2496 -0.3234 -0.3211 -0.1520 -0.1479 0.2780 0.2803 3.3677 3.3680 5.0519 5.0811 5.4289 5.4890 5.5797 5.6057 5.8132 5.8133 6.5039 6.5073 6.6450 6.6546 6.8304 6.8365 7.1117 7.1223 7.5979 7.5987 7.9410 7.9425 8.0682 8.0724 8.8131 8.8134 9.1507 9.1507 9.5068 9.5080 9.7972 9.7979 10.3603 10.3650 10.3889 10.3963 10.9706 10.9809 k = 0.0000 0.4756 0.2270 ( 10858 PWs) bands (ev): -48.2854 -48.2854 -48.2854 -48.2854 -24.9550 -24.9550 -24.9530 -24.9530 -24.3339 -24.3338 -24.3234 -24.3234 -24.2625 -24.2625 -24.2497 -24.2496 -0.2942 -0.2925 -0.0992 -0.0955 0.2142 0.2165 3.3418 3.3420 5.1023 5.1317 5.3690 5.4149 5.5853 5.5984 5.8102 5.8103 6.5042 6.5065 6.6480 6.6544 6.8287 6.8327 7.1570 7.1653 7.5492 7.5498 7.9580 7.9596 8.0457 8.0492 8.8156 8.8157 9.1465 9.1465 9.5141 9.5150 9.7998 9.8002 10.3722 10.3767 10.3932 10.3995 10.9793 10.9864 k = 0.0000 0.4878 0.2270 ( 10858 PWs) bands (ev): -48.2854 -48.2854 -48.2854 -48.2854 -24.9550 -24.9550 -24.9530 -24.9530 -24.3339 -24.3338 -24.3234 -24.3234 -24.2625 -24.2625 -24.2496 -24.2496 -0.2773 -0.2765 -0.0484 -0.0458 0.1584 0.1603 3.3261 3.3262 5.1546 5.1811 5.3130 5.3468 5.5897 5.5953 5.8084 5.8085 6.5046 6.5057 6.6505 6.6537 6.8281 6.8301 7.1924 7.1972 7.5125 7.5134 7.9749 7.9765 8.0259 8.0284 8.8171 8.8171 9.1439 9.1439 9.5186 9.5190 9.8014 9.8016 10.3805 10.3836 10.3962 10.4003 10.9855 10.9891 k = 0.0000 0.5000 0.2270 ( 10856 PWs) bands (ev): -48.2854 -48.2854 -48.2854 -48.2854 -24.9550 -24.9550 -24.9530 -24.9530 -24.3339 -24.3339 -24.3234 -24.3234 -24.2625 -24.2625 -24.2496 -24.2496 -0.2716 -0.2716 -0.0217 -0.0217 0.1322 0.1322 3.3209 3.3209 5.1964 5.1964 5.2975 5.2975 5.5928 5.5928 5.8078 5.8078 6.5051 6.5051 6.6524 6.6524 6.8286 6.8286 7.2080 7.2080 7.4987 7.4987 7.9858 7.9858 8.0159 8.0159 8.8176 8.8176 9.1431 9.1431 9.5202 9.5202 9.8020 9.8020 10.3846 10.3846 10.3989 10.3989 10.9888 10.9888 k = 0.0000 0.5000 0.2270 ( 10856 PWs) bands (ev): -48.2854 -48.2854 -48.2854 -48.2854 -24.9550 -24.9550 -24.9530 -24.9530 -24.3339 -24.3339 -24.3234 -24.3234 -24.2625 -24.2625 -24.2496 -24.2496 -0.2716 -0.2716 -0.0217 -0.0217 0.1322 0.1322 3.3209 3.3209 5.1964 5.1964 5.2975 5.2975 5.5928 5.5928 5.8078 5.8078 6.5051 6.5051 6.6524 6.6524 6.8286 6.8286 7.2080 7.2080 7.4987 7.4987 7.9858 7.9858 8.0159 8.0159 8.8176 8.8176 9.1431 9.1431 9.5202 9.5202 9.8020 9.8020 10.3846 10.3846 10.3989 10.3989 10.9888 10.9888 k = 0.0122 0.5000 0.2270 ( 10856 PWs) bands (ev): -48.2854 -48.2854 -48.2854 -48.2854 -24.9550 -24.9550 -24.9530 -24.9530 -24.3339 -24.3339 -24.3235 -24.3234 -24.2626 -24.2625 -24.2497 -24.2496 -0.2708 -0.2707 -0.0208 -0.0208 0.1330 0.1331 3.3222 3.3226 5.1964 5.1965 5.2966 5.2997 5.5913 5.5953 5.8082 5.8086 6.5047 6.5047 6.6523 6.6525 6.8280 6.8281 7.2073 7.2088 7.4942 7.5043 7.9792 7.9875 8.0036 8.0245 8.8128 8.8184 9.1419 9.1432 9.5161 9.5198 9.8002 9.8008 10.3848 10.3849 10.3992 10.3992 10.9871 10.9878 k = 0.0244 0.5000 0.2270 ( 10868 PWs) bands (ev): -48.2854 -48.2854 -48.2854 -48.2854 -24.9551 -24.9550 -24.9531 -24.9530 -24.3339 -24.3338 -24.3236 -24.3234 -24.2626 -24.2625 -24.2497 -24.2497 -0.2682 -0.2681 -0.0183 -0.0181 0.1355 0.1356 3.3264 3.3271 5.1963 5.1966 5.2969 5.3032 5.5907 5.5986 5.8098 5.8104 6.5035 6.5036 6.6522 6.6526 6.8265 6.8266 7.2065 7.2095 7.4907 7.5109 7.9676 7.9842 7.9875 8.0293 8.8041 8.8152 9.1397 9.1422 9.5074 9.5149 9.7954 9.7965 10.3854 10.3855 10.4001 10.4001 10.9825 10.9841 k = 0.0366 0.5000 0.2270 ( 10868 PWs) bands (ev): -48.2854 -48.2854 -48.2854 -48.2854 -24.9551 -24.9550 -24.9531 -24.9530 -24.3338 -24.3338 -24.3237 -24.3234 -24.2626 -24.2625 -24.2498 -24.2497 -0.2639 -0.2638 -0.0140 -0.0138 0.1397 0.1399 3.3335 3.3347 5.1960 5.1967 5.2984 5.3079 5.5911 5.6028 5.8125 5.8132 6.5016 6.5017 6.6521 6.6527 6.8238 6.8242 7.2057 7.2101 7.4883 7.5185 7.9511 7.9678 7.9761 8.0305 8.7912 8.8079 9.1364 9.1401 9.4941 9.5054 9.7876 9.7892 10.3864 10.3865 10.4015 10.4016 10.9749 10.9778 k = 0.0488 0.5000 0.2270 ( 10868 PWs) bands (ev): -48.2854 -48.2854 -48.2854 -48.2854 -24.9551 -24.9550 -24.9532 -24.9530 -24.3338 -24.3338 -24.3238 -24.3235 -24.2626 -24.2625 -24.2500 -24.2499 -0.2580 -0.2577 -0.0080 -0.0078 0.1456 0.1458 3.3435 3.3451 5.1953 5.1966 5.3013 5.3138 5.5928 5.6078 5.8164 5.8171 6.4988 6.4993 6.6521 6.6527 6.8197 6.8209 7.2048 7.2107 7.4870 7.5270 7.9298 7.9445 7.9633 8.0283 8.7742 8.7966 9.1321 9.1369 9.4760 9.4916 9.7768 9.7791 10.3877 10.3878 10.4035 10.4036 10.9643 10.9689 k = 0.0610 0.5000 0.2270 ( 10852 PWs) bands (ev): -48.2854 -48.2854 -48.2854 -48.2854 -24.9552 -24.9551 -24.9533 -24.9530 -24.3338 -24.3338 -24.3239 -24.3235 -24.2626 -24.2625 -24.2502 -24.2500 -0.2503 -0.2500 -0.0003 -0.0000 0.1531 0.1534 3.3565 3.3585 5.1940 5.1964 5.3053 5.3210 5.5958 5.6139 5.8213 5.8217 6.4951 6.4963 6.6521 6.6527 6.8143 6.8166 7.2038 7.2113 7.4868 7.5364 7.9039 7.9178 7.9459 8.0227 8.7528 8.7809 9.1265 9.1326 9.4533 9.4734 9.7631 9.7661 10.3893 10.3895 10.4060 10.4061 10.9504 10.9576 k = 0.0732 0.5000 0.2270 ( 10872 PWs) bands (ev): -48.2854 -48.2854 -48.2854 -48.2854 -24.9552 -24.9551 -24.9534 -24.9531 -24.3338 -24.3337 -24.3241 -24.3236 -24.2626 -24.2624 -24.2504 -24.2502 -0.2409 -0.2406 0.0091 0.0094 0.1622 0.1626 3.3723 3.3748 5.1920 5.1957 5.3106 5.3292 5.6002 5.6210 5.8272 5.8273 6.4905 6.4929 6.6520 6.6524 6.8074 6.8114 7.2027 7.2118 7.4876 7.5466 7.8736 7.8878 7.9242 8.0140 8.7271 8.7609 9.1198 9.1269 9.4257 9.4509 9.7466 9.7503 10.3912 10.3915 10.4089 10.4091 10.9326 10.9442 k = 0.0854 0.5000 0.2270 ( 10872 PWs) bands (ev): -48.2854 -48.2854 -48.2854 -48.2853 -24.9553 -24.9551 -24.9535 -24.9531 -24.3337 -24.3337 -24.3243 -24.3237 -24.2626 -24.2624 -24.2506 -24.2504 -0.2299 -0.2295 0.0201 0.0205 0.1729 0.1734 3.3910 3.3939 5.1889 5.1944 5.3169 5.3385 5.6063 5.6293 5.8332 5.8343 6.4851 6.4891 6.6518 6.6518 6.7989 6.8050 7.2015 7.2123 7.4894 7.5575 7.8394 7.8549 7.8984 8.0024 8.6967 8.7363 9.1118 9.1199 9.3933 9.4241 9.7272 9.7318 10.3934 10.3937 10.4122 10.4125 10.9097 10.9288 k = 0.0976 0.5000 0.2270 ( 10872 PWs) bands (ev): -48.2854 -48.2854 -48.2853 -48.2853 -24.9553 -24.9552 -24.9536 -24.9532 -24.3337 -24.3336 -24.3245 -24.3238 -24.2626 -24.2624 -24.2509 -24.2506 -0.2173 -0.2168 0.0327 0.0331 0.1852 0.1857 3.4126 3.4160 5.1845 5.1923 5.3243 5.3487 5.6141 5.6388 5.8398 5.8420 6.4790 6.4850 6.6507 6.6515 6.7890 6.7976 7.2001 7.2127 7.4920 7.5689 7.8017 7.8195 7.8689 7.9884 8.6616 8.7069 9.1024 9.1114 9.3561 9.3930 9.7051 9.7106 10.3957 10.3960 10.4158 10.4162 10.8778 10.9120 k = 0.1098 0.5000 0.2270 ( 10876 PWs) bands (ev): -48.2853 -48.2853 -48.2853 -48.2853 -24.9554 -24.9552 -24.9538 -24.9533 -24.3336 -24.3336 -24.3247 -24.3240 -24.2626 -24.2624 -24.2511 -24.2509 -0.2030 -0.2025 0.0470 0.0474 0.1990 0.1995 3.4370 3.4409 5.1788 5.1892 5.3325 5.3598 5.6238 5.6498 5.8468 5.8505 6.4720 6.4807 6.6488 6.6510 6.7778 6.7889 7.1984 7.2129 7.4953 7.5805 7.7612 7.7819 7.8360 7.9723 8.6217 8.6727 9.0917 9.1015 9.3141 9.3578 9.6801 9.6868 10.3981 10.3985 10.4197 10.4203 10.8301 10.8754 k = 0.1220 0.5000 0.2270 ( 10876 PWs) bands (ev): -48.2853 -48.2853 -48.2853 -48.2853 -24.9555 -24.9553 -24.9539 -24.9534 -24.3336 -24.3335 -24.3249 -24.3242 -24.2626 -24.2623 -24.2515 -24.2512 -0.1872 -0.1866 0.0627 0.0632 0.2142 0.2147 3.4641 3.4686 5.1715 5.1849 5.3412 5.3716 5.6354 5.6623 5.8539 5.8594 6.4642 6.4761 6.6458 6.6502 6.7656 6.7789 7.1964 7.2131 7.4993 7.5914 7.7193 7.7428 7.8001 7.9545 8.5770 8.6333 9.0795 9.0899 9.2675 9.3187 9.6523 9.6604 10.4006 10.4011 10.4239 10.4246 10.7664 10.7938 k = 0.1341 0.5000 0.2270 ( 10872 PWs) bands (ev): -48.2853 -48.2853 -48.2853 -48.2853 -24.9556 -24.9553 -24.9540 -24.9535 -24.3335 -24.3334 -24.3252 -24.3244 -24.2625 -24.2623 -24.2518 -24.2515 -0.1698 -0.1692 0.0800 0.0805 0.2307 0.2313 3.4941 3.4991 5.1625 5.1792 5.3504 5.3837 5.6488 5.6763 5.8610 5.8686 6.4557 6.4715 6.6411 6.6488 6.7529 6.7677 7.1939 7.2131 7.5036 7.5984 7.6794 7.7028 7.7618 7.9355 8.5275 8.5888 9.0657 9.0767 9.2166 9.2757 9.6217 9.6314 10.4031 10.4037 10.4282 10.4292 10.6975 10.7174 k = 0.1463 0.5000 0.2270 ( 10864 PWs) bands (ev): -48.2853 -48.2853 -48.2852 -48.2852 -24.9556 -24.9554 -24.9542 -24.9536 -24.3335 -24.3334 -24.3255 -24.3246 -24.2625 -24.2623 -24.2522 -24.2518 -0.1509 -0.1502 0.0987 0.0992 0.2486 0.2493 3.5268 3.5323 5.1518 5.1719 5.3597 5.3961 5.6642 5.6920 5.8678 5.8778 6.4464 6.4668 6.6340 6.6467 6.7406 6.7554 7.1909 7.2129 7.5080 7.5894 7.6543 7.6629 7.7216 7.9159 8.4732 8.5390 9.0504 9.0616 9.1620 9.2292 9.5881 9.5996 10.4056 10.4062 10.4326 10.4339 10.6311 10.6474 k = 0.1585 0.5000 0.2270 ( 10860 PWs) bands (ev): -48.2852 -48.2852 -48.2852 -48.2852 -24.9557 -24.9554 -24.9543 -24.9537 -24.3334 -24.3333 -24.3257 -24.3248 -24.2625 -24.2622 -24.2526 -24.2522 -0.1305 -0.1299 0.1188 0.1193 0.2677 0.2684 3.5621 3.5683 5.1394 5.1631 5.3686 5.4083 5.6813 5.7093 5.8742 5.8867 6.4363 6.4621 6.6235 6.6433 6.7297 6.7424 7.1871 7.2125 7.5122 7.5549 7.6228 7.6550 7.6801 7.8961 8.4145 8.4840 9.0333 9.0447 9.1044 9.1797 9.5515 9.5650 10.4079 10.4086 10.4370 10.4388 10.5709 10.5845 k = 0.1707 0.5000 0.2270 ( 10860 PWs) bands (ev): -48.2852 -48.2852 -48.2852 -48.2852 -24.9558 -24.9555 -24.9545 -24.9538 -24.3333 -24.3332 -24.3260 -24.3251 -24.2625 -24.2622 -24.2530 -24.2526 -0.1088 -0.1081 0.1403 0.1408 0.2880 0.2886 3.6001 3.6070 5.1253 5.1525 5.3770 5.4201 5.7001 5.7281 5.8798 5.8948 6.4255 6.4573 6.6092 6.6380 6.7208 6.7295 7.1822 7.2119 7.5109 7.5160 7.5844 7.6379 7.6650 7.8767 8.3516 8.4241 9.0135 9.0258 9.0454 9.1277 9.5117 9.5276 10.4096 10.4106 10.4410 10.4437 10.5185 10.5293 k = 0.1829 0.5000 0.2270 ( 10860 PWs) bands (ev): -48.2852 -48.2852 -48.2852 -48.2852 -24.9559 -24.9556 -24.9547 -24.9540 -24.3333 -24.3332 -24.3263 -24.3253 -24.2625 -24.2622 -24.2534 -24.2530 -0.0857 -0.0849 0.1630 0.1635 0.3092 0.3099 3.6406 3.6483 5.1094 5.1403 5.3843 5.4308 5.7204 5.7485 5.8843 5.9017 6.4139 6.4525 6.5913 6.6300 6.7142 6.7175 7.1759 7.2111 7.4657 7.5191 7.5480 7.5959 7.6774 7.8581 8.2851 8.3596 8.9768 9.0000 9.0047 9.0738 9.4688 9.4873 10.4101 10.4117 10.4426 10.4483 10.4772 10.4826 k = 0.1951 0.5000 0.2270 ( 10864 PWs) bands (ev): -48.2852 -48.2852 -48.2851 -48.2851 -24.9560 -24.9557 -24.9548 -24.9541 -24.3332 -24.3331 -24.3266 -24.3256 -24.2624 -24.2621 -24.2538 -24.2534 -0.0613 -0.0605 0.1868 0.1873 0.3314 0.3321 3.6836 3.6922 5.0920 5.1263 5.3901 5.4401 5.7418 5.7703 5.8876 5.9070 6.4015 6.4474 6.5705 6.6187 6.7074 6.7097 7.1678 7.2099 7.4225 7.5142 7.5213 7.5547 7.6902 7.8406 8.2155 8.2910 8.9164 8.9757 8.9806 9.0192 9.4230 9.4442 10.4046 10.4091 10.4329 10.4429 10.4566 10.4601 k = 0.2073 0.5000 0.2270 ( 10860 PWs) bands (ev): -48.2851 -48.2851 -48.2851 -48.2851 -24.9561 -24.9558 -24.9550 -24.9543 -24.3331 -24.3330 -24.3269 -24.3259 -24.2624 -24.2621 -24.2543 -24.2539 -0.0357 -0.0349 0.2118 0.2122 0.3545 0.3551 3.7290 3.7385 5.0730 5.1106 5.3939 5.4472 5.7640 5.7934 5.8895 5.9099 6.3884 6.4420 6.5482 6.6041 6.6997 6.7067 7.1574 7.2084 7.3829 7.4834 7.5151 7.5225 7.7024 7.8243 8.1435 8.2191 8.8537 8.9494 8.9514 8.9684 9.3744 9.3987 10.3850 10.3928 10.4257 10.4284 10.4600 10.4614 k = 0.2195 0.5000 0.2270 ( 10856 PWs) bands (ev): -48.2851 -48.2851 -48.2851 -48.2851 -24.9562 -24.9559 -24.9552 -24.9544 -24.3330 -24.3329 -24.3272 -24.3262 -24.2624 -24.2621 -24.2547 -24.2543 -0.0089 -0.0081 0.2377 0.2381 0.3781 0.3788 3.7768 3.7873 5.0525 5.0934 5.3952 5.4516 5.7860 5.8175 5.8901 5.9099 6.3747 6.4358 6.5258 6.5870 6.6941 6.7048 7.1444 7.2065 7.3486 7.4561 7.4780 7.5225 7.7134 7.8092 8.0699 8.1447 8.7909 8.8999 8.9251 8.9328 9.3238 9.3514 10.3620 10.3685 10.4252 10.4265 10.4648 10.4655 k = 0.2317 0.5000 0.2270 ( 10860 PWs) bands (ev): -48.2851 -48.2851 -48.2851 -48.2850 -24.9563 -24.9560 -24.9554 -24.9546 -24.3329 -24.3328 -24.3276 -24.3265 -24.2623 -24.2620 -24.2552 -24.2547 0.0189 0.0197 0.2645 0.2649 0.4024 0.4030 3.8268 3.8384 5.0309 5.0746 5.3935 5.4526 5.8061 5.8425 5.8908 5.9066 6.3608 6.4279 6.5051 6.5686 6.6902 6.7035 7.1292 7.2041 7.3202 7.4326 7.4440 7.5216 7.7227 7.7949 7.9955 8.0687 8.7287 8.8441 8.8960 8.9005 9.2723 9.3030 10.3425 10.3470 10.4262 10.4273 10.4697 10.4700 k = 0.2439 0.5000 0.2270 ( 10844 PWs) bands (ev): -48.2850 -48.2850 -48.2850 -48.2850 -24.9564 -24.9561 -24.9555 -24.9548 -24.3328 -24.3327 -24.3279 -24.3268 -24.2623 -24.2620 -24.2556 -24.2552 0.0476 0.0485 0.2921 0.2924 0.4270 0.4275 3.8789 3.8918 5.0081 5.0545 5.3885 5.4494 5.8202 5.8670 5.8948 5.9002 6.3471 6.4174 6.4881 6.5499 6.6873 6.7027 7.1128 7.2012 7.2977 7.4129 7.4140 7.5200 7.7295 7.7808 7.9211 7.9924 8.6673 8.7877 8.8630 8.8653 9.2214 9.2549 10.3274 10.3299 10.4275 10.4285 10.4744 10.4747 k = 0.2561 0.5000 0.2270 ( 10828 PWs) bands (ev): -48.2850 -48.2850 -48.2850 -48.2850 -24.9565 -24.9562 -24.9557 -24.9550 -24.3328 -24.3327 -24.3282 -24.3271 -24.2623 -24.2620 -24.2561 -24.2557 0.0773 0.0781 0.3203 0.3206 0.4518 0.4523 3.9329 3.9472 4.9844 5.0332 5.3797 5.4415 5.8231 5.8779 5.9032 5.9070 6.3341 6.4038 6.4759 6.5319 6.6850 6.7021 7.0969 7.1978 7.2802 7.3885 7.3971 7.5180 7.7332 7.7661 7.8475 7.9166 8.6070 8.7317 8.8251 8.8262 9.1732 9.2087 10.3166 10.3171 10.4289 10.4298 10.4790 10.4793 k = 0.2683 0.5000 0.2270 ( 10840 PWs) bands (ev): -48.2850 -48.2850 -48.2850 -48.2850 -24.9566 -24.9562 -24.9559 -24.9551 -24.3327 -24.3326 -24.3285 -24.3274 -24.2622 -24.2619 -24.2565 -24.2561 0.1076 0.1085 0.3490 0.3492 0.4767 0.4772 3.9886 4.0046 4.9600 5.0109 5.3670 5.4283 5.8141 5.8628 5.9273 5.9273 6.3226 6.3882 6.4683 6.5150 6.6832 6.7017 7.0832 7.1938 7.2667 7.3681 7.3850 7.5159 7.7328 7.7496 7.7755 7.8429 8.5479 8.6763 8.7812 8.7824 9.1298 9.1660 10.3084 10.3098 10.4302 10.4311 10.4832 10.4837 k = 0.2805 0.5000 0.2270 ( 10840 PWs) bands (ev): -48.2849 -48.2849 -48.2849 -48.2849 -24.9567 -24.9563 -24.9561 -24.9553 -24.3326 -24.3325 -24.3288 -24.3277 -24.2622 -24.2619 -24.2570 -24.2566 0.1386 0.1395 0.3780 0.3782 0.5015 0.5018 4.0460 4.0638 4.9352 4.9878 5.3505 5.4098 5.7965 5.8392 5.9521 5.9547 6.3131 6.3723 6.4639 6.4996 6.6818 6.7013 7.0732 7.1891 7.2561 7.3531 7.3766 7.5141 7.7055 7.7281 7.7284 7.7742 8.4899 8.6218 8.7307 8.7339 9.0930 9.1283 10.3033 10.3064 10.4314 10.4322 10.4868 10.4878 k = 0.2927 0.5000 0.2270 ( 10832 PWs) bands (ev): -48.2849 -48.2849 -48.2849 -48.2849 -24.9568 -24.9564 -24.9562 -24.9555 -24.3325 -24.3324 -24.3291 -24.3280 -24.2621 -24.2619 -24.2574 -24.2570 0.1701 0.1710 0.4073 0.4073 0.5259 0.5262 4.1046 4.1245 4.9102 4.9642 5.3301 5.3859 5.7724 5.8094 5.9791 5.9829 6.3063 6.3575 6.4618 6.4858 6.6805 6.7009 7.0677 7.1837 7.2478 7.3436 7.3715 7.5125 7.6386 7.6876 7.7174 7.7254 8.4332 8.5683 8.6740 8.6810 9.0637 9.0967 10.3014 10.3063 10.4325 10.4331 10.4894 10.4912 k = 0.3049 0.5000 0.2270 ( 10824 PWs) bands (ev): -48.2849 -48.2849 -48.2849 -48.2849 -24.9569 -24.9565 -24.9564 -24.9557 -24.3324 -24.3324 -24.3294 -24.3284 -24.2621 -24.2618 -24.2578 -24.2574 0.2020 0.2029 0.4365 0.4365 0.5498 0.5501 4.1643 4.1866 4.8853 4.9405 5.3065 5.3572 5.7431 5.7742 6.0070 6.0111 6.3022 6.3447 6.4610 6.4737 6.6795 6.7004 7.0668 7.1776 7.2413 7.3397 7.3696 7.5112 7.5751 7.6272 7.6970 7.7006 8.3778 8.5160 8.6124 8.6250 9.0421 9.0715 10.3025 10.3089 10.4337 10.4340 10.4888 10.4913 k = 0.3171 0.5000 0.2270 ( 10816 PWs) bands (ev): -48.2848 -48.2848 -48.2848 -48.2848 -24.9569 -24.9566 -24.9565 -24.9558 -24.3323 -24.3323 -24.3296 -24.3287 -24.2621 -24.2618 -24.2582 -24.2579 0.2340 0.2349 0.4655 0.4656 0.5730 0.5732 4.2246 4.2497 4.8609 4.9168 5.2803 5.3243 5.7092 5.7341 6.0351 6.0393 6.3009 6.3341 6.4613 6.4630 6.6788 6.6998 7.0700 7.1708 7.2368 7.3410 7.3706 7.5091 7.5155 7.5673 7.6701 7.6769 8.3237 8.4649 8.5476 8.5671 9.0274 9.0528 10.3061 10.3141 10.4346 10.4348 10.4824 10.4825 k = 0.3293 0.5000 0.2270 ( 10812 PWs) bands (ev): -48.2848 -48.2848 -48.2848 -48.2848 -24.9570 -24.9567 -24.9567 -24.9560 -24.3323 -24.3322 -24.3299 -24.3290 -24.2620 -24.2618 -24.2586 -24.2583 0.2661 0.2669 0.4941 0.4942 0.5953 0.5954 4.2850 4.3134 4.8373 4.8936 5.2521 5.2882 5.6715 5.6900 6.0629 6.0671 6.3021 6.3260 6.4539 6.4621 6.6783 6.6991 7.0764 7.1631 7.2345 7.3469 7.3737 7.4606 7.4980 7.5183 7.6430 7.6461 8.2709 8.4150 8.4816 8.5089 9.0189 9.0401 10.3120 10.3213 10.4351 10.4360 10.4717 10.4735 k = 0.3415 0.5000 0.2270 ( 10804 PWs) bands (ev): -48.2848 -48.2848 -48.2848 -48.2848 -24.9571 -24.9568 -24.9568 -24.9562 -24.3322 -24.3322 -24.3301 -24.3293 -24.2620 -24.2618 -24.2590 -24.2587 0.2980 0.2988 0.5222 0.5224 0.6164 0.6164 4.3451 4.3773 4.8148 4.8711 5.2231 5.2502 5.6308 5.6429 6.0899 6.0941 6.3053 6.3203 6.4461 6.4633 6.6780 6.6984 7.0845 7.1545 7.2351 7.3565 7.3753 7.4142 7.4535 7.5022 7.6085 7.6190 8.2196 8.3665 8.4158 8.4517 9.0157 9.0329 10.3198 10.3303 10.4354 10.4375 10.4620 10.4651 k = 0.3537 0.5000 0.2270 ( 10792 PWs) bands (ev): -48.2848 -48.2848 -48.2848 -48.2848 -24.9572 -24.9569 -24.9569 -24.9563 -24.3321 -24.3321 -24.3304 -24.3296 -24.2619 -24.2617 -24.2594 -24.2591 0.3295 0.3303 0.5495 0.5497 0.6361 0.6362 4.4039 4.4406 4.7938 4.8497 5.1943 5.2114 5.5879 5.5937 6.1158 6.1201 6.3101 6.3171 6.4398 6.4644 6.6779 6.6974 7.0926 7.1451 7.2392 7.3519 7.3669 7.4000 7.4079 7.4840 7.5649 7.6039 8.1697 8.3193 8.3515 8.3963 9.0170 9.0307 10.3293 10.3407 10.4352 10.4393 10.4535 10.4582 k = 0.3659 0.5000 0.2270 ( 10800 PWs) bands (ev): -48.2847 -48.2847 -48.2847 -48.2847 -24.9572 -24.9570 -24.9570 -24.9565 -24.3321 -24.3320 -24.3306 -24.3298 -24.2619 -24.2617 -24.2597 -24.2594 0.3604 0.3613 0.5757 0.5760 0.6543 0.6544 4.4608 4.5025 4.7745 4.8298 5.1668 5.1731 5.5437 5.5438 6.1399 6.1447 6.3160 6.3162 6.4348 6.4652 6.6779 6.6964 7.0988 7.1348 7.2472 7.3130 7.3563 7.3843 7.4088 7.4596 7.5167 7.6006 8.1213 8.2734 8.2894 8.3432 9.0221 9.0326 10.3400 10.3520 10.4342 10.4418 10.4460 10.4534 k = 0.3780 0.5000 0.2270 ( 10800 PWs) bands (ev): -48.2847 -48.2847 -48.2847 -48.2847 -24.9573 -24.9572 -24.9571 -24.9566 -24.3320 -24.3320 -24.3307 -24.3301 -24.2618 -24.2617 -24.2600 -24.2598 0.3905 0.3914 0.6008 0.6010 0.6708 0.6710 4.5144 4.5618 4.7574 4.8115 5.1369 5.1420 5.4939 5.4994 6.1618 6.1674 6.3178 6.3226 6.4310 6.4653 6.6780 6.6952 7.1019 7.1238 7.2557 7.2795 7.3204 7.3706 7.4214 7.4486 7.4675 7.6064 8.0746 8.2290 8.2301 8.2925 9.0301 9.0381 10.3515 10.3634 10.4320 10.4395 10.4452 10.4513 k = 0.3902 0.5000 0.2270 ( 10804 PWs) bands (ev): -48.2847 -48.2847 -48.2847 -48.2847 -24.9574 -24.9572 -24.9571 -24.9568 -24.3320 -24.3319 -24.3309 -24.3303 -24.2618 -24.2617 -24.2603 -24.2601 0.4196 0.4203 0.6243 0.6246 0.6854 0.6857 4.5635 4.6169 4.7425 4.7952 5.1045 5.1210 5.4455 5.4560 6.1808 6.1877 6.3218 6.3296 6.4282 6.4645 6.6781 6.6938 7.1016 7.1121 7.2382 7.2763 7.2861 7.3335 7.4129 7.4454 7.4610 7.6183 8.0295 8.1738 8.1859 8.2441 9.0405 9.0464 10.3632 10.3744 10.4288 10.4338 10.4501 10.4519 k = 0.4024 0.5000 0.2270 ( 10812 PWs) bands (ev): -48.2847 -48.2847 -48.2847 -48.2847 -24.9574 -24.9573 -24.9572 -24.9569 -24.3319 -24.3319 -24.3310 -24.3306 -24.2618 -24.2617 -24.2605 -24.2604 0.4472 0.4480 0.6462 0.6465 0.6981 0.6985 4.6066 4.6653 4.7302 4.7812 5.0777 5.1048 5.3998 5.4147 6.1967 6.2052 6.3281 6.3369 6.4262 6.4625 6.6782 6.6923 7.0980 7.1002 7.2114 7.2544 7.2755 7.2885 7.3832 7.4625 7.4830 7.6343 7.9864 8.1205 8.1443 8.1978 9.0524 9.0566 10.3743 10.3838 10.4253 10.4288 10.4549 10.4569 k = 0.4146 0.5000 0.2270 ( 10816 PWs) bands (ev): -48.2847 -48.2847 -48.2847 -48.2847 -24.9575 -24.9574 -24.9573 -24.9570 -24.3319 -24.3318 -24.3312 -24.3308 -24.2617 -24.2617 -24.2607 -24.2606 0.4732 0.4739 0.6661 0.6664 0.7088 0.7092 4.6424 4.7041 4.7206 4.7697 5.0589 5.0940 5.3581 5.3769 6.2093 6.2195 6.3363 6.3445 6.4247 6.4591 6.6783 6.6906 7.0883 7.0916 7.1887 7.2210 7.2474 7.2489 7.3828 7.4842 7.5080 7.6533 7.9453 8.0704 8.1040 8.1534 9.0651 9.0680 10.3839 10.3913 10.4218 10.4245 10.4603 10.4658 k = 0.4268 0.5000 0.2270 ( 10804 PWs) bands (ev): -48.2846 -48.2846 -48.2846 -48.2846 -24.9575 -24.9574 -24.9573 -24.9571 -24.3319 -24.3318 -24.3313 -24.3310 -24.2617 -24.2617 -24.2609 -24.2608 0.4971 0.4977 0.6839 0.6842 0.7175 0.7179 4.6703 4.7137 4.7294 4.7618 5.0494 5.0881 5.3223 5.3441 6.2189 6.2303 6.3457 6.3522 6.4235 6.4544 6.6783 6.6888 7.0769 7.0832 7.1705 7.1812 7.2074 7.2186 7.4031 7.5084 7.5337 7.6745 7.9068 8.0236 8.0652 8.1105 9.0779 9.0799 10.3915 10.3965 10.4187 10.4208 10.4679 10.4763 k = 0.4390 0.5000 0.2270 ( 10808 PWs) bands (ev): -48.2846 -48.2846 -48.2846 -48.2846 -24.9576 -24.9575 -24.9574 -24.9572 -24.3319 -24.3317 -24.3313 -24.3311 -24.2617 -24.2617 -24.2610 -24.2610 0.5185 0.5192 0.6994 0.6996 0.7242 0.7246 4.6902 4.7097 4.7380 4.7598 5.0486 5.0853 5.2940 5.3179 6.2260 6.2379 6.3554 6.3596 6.4224 6.4484 6.6782 6.6869 7.0664 7.0736 7.1412 7.1540 7.1676 7.1979 7.4310 7.5347 7.5582 7.6966 7.8719 7.9806 8.0280 8.0691 9.0901 9.0914 10.3967 10.3998 10.4162 10.4179 10.4774 10.4876 k = 0.4512 0.5000 0.2270 ( 10808 PWs) bands (ev): -48.2846 -48.2846 -48.2846 -48.2846 -24.9576 -24.9575 -24.9574 -24.9573 -24.3319 -24.3317 -24.3314 -24.3313 -24.2618 -24.2617 -24.2612 -24.2612 0.5371 0.5377 0.7123 0.7125 0.7291 0.7295 4.7024 4.7098 4.7356 4.7594 5.0529 5.0831 5.2751 5.2993 6.2312 6.2425 6.3642 6.3661 6.4215 6.4418 6.6782 6.6850 7.0573 7.0639 7.1061 7.1223 7.1514 7.1815 7.4619 7.5628 7.5795 7.7172 7.8430 7.9426 7.9927 8.0291 9.1010 9.1019 10.3998 10.4015 10.4143 10.4157 10.4877 10.4985 k = 0.4634 0.5000 0.2270 ( 10804 PWs) bands (ev): -48.2846 -48.2846 -48.2846 -48.2846 -24.9576 -24.9575 -24.9575 -24.9574 -24.3319 -24.3317 -24.3314 -24.3314 -24.2618 -24.2617 -24.2613 -24.2612 0.5524 0.5528 0.7225 0.7227 0.7324 0.7328 4.7060 4.7160 4.7310 4.7554 5.0578 5.0797 5.2660 5.2879 6.2351 6.2447 6.3713 6.3713 6.4210 6.4353 6.6781 6.6832 7.0500 7.0551 7.0780 7.0907 7.1452 7.1683 7.4935 7.5922 7.5947 7.7297 7.8264 7.9117 7.9596 7.9905 9.1102 9.1107 10.4012 10.4020 10.4132 10.4143 10.4975 10.5077 k = 0.4756 0.5000 0.2270 ( 10804 PWs) bands (ev): -48.2846 -48.2846 -48.2846 -48.2846 -24.9576 -24.9575 -24.9575 -24.9575 -24.3319 -24.3317 -24.3314 -24.3314 -24.2618 -24.2617 -24.2614 -24.2613 0.5638 0.5641 0.7299 0.7300 0.7345 0.7348 4.7086 4.7227 4.7262 4.7489 5.0609 5.0748 5.2651 5.2817 6.2381 6.2451 6.3750 6.3760 6.4211 6.4298 6.6782 6.6816 7.0447 7.0482 7.0581 7.0667 7.1424 7.1579 7.5244 7.6004 7.6223 7.7254 7.8307 7.8912 7.9295 7.9536 9.1171 9.1174 10.4016 10.4020 10.4128 10.4135 10.5058 10.5140 k = 0.4878 0.5000 0.2270 ( 10812 PWs) bands (ev): -48.2846 -48.2846 -48.2846 -48.2846 -24.9576 -24.9576 -24.9575 -24.9575 -24.3318 -24.3318 -24.3315 -24.3315 -24.2618 -24.2617 -24.2614 -24.2613 0.5709 0.5711 0.7344 0.7344 0.7357 0.7359 4.7122 4.7213 4.7287 4.7417 5.0630 5.0697 5.2688 5.2777 6.2406 6.2443 6.3773 6.3782 6.4219 6.4259 6.6785 6.6802 7.0418 7.0435 7.0469 7.0512 7.1424 7.1502 7.5532 7.5944 7.6524 7.7067 7.8516 7.8845 7.9032 7.9194 9.1214 9.1216 10.4016 10.4017 10.4128 10.4131 10.5114 10.5154 k = 0.5000 0.5000 0.2270 ( 10824 PWs) bands (ev): -48.2846 -48.2846 -48.2846 -48.2846 -24.9576 -24.9576 -24.9575 -24.9575 -24.3318 -24.3318 -24.3315 -24.3315 -24.2618 -24.2618 -24.2614 -24.2614 0.5734 0.5734 0.7356 0.7356 0.7363 0.7363 4.7166 4.7166 4.7349 4.7349 5.0656 5.0656 5.2736 5.2736 6.2427 6.2427 6.3785 6.3785 6.4234 6.4234 6.6792 6.6792 7.0414 7.0414 7.0446 7.0446 7.1450 7.1450 7.5776 7.5776 7.6812 7.6812 7.8784 7.8784 7.8936 7.8936 9.1229 9.1229 10.4016 10.4016 10.4129 10.4129 10.5143 10.5143 k = 0.5000 0.5000 0.2270 ( 10824 PWs) bands (ev): -48.2846 -48.2846 -48.2846 -48.2846 -24.9576 -24.9576 -24.9575 -24.9575 -24.3318 -24.3318 -24.3315 -24.3315 -24.2618 -24.2618 -24.2614 -24.2614 0.5734 0.5734 0.7356 0.7356 0.7363 0.7363 4.7166 4.7166 4.7349 4.7349 5.0656 5.0656 5.2736 5.2736 6.2427 6.2427 6.3785 6.3785 6.4234 6.4234 6.6792 6.6792 7.0414 7.0414 7.0446 7.0446 7.1450 7.1450 7.5776 7.5776 7.6812 7.6812 7.8784 7.8784 7.8936 7.8936 9.1229 9.1229 10.4016 10.4016 10.4129 10.4129 10.5143 10.5143 k = 0.4912 0.4912 0.2270 ( 10808 PWs) bands (ev): -48.2846 -48.2846 -48.2846 -48.2846 -24.9576 -24.9576 -24.9575 -24.9575 -24.3318 -24.3318 -24.3315 -24.3315 -24.2618 -24.2617 -24.2614 -24.2613 0.5708 0.5710 0.7324 0.7325 0.7376 0.7377 4.7121 4.7211 4.7291 4.7417 5.0628 5.0698 5.2686 5.2780 6.2406 6.2443 6.3772 6.3783 6.4219 6.4258 6.6785 6.6802 7.0413 7.0420 7.0485 7.0520 7.1424 7.1503 7.5525 7.5941 7.6528 7.7071 7.8534 7.8772 7.9111 7.9172 9.1214 9.1215 10.4016 10.4017 10.4128 10.4131 10.5113 10.5154 k = 0.4825 0.4825 0.2270 ( 10810 PWs) bands (ev): -48.2846 -48.2846 -48.2846 -48.2846 -24.9576 -24.9575 -24.9575 -24.9575 -24.3319 -24.3317 -24.3314 -24.3314 -24.2618 -24.2617 -24.2614 -24.2613 0.5636 0.5639 0.7218 0.7220 0.7422 0.7425 4.7083 4.7200 4.7305 4.7490 5.0593 5.0744 5.2642 5.2838 6.2380 6.2451 6.3744 6.3770 6.4210 6.4292 6.6782 6.6818 7.0414 7.0418 7.0648 7.0713 7.1422 7.1582 7.5213 7.5880 7.6377 7.7285 7.8351 7.8697 7.9487 7.9493 9.1169 9.1172 10.4018 10.4020 10.4127 10.4135 10.5050 10.5136 k = 0.4737 0.4737 0.2270 ( 10806 PWs) bands (ev): -48.2846 -48.2846 -48.2846 -48.2846 -24.9576 -24.9575 -24.9575 -24.9574 -24.3319 -24.3316 -24.3314 -24.3314 -24.2618 -24.2616 -24.2613 -24.2612 0.5522 0.5526 0.7044 0.7047 0.7493 0.7497 4.7053 4.7151 4.7380 4.7570 5.0514 5.0754 5.2649 5.2949 6.2348 6.2447 6.3702 6.3748 6.4201 6.4331 6.6784 6.6839 7.0412 7.0414 7.0919 7.1026 7.1442 7.1685 7.4848 7.5528 7.6443 7.7461 7.8237 7.8687 7.9884 7.9914 9.1097 9.1102 10.4022 10.4024 10.4127 10.4141 10.4956 10.5065 k = 0.4649 0.4649 0.2270 ( 10810 PWs) bands (ev): -48.2846 -48.2846 -48.2846 -48.2846 -24.9576 -24.9575 -24.9574 -24.9573 -24.3319 -24.3316 -24.3314 -24.3313 -24.2617 -24.2616 -24.2613 -24.2612 0.5371 0.5376 0.6804 0.6807 0.7584 0.7589 4.7034 4.7114 4.7476 4.7661 5.0361 5.0675 5.2767 5.3148 6.2307 6.2425 6.3646 6.3717 6.4185 6.4366 6.6790 6.6868 7.0408 7.0409 7.1281 7.1430 7.1499 7.1810 7.4443 7.5081 7.6554 7.7609 7.8191 7.8731 8.0333 8.0386 9.1000 9.1008 10.4024 10.4028 10.4126 10.4148 10.4844 10.4962 k = 0.4561 0.4561 0.2270 ( 10792 PWs) bands (ev): -48.2846 -48.2846 -48.2846 -48.2846 -24.9576 -24.9575 -24.9573 -24.9573 -24.3319 -24.3315 -24.3313 -24.3313 -24.2617 -24.2615 -24.2612 -24.2611 0.5190 0.5195 0.6500 0.6504 0.7689 0.7694 4.7031 4.7098 4.7591 4.7765 5.0127 5.0490 5.3021 5.3446 6.2251 6.2381 6.3579 6.3678 6.4158 6.4391 6.6803 6.6906 7.0403 7.0403 7.1521 7.1705 7.1959 7.1978 7.4021 7.4598 7.6668 7.7738 7.8211 7.8820 8.0832 8.0901 9.0883 9.0896 10.4015 10.4033 10.4128 10.4158 10.4730 10.4839 k = 0.4474 0.4474 0.2270 ( 10798 PWs) bands (ev): -48.2846 -48.2846 -48.2846 -48.2846 -24.9575 -24.9574 -24.9572 -24.9572 -24.3319 -24.3315 -24.3313 -24.3312 -24.2616 -24.2614 -24.2612 -24.2610 0.4980 0.4985 0.6136 0.6141 0.7805 0.7810 4.7047 4.7108 4.7726 4.7882 4.9829 5.0225 5.3394 5.3835 6.2178 6.2312 6.3503 6.3634 6.4119 6.4402 6.6824 6.6954 7.0395 7.0396 7.1575 7.2045 7.2213 7.2580 7.3632 7.4098 7.6784 7.7853 7.8290 7.8946 8.1380 8.1459 9.0751 9.0769 10.3985 10.4034 10.4136 10.4172 10.4630 10.4713 k = 0.4386 0.4386 0.2270 ( 10798 PWs) bands (ev): -48.2847 -48.2847 -48.2847 -48.2847 -24.9575 -24.9574 -24.9571 -24.9571 -24.3319 -24.3314 -24.3312 -24.3311 -24.2616 -24.2612 -24.2611 -24.2608 0.4743 0.4749 0.5717 0.5722 0.7928 0.7934 4.7085 4.7147 4.7881 4.8009 4.9492 4.9924 5.3856 5.4296 6.2083 6.2218 6.3421 6.3580 6.4070 6.4395 6.6853 6.7016 7.0387 7.0387 7.1625 7.2209 7.2452 7.3244 7.3473 7.3595 7.6904 7.7969 7.8416 7.9102 8.1976 8.2061 9.0610 9.0635 10.3925 10.4023 10.4154 10.4189 10.4562 10.4600 k = 0.4298 0.4298 0.2270 ( 10800 PWs) bands (ev): -48.2847 -48.2847 -48.2847 -48.2847 -24.9574 -24.9573 -24.9570 -24.9570 -24.3319 -24.3313 -24.3312 -24.3310 -24.2615 -24.2611 -24.2610 -24.2607 0.4482 0.4487 0.5246 0.5252 0.8059 0.8064 4.7146 4.7216 4.8057 4.8133 4.9140 4.9629 5.4383 5.4812 6.1964 6.2098 6.3336 6.3512 6.4017 6.4370 6.6892 6.7091 7.0376 7.0376 7.1661 7.2170 7.2432 7.3097 7.3801 7.3956 7.7028 7.8097 7.8576 7.9283 8.2622 8.2709 9.0466 9.0498 10.3838 10.3990 10.4181 10.4214 10.4520 10.4529 k = 0.4211 0.4211 0.2270 ( 10808 PWs) bands (ev): -48.2847 -48.2847 -48.2847 -48.2847 -24.9574 -24.9572 -24.9569 -24.9569 -24.3319 -24.3312 -24.3311 -24.3309 -24.2614 -24.2610 -24.2609 -24.2605 0.4196 0.4201 0.4729 0.4735 0.8194 0.8199 4.7226 4.7313 4.8229 4.8251 4.8794 4.9394 5.4957 5.5367 6.1820 6.1955 6.3248 6.3422 6.3970 6.4327 6.6940 6.7183 7.0360 7.0362 7.1665 7.1781 7.2556 7.2638 7.4342 7.4688 7.7160 7.8247 7.8761 7.9485 8.3318 8.3404 9.0324 9.0366 10.3738 10.3928 10.4217 10.4249 10.4484 10.4529 k = 0.4123 0.4123 0.2270 ( 10810 PWs) bands (ev): -48.2847 -48.2847 -48.2847 -48.2847 -24.9573 -24.9572 -24.9568 -24.9568 -24.3318 -24.3312 -24.3310 -24.3308 -24.2612 -24.2608 -24.2607 -24.2604 0.3886 0.3891 0.4170 0.4176 0.8334 0.8339 4.7316 4.7429 4.8254 4.8424 4.8522 4.9287 5.5564 5.5946 6.1651 6.1792 6.3155 6.3303 6.3936 6.4269 6.6998 6.7292 7.0337 7.0342 7.1342 7.1584 7.2268 7.2690 7.4922 7.5427 7.7301 7.8425 7.8968 7.9703 8.4063 8.4145 9.0191 9.0244 10.3638 10.3848 10.4263 10.4296 10.4488 10.4553 k = 0.4035 0.4035 0.2270 ( 10822 PWs) bands (ev): -48.2848 -48.2848 -48.2847 -48.2847 -24.9572 -24.9571 -24.9567 -24.9567 -24.3318 -24.3311 -24.3309 -24.3306 -24.2611 -24.2606 -24.2606 -24.2602 0.3551 0.3557 0.3574 0.3581 0.8477 0.8482 4.7389 4.7531 4.8213 4.8221 4.8718 4.9342 5.6193 5.6536 6.1458 6.1617 6.3052 6.3150 6.3917 6.4198 6.7067 6.7421 7.0301 7.0308 7.0920 7.1352 7.2069 7.2813 7.5491 7.6162 7.7452 7.8635 7.9193 7.9934 8.4852 8.4929 9.0073 9.0136 10.3546 10.3763 10.4319 10.4355 10.4523 10.4597 k = 0.3947 0.3947 0.2270 ( 10826 PWs) bands (ev): -48.2848 -48.2848 -48.2848 -48.2848 -24.9571 -24.9570 -24.9566 -24.9565 -24.3317 -24.3309 -24.3308 -24.3305 -24.2610 -24.2604 -24.2604 -24.2600 0.2945 0.2952 0.3195 0.3200 0.8624 0.8627 4.7399 4.7527 4.8149 4.8203 4.8975 4.9514 5.6836 5.7122 6.1245 6.1436 6.2933 6.2964 6.3914 6.4120 6.7146 6.7571 7.0214 7.0236 7.0580 7.1036 7.1992 7.2921 7.6028 7.6883 7.7614 7.8879 7.9438 8.0173 8.5677 8.5747 8.9974 9.0048 10.3466 10.3685 10.4387 10.4429 10.4580 10.4659 k = 0.3860 0.3860 0.2270 ( 10834 PWs) bands (ev): -48.2848 -48.2848 -48.2848 -48.2848 -24.9570 -24.9568 -24.9564 -24.9564 -24.3317 -24.3308 -24.3307 -24.3304 -24.2608 -24.2602 -24.2602 -24.2598 0.2289 0.2295 0.2815 0.2820 0.8772 0.8775 4.7325 4.7387 4.8283 4.8301 4.9254 4.9755 5.7484 5.7688 6.1014 6.1263 6.2746 6.2790 6.3925 6.4042 6.7235 6.7742 6.9969 7.0106 7.0426 7.0765 7.1949 7.3013 7.6523 7.7574 7.7797 7.9155 7.9706 8.0418 8.6527 8.6589 8.9897 8.9982 10.3402 10.3619 10.4467 10.4517 10.4657 10.4737 k = 0.3772 0.3772 0.2270 ( 10848 PWs) bands (ev): -48.2848 -48.2848 -48.2848 -48.2848 -24.9569 -24.9567 -24.9563 -24.9562 -24.3316 -24.3307 -24.3305 -24.3302 -24.2606 -24.2601 -24.2600 -24.2596 0.1609 0.1615 0.2413 0.2418 0.8921 0.8924 4.7210 4.7221 4.8489 4.8516 4.9554 5.0038 5.8131 5.8207 6.0769 6.1117 6.2501 6.2617 6.3945 6.3971 6.7334 6.7936 6.9660 6.9885 7.0376 7.0601 7.1911 7.3090 7.6970 7.7949 7.8287 7.9456 8.0002 8.0665 8.7386 8.7442 8.9845 8.9939 10.3352 10.3564 10.4561 10.4620 10.4750 10.4830 k = 0.3684 0.3684 0.2270 ( 10840 PWs) bands (ev): -48.2849 -48.2849 -48.2849 -48.2849 -24.9567 -24.9566 -24.9561 -24.9561 -24.3315 -24.3306 -24.3304 -24.3301 -24.2604 -24.2598 -24.2598 -24.2593 0.0909 0.0915 0.1990 0.1994 0.9071 0.9074 4.7080 4.7102 4.8734 4.8800 4.9873 5.0352 5.8639 5.8767 6.0512 6.1033 6.2233 6.2411 6.3912 6.3975 6.7440 6.8149 6.9372 6.9611 7.0349 7.0517 7.1874 7.3157 7.7374 7.8148 7.8943 7.9768 8.0336 8.0912 8.8239 8.8291 8.9820 8.9920 10.3315 10.3521 10.4668 10.4739 10.4856 10.4937 k = 0.3596 0.3596 0.2270 ( 10844 PWs) bands (ev): -48.2849 -48.2849 -48.2849 -48.2849 -24.9566 -24.9564 -24.9559 -24.9559 -24.3314 -24.3304 -24.3303 -24.3299 -24.2602 -24.2596 -24.2595 -24.2591 0.0194 0.0200 0.1547 0.1551 0.9221 0.9223 4.6982 4.7024 4.9017 4.9116 5.0210 5.0691 5.8927 5.9386 6.0246 6.1062 6.1949 6.2175 6.3868 6.4014 6.7552 6.8377 6.9124 6.9336 7.0328 7.0467 7.1844 7.3220 7.7741 7.8353 7.9584 8.0076 8.0716 8.1158 8.9069 8.9117 8.9820 8.9926 10.3289 10.3487 10.4788 10.4871 10.4974 10.5053 k = 0.3509 0.3509 0.2270 ( 10844 PWs) bands (ev): -48.2849 -48.2849 -48.2849 -48.2849 -24.9565 -24.9563 -24.9558 -24.9557 -24.3313 -24.3303 -24.3302 -24.3298 -24.2600 -24.2594 -24.2593 -24.2589 -0.0533 -0.0528 0.1086 0.1089 0.9369 0.9371 4.6932 4.6987 4.9329 4.9459 5.0564 5.1052 5.9034 5.9918 6.0032 6.1222 6.1672 6.1921 6.3839 6.4061 6.7664 6.8608 6.8918 6.9083 7.0308 7.0427 7.1836 7.3287 7.8080 7.8568 8.0207 8.0372 8.1139 8.1401 8.9822 8.9838 8.9929 8.9975 10.3270 10.3461 10.4919 10.5013 10.5098 10.5176 k = 0.3421 0.3421 0.2270 ( 10852 PWs) bands (ev): -48.2850 -48.2850 -48.2850 -48.2850 -24.9563 -24.9561 -24.9556 -24.9555 -24.3312 -24.3302 -24.3300 -24.3296 -24.2597 -24.2592 -24.2590 -24.2586 -0.1269 -0.1264 0.0607 0.0610 0.9515 0.9516 4.6933 4.6997 4.9661 4.9821 5.0934 5.1432 5.8986 5.9688 6.0520 6.1243 6.1651 6.1684 6.3825 6.4117 6.7772 6.8753 6.8787 6.8900 7.0290 7.0387 7.1870 7.3368 7.8400 7.8794 8.0655 8.0808 8.1599 8.1646 8.9880 8.9983 9.0615 9.0655 10.3256 10.3440 10.5058 10.5157 10.5229 10.5299 k = 0.3333 0.3333 0.2270 ( 10858 PWs) bands (ev): -48.2850 -48.2850 -48.2850 -48.2850 -24.9561 -24.9559 -24.9554 -24.9554 -24.3311 -24.3300 -24.3299 -24.3295 -24.2595 -24.2589 -24.2588 -24.2583 -0.2011 -0.2006 0.0113 0.0116 0.9657 0.9657 4.6987 4.7058 5.0010 5.0200 5.1318 5.1828 5.8843 5.9413 6.0862 6.0968 6.1602 6.1988 6.3824 6.4184 6.7868 6.8627 6.8640 6.9040 7.0273 7.0344 7.1970 7.3475 7.8707 7.9030 8.0927 8.1370 8.1912 8.2085 8.9940 9.0042 9.1297 9.1338 10.3245 10.3422 10.5199 10.5285 10.5370 10.5420 k = 0.3246 0.3246 0.2270 ( 10850 PWs) bands (ev): -48.2851 -48.2851 -48.2850 -48.2850 -24.9560 -24.9558 -24.9552 -24.9552 -24.3310 -24.3298 -24.3297 -24.3293 -24.2592 -24.2587 -24.2585 -24.2581 -0.2755 -0.2751 -0.0395 -0.0392 0.9794 0.9795 4.7094 4.7169 5.0368 5.0588 5.1714 5.2238 5.8653 5.9141 6.0666 6.0797 6.1900 6.2373 6.3836 6.4268 6.7946 6.8471 6.8538 6.9172 7.0257 7.0304 7.2157 7.3618 7.9008 7.9276 8.1190 8.1825 8.2267 8.2591 9.0013 9.0109 9.1914 9.1957 10.3234 10.3405 10.5331 10.5391 10.5514 10.5536 k = 0.3158 0.3158 0.2270 ( 10856 PWs) bands (ev): -48.2851 -48.2851 -48.2851 -48.2851 -24.9558 -24.9556 -24.9551 -24.9550 -24.3308 -24.3297 -24.3296 -24.3292 -24.2590 -24.2584 -24.2582 -24.2578 -0.3500 -0.3496 -0.0915 -0.0912 0.9925 0.9926 4.7254 4.7332 5.0729 5.0981 5.2119 5.2661 5.8447 5.8878 6.0372 6.0562 6.2343 6.2749 6.3865 6.4373 6.8001 6.8326 6.8479 6.9229 7.0245 7.0277 7.2442 7.3805 7.9305 7.9532 8.1444 8.2118 8.2766 8.3112 9.0095 9.0182 9.2465 9.2509 10.3223 10.3388 10.5443 10.5477 10.5647 10.5647 k = 0.3070 0.3070 0.2270 ( 10860 PWs) bands (ev): -48.2851 -48.2851 -48.2851 -48.2851 -24.9556 -24.9554 -24.9549 -24.9548 -24.3307 -24.3295 -24.3294 -24.3290 -24.2587 -24.2581 -24.2579 -24.2575 -0.4243 -0.4239 -0.1445 -0.1442 1.0050 1.0051 4.7467 4.7546 5.1086 5.1368 5.2530 5.3093 5.8243 5.8631 6.0096 6.0307 6.2780 6.3092 6.3916 6.4512 6.8034 6.8202 6.8446 6.9206 7.0239 7.0271 7.2822 7.4044 7.9601 7.9798 8.1690 8.2335 8.3325 8.3643 9.0182 9.0259 9.2951 9.2996 10.3208 10.3370 10.5529 10.5544 10.5752 10.5762 k = 0.2982 0.2982 0.2270 ( 10868 PWs) bands (ev): -48.2852 -48.2852 -48.2851 -48.2851 -24.9554 -24.9552 -24.9547 -24.9546 -24.3305 -24.3294 -24.3292 -24.3288 -24.2584 -24.2578 -24.2576 -24.2572 -0.4981 -0.4978 -0.1982 -0.1979 1.0166 1.0168 4.7730 4.7810 5.1428 5.1740 5.2943 5.3532 5.8060 5.8408 5.9845 6.0064 6.3165 6.3384 6.4010 6.4698 6.8050 6.8097 6.8431 6.9122 7.0239 7.0284 7.3282 7.4335 7.9898 8.0072 8.1927 8.2520 8.3900 8.4182 9.0271 9.0336 9.3376 9.3422 10.3191 10.3349 10.5587 10.5591 10.5849 10.5859 k = 0.2895 0.2895 0.2270 ( 10874 PWs) bands (ev): -48.2852 -48.2852 -48.2852 -48.2852 -24.9552 -24.9550 -24.9545 -24.9544 -24.3304 -24.3292 -24.3291 -24.3287 -24.2581 -24.2576 -24.2573 -24.2569 -0.5713 -0.5710 -0.2525 -0.2522 1.0273 1.0275 4.8045 4.8124 5.1742 5.2082 5.3356 5.3977 5.7915 5.8222 5.9625 5.9847 6.3451 6.3614 6.4183 6.4940 6.8010 6.8059 6.8429 6.8999 7.0246 7.0308 7.3807 7.4678 8.0196 8.0355 8.2156 8.2686 8.4479 8.4728 9.0358 9.0411 9.3746 9.3792 10.3169 10.3326 10.5620 10.5620 10.5938 10.5946 k = 0.2807 0.2807 0.2270 ( 10882 PWs) bands (ev): -48.2853 -48.2853 -48.2852 -48.2852 -24.9551 -24.9548 -24.9543 -24.9542 -24.3302 -24.3290 -24.3289 -24.3285 -24.2578 -24.2573 -24.2570 -24.2566 -0.6437 -0.6434 -0.3072 -0.3069 1.0370 1.0373 4.8407 4.8485 5.2015 5.2374 5.3765 5.4424 5.7824 5.8083 5.9446 5.9666 6.3621 6.3786 6.4445 6.5232 6.7937 6.8068 6.8443 6.8862 7.0263 7.0339 7.4382 7.5066 8.0495 8.0645 8.2378 8.2835 8.5058 8.5277 9.0443 9.0482 9.4068 9.4115 10.3143 10.3299 10.5630 10.5633 10.6019 10.6025 k = 0.2719 0.2719 0.2270 ( 10890 PWs) bands (ev): -48.2853 -48.2853 -48.2853 -48.2853 -24.9549 -24.9546 -24.9541 -24.9540 -24.3301 -24.3288 -24.3287 -24.3284 -24.2575 -24.2570 -24.2567 -24.2563 -0.7150 -0.7148 -0.3620 -0.3618 1.0456 1.0459 4.8817 4.8891 5.2231 5.2596 5.4171 5.4871 5.7804 5.8004 5.9315 5.9528 6.3719 6.3915 6.4745 6.5558 6.7878 6.8080 6.8481 6.8728 7.0288 7.0374 7.4993 7.5494 8.0794 8.0942 8.2594 8.2971 8.5635 8.5830 9.0522 9.0547 9.4349 9.4395 10.3111 10.3268 10.5621 10.5626 10.6094 10.6100 k = 0.2632 0.2632 0.2270 ( 10878 PWs) bands (ev): -48.2854 -48.2854 -48.2853 -48.2853 -24.9547 -24.9544 -24.9539 -24.9538 -24.3299 -24.3286 -24.3286 -24.3282 -24.2572 -24.2567 -24.2563 -24.2560 -0.7853 -0.7850 -0.4169 -0.4167 1.0531 1.0534 4.9271 4.9339 5.2378 5.2729 5.4574 5.5315 5.7859 5.7993 5.9247 5.9443 6.3784 6.4015 6.5033 6.5895 6.7835 6.8099 6.8560 6.8612 7.0323 7.0414 7.5630 7.5953 8.1093 8.1244 8.2806 8.3094 8.6209 8.6383 9.0594 9.0605 9.4594 9.4640 10.3074 10.3233 10.5596 10.5603 10.6163 10.6172 k = 0.2544 0.2544 0.2270 ( 10864 PWs) bands (ev): -48.2854 -48.2854 -48.2854 -48.2854 -24.9545 -24.9542 -24.9537 -24.9535 -24.3298 -24.3285 -24.3284 -24.3280 -24.2569 -24.2564 -24.2560 -24.2557 -0.8542 -0.8540 -0.4715 -0.4713 1.0593 1.0597 4.9769 4.9826 5.2449 5.2763 5.4976 5.5752 5.7978 5.8052 5.9260 5.9420 6.3837 6.4096 6.5277 6.6215 6.7817 6.8128 6.8532 6.8694 7.0369 7.0459 7.6284 7.6433 8.1390 8.1550 8.3019 8.3209 8.6779 8.6935 9.0655 9.0658 9.4810 9.4855 10.3031 10.3192 10.5555 10.5565 10.6226 10.6241 k = 0.2456 0.2456 0.2270 ( 10870 PWs) bands (ev): -48.2855 -48.2854 -48.2854 -48.2854 -24.9543 -24.9540 -24.9535 -24.9533 -24.3296 -24.3283 -24.3282 -24.3279 -24.2566 -24.2561 -24.2557 -24.2554 -0.9217 -0.9215 -0.5257 -0.5255 1.0643 1.0648 5.0306 5.0344 5.2448 5.2705 5.5377 5.6180 5.8130 5.8169 5.9381 5.9477 6.3884 6.4164 6.5465 6.6478 6.7844 6.8165 6.8509 6.8896 7.0430 7.0511 7.6925 7.6948 8.1683 8.1856 8.3237 8.3318 8.7342 8.7484 9.0696 9.0714 9.5003 9.5046 10.2981 10.3146 10.5499 10.5512 10.6281 10.6307 k = 0.2368 0.2368 0.2270 ( 10870 PWs) bands (ev): -48.2855 -48.2855 -48.2854 -48.2854 -24.9541 -24.9538 -24.9533 -24.9531 -24.3294 -24.3281 -24.3281 -24.3277 -24.2562 -24.2557 -24.2554 -24.2551 -0.9876 -0.9875 -0.5794 -0.5792 1.0680 1.0685 5.0877 5.0880 5.2396 5.2571 5.5773 5.6594 5.8282 5.8322 5.9629 5.9630 6.3929 6.4223 6.5592 6.6639 6.7923 6.8210 6.8576 6.9168 7.0512 7.0571 7.7417 7.7613 8.1970 8.2158 8.3429 8.3465 8.7899 8.8027 9.0728 9.0759 9.5175 9.5218 10.2924 10.3093 10.5428 10.5446 10.6328 10.6368 k = 0.2281 0.2281 0.2270 ( 10862 PWs) bands (ev): -48.2855 -48.2855 -48.2855 -48.2855 -24.9539 -24.9536 -24.9531 -24.9529 -24.3293 -24.3280 -24.3279 -24.3276 -24.2559 -24.2554 -24.2551 -24.2548 -1.0519 -1.0518 -0.6324 -0.6322 1.0704 1.0710 5.1365 5.1480 5.2363 5.2384 5.6163 5.6992 5.8426 5.8490 5.9889 6.0000 6.3973 6.4277 6.5666 6.6691 6.8018 6.8261 6.8781 6.9494 7.0628 7.0642 7.7900 7.8271 8.2252 8.2452 8.3551 8.3708 8.8445 8.8564 9.0750 9.0795 9.5332 9.5373 10.2859 10.3032 10.5345 10.5368 10.6364 10.6425 k = 0.2193 0.2193 0.2270 ( 10858 PWs) bands (ev): -48.2856 -48.2856 -48.2855 -48.2855 -24.9537 -24.9534 -24.9529 -24.9527 -24.3291 -24.3278 -24.3277 -24.3274 -24.2556 -24.2551 -24.2548 -24.2545 -1.1145 -1.1143 -0.6844 -0.6842 1.0716 1.0721 5.1599 5.1970 5.2296 5.2567 5.6542 5.7372 5.8572 5.8664 6.0251 6.0466 6.4017 6.4326 6.5698 6.6668 6.8093 6.8320 6.9123 6.9839 7.0726 7.0806 7.8360 7.8912 8.2530 8.2728 8.3698 8.3971 8.8979 8.9090 9.0763 9.0818 9.5477 9.5516 10.2785 10.2964 10.5250 10.5277 10.6386 10.6474 k = 0.2105 0.2105 0.2270 ( 10866 PWs) bands (ev): -48.2856 -48.2856 -48.2856 -48.2856 -24.9535 -24.9532 -24.9527 -24.9525 -24.3289 -24.3276 -24.3276 -24.3272 -24.2553 -24.2548 -24.2544 -24.2542 -1.1751 -1.1750 -0.7354 -0.7353 1.0715 1.0721 5.1505 5.1805 5.2862 5.3091 5.6908 5.7734 5.8735 5.8846 6.0699 6.1001 6.4063 6.4371 6.5704 6.6605 6.8157 6.8386 6.9551 7.0145 7.0829 7.1093 7.8787 7.9522 8.2808 8.2982 8.3887 8.4258 8.9497 8.9601 9.0765 9.0831 9.5613 9.5650 10.2702 10.2886 10.5142 10.5175 10.6386 10.6514 k = 0.2018 0.2018 0.2270 ( 10858 PWs) bands (ev): -48.2857 -48.2857 -48.2856 -48.2856 -24.9533 -24.9530 -24.9525 -24.9523 -24.3288 -24.3275 -24.3274 -24.3271 -24.2550 -24.2545 -24.2541 -24.2539 -1.2339 -1.2338 -0.7853 -0.7851 1.0702 1.0708 5.1285 5.1518 5.3555 5.3742 5.7258 5.8078 5.8924 5.9044 6.1211 6.1586 6.4111 6.4414 6.5693 6.6527 6.8224 6.8462 7.0017 7.0378 7.0964 7.1510 7.9169 8.0084 8.3091 8.3220 8.4127 8.4571 8.9994 9.0090 9.0762 9.0832 9.5742 9.5777 10.2609 10.2798 10.5024 10.5062 10.6355 10.6536 k = 0.1930 0.1930 0.2270 ( 10862 PWs) bands (ev): -48.2857 -48.2857 -48.2856 -48.2856 -24.9531 -24.9528 -24.9523 -24.9521 -24.3286 -24.3273 -24.3272 -24.3269 -24.2546 -24.2542 -24.2538 -24.2536 -1.2906 -1.2905 -0.8338 -0.8336 1.0677 1.0684 5.1019 5.1208 5.4280 5.4442 5.7590 5.8405 5.9144 5.9263 6.1770 6.2207 6.4162 6.4456 6.5677 6.6445 6.8302 6.8549 7.0466 7.0562 7.1167 7.2029 7.9496 8.0576 8.3386 8.3463 8.4416 8.4909 9.0459 9.0517 9.0788 9.0829 9.5867 9.5900 10.2505 10.2699 10.4894 10.4937 10.6279 10.6525 k = 0.1842 0.1842 0.2270 ( 10860 PWs) bands (ev): -48.2857 -48.2857 -48.2857 -48.2857 -24.9529 -24.9526 -24.9521 -24.9519 -24.3284 -24.3272 -24.3271 -24.3268 -24.2543 -24.2539 -24.2535 -24.2533 -1.3452 -1.3452 -0.8809 -0.8808 1.0643 1.0649 5.0730 5.0889 5.5026 5.5169 5.7903 5.8716 5.9395 5.9507 6.2357 6.2855 6.4221 6.4497 6.5661 6.6366 6.8397 6.8649 7.0727 7.0821 7.1502 7.2610 7.9763 8.0973 8.3695 8.3739 8.4747 8.5272 9.0636 9.0728 9.0982 9.1085 9.5991 9.6023 10.2388 10.2587 10.4754 10.4800 10.6155 10.6455 k = 0.1754 0.1754 0.2270 ( 10852 PWs) bands (ev): -48.2858 -48.2858 -48.2857 -48.2857 -24.9527 -24.9524 -24.9519 -24.9517 -24.3282 -24.3270 -24.3269 -24.3266 -24.2540 -24.2536 -24.2532 -24.2531 -1.3977 -1.3976 -0.9265 -0.9263 1.0598 1.0605 5.0430 5.0567 5.5786 5.5911 5.8198 5.9009 5.9676 5.9778 6.2956 6.3521 6.4293 6.4540 6.5652 6.6293 6.8512 6.8766 7.0895 7.1070 7.1976 7.3228 7.9968 8.1262 8.4017 8.4062 8.5117 8.5659 9.0603 9.0710 9.1375 9.1492 9.6116 9.6147 10.2260 10.2461 10.4604 10.4651 10.5989 10.6310 k = 0.1667 0.1667 0.2270 ( 10860 PWs) bands (ev): -48.2858 -48.2858 -48.2857 -48.2857 -24.9525 -24.9522 -24.9517 -24.9515 -24.3281 -24.3269 -24.3268 -24.3265 -24.2537 -24.2533 -24.2530 -24.2528 -1.4480 -1.4479 -0.9704 -0.9703 1.0546 1.0552 5.0127 5.0244 5.6555 5.6658 5.8476 5.9286 5.9982 6.0075 6.3534 6.4188 6.4399 6.4597 6.5659 6.6229 6.8651 6.8905 7.1075 7.1280 7.2517 7.3867 8.0114 8.1449 8.4345 8.4423 8.5527 8.6068 9.0544 9.0653 9.1754 9.1877 9.6245 9.6277 10.2117 10.2319 10.4443 10.4489 10.5793 10.6113 k = 0.1579 0.1579 0.2270 ( 10868 PWs) bands (ev): -48.2859 -48.2859 -48.2858 -48.2858 -24.9523 -24.9520 -24.9515 -24.9514 -24.3279 -24.3268 -24.3266 -24.3264 -24.2534 -24.2530 -24.2527 -24.2525 -1.4959 -1.4959 -1.0126 -1.0125 1.0486 1.0492 4.9823 4.9925 5.7322 5.7397 5.8740 5.9552 6.0308 6.0393 6.4001 6.4581 6.4607 6.4938 6.5697 6.6177 6.8821 6.9072 7.1276 7.1492 7.3079 7.4517 8.0209 8.1553 8.4671 8.4794 8.5983 8.6495 9.0473 9.0578 9.2092 9.2223 9.6382 9.6415 10.1961 10.2161 10.4272 10.4312 10.5574 10.5884 k = 0.1491 0.1491 0.2270 ( 10866 PWs) bands (ev): -48.2859 -48.2859 -48.2858 -48.2858 -24.9522 -24.9519 -24.9513 -24.9512 -24.3278 -24.3267 -24.3265 -24.3262 -24.2531 -24.2528 -24.2524 -24.2523 -1.5416 -1.5415 -1.0530 -1.0529 1.0420 1.0426 4.9523 4.9613 5.8074 5.8110 5.8998 5.9819 6.0647 6.0726 6.4251 6.4648 6.4972 6.5599 6.5815 6.6144 6.9027 6.9273 7.1502 7.1722 7.3645 7.5168 8.0260 8.1598 8.4986 8.5148 8.6480 8.6933 9.0398 9.0492 9.2381 9.2521 9.6530 9.6564 10.1790 10.1987 10.4090 10.4120 10.5339 10.5637 k = 0.1404 0.1404 0.2270 ( 10858 PWs) bands (ev): -48.2859 -48.2859 -48.2858 -48.2858 -24.9520 -24.9517 -24.9512 -24.9510 -24.3276 -24.3266 -24.3263 -24.3261 -24.2529 -24.2525 -24.2522 -24.2520 -1.5848 -1.5848 -1.0914 -1.0913 1.0349 1.0355 4.9231 4.9309 5.8767 5.8768 5.9285 6.0107 6.0993 6.1065 6.4388 6.4703 6.5274 6.6028 6.6123 6.6366 6.9278 6.9518 7.1758 7.1980 7.4201 7.5812 8.0275 8.1603 8.5280 8.5470 8.7005 8.7365 9.0331 9.0402 9.2612 9.2761 9.6692 9.6727 10.1604 10.1795 10.3895 10.3909 10.5092 10.5377 k = 0.1316 0.1316 0.2270 ( 10866 PWs) bands (ev): -48.2860 -48.2860 -48.2859 -48.2859 -24.9518 -24.9516 -24.9510 -24.9509 -24.3275 -24.3265 -24.3262 -24.3260 -24.2526 -24.2522 -24.2520 -24.2518 -1.6257 -1.6257 -1.1279 -1.1278 1.0274 1.0280 4.8947 4.9016 5.9248 5.9321 5.9749 6.0457 6.1336 6.1401 6.4502 6.4762 6.5414 6.6030 6.6626 6.7016 6.9583 6.9818 7.2049 7.2270 7.4741 7.6443 8.0262 8.1583 8.5549 8.5753 8.7530 8.7766 9.0297 9.0322 9.2781 9.2937 9.6869 9.6906 10.1403 10.1587 10.3679 10.3686 10.4833 10.5105 k = 0.1228 0.1228 0.2270 ( 10862 PWs) bands (ev): -48.2860 -48.2860 -48.2859 -48.2859 -24.9517 -24.9514 -24.9508 -24.9507 -24.3273 -24.3264 -24.3261 -24.3258 -24.2523 -24.2520 -24.2517 -24.2516 -1.6641 -1.6641 -1.1623 -1.1622 1.0197 1.0203 4.8675 4.8736 5.9511 5.9730 6.0384 6.0898 6.1670 6.1725 6.4617 6.4829 6.5487 6.6012 6.7200 6.7678 6.9953 7.0184 7.2379 7.2599 7.5257 7.7052 8.0228 8.1547 8.5785 8.5997 8.8010 8.8088 9.0284 9.0335 9.2885 9.3042 9.7062 9.7099 10.1190 10.1364 10.3429 10.3463 10.4563 10.4822 k = 0.1140 0.1140 0.2270 ( 10860 PWs) bands (ev): -48.2860 -48.2860 -48.2859 -48.2859 -24.9515 -24.9513 -24.9507 -24.9506 -24.3272 -24.3263 -24.3259 -24.3257 -24.2521 -24.2518 -24.2515 -24.2514 -1.7000 -1.7000 -1.1946 -1.1945 1.0120 1.0125 4.8415 4.8469 5.9712 6.0013 6.1020 6.1403 6.1988 6.2027 6.4742 6.4904 6.5540 6.5995 6.7788 6.8326 7.0393 7.0621 7.2753 7.2970 7.5743 7.7632 8.0179 8.1505 8.5984 8.6197 8.8278 8.8373 9.0343 9.0493 9.2925 9.3075 9.7269 9.7305 10.0964 10.1128 10.3159 10.3223 10.4283 10.4528 k = 0.1053 0.1053 0.2270 ( 10864 PWs) bands (ev): -48.2861 -48.2861 -48.2860 -48.2860 -24.9514 -24.9512 -24.9505 -24.9504 -24.3271 -24.3263 -24.3258 -24.3256 -24.2519 -24.2516 -24.2513 -24.2512 -1.7333 -1.7333 -1.2247 -1.2246 1.0042 1.0047 4.8170 4.8218 5.9889 6.0219 6.1609 6.1912 6.2286 6.2300 6.4878 6.4989 6.5590 6.5984 6.8375 6.8955 7.0905 7.1132 7.3173 7.3386 7.6194 7.8173 8.0125 8.1463 8.6141 8.6351 8.8310 8.8546 9.0551 9.0779 9.2915 9.3043 9.7486 9.7520 10.0729 10.0883 10.2873 10.2966 10.3990 10.4221 k = 0.0965 0.0965 0.2270 ( 10852 PWs) bands (ev): -48.2861 -48.2861 -48.2860 -48.2860 -24.9513 -24.9511 -24.9504 -24.9503 -24.3269 -24.3262 -24.3257 -24.3255 -24.2517 -24.2513 -24.2512 -24.2510 -1.7641 -1.7641 -1.2526 -1.2525 0.9966 0.9971 4.7940 4.7982 6.0049 6.0381 6.2123 6.2378 6.2548 6.2574 6.5020 6.5082 6.5641 6.5977 6.8959 6.9571 7.1480 7.1710 7.3640 7.3848 7.6606 7.8661 8.0078 8.1427 8.6252 8.6455 8.8215 8.8531 9.0864 9.1130 9.2892 9.2978 9.7708 9.7739 10.0489 10.0633 10.2576 10.2694 10.3685 10.3901 k = 0.0877 0.0877 0.2270 ( 10856 PWs) bands (ev): -48.2861 -48.2861 -48.2860 -48.2860 -24.9512 -24.9510 -24.9503 -24.9502 -24.3268 -24.3261 -24.3256 -24.3254 -24.2515 -24.2512 -24.2510 -24.2508 -1.7923 -1.7923 -1.2782 -1.2781 0.9893 0.9897 4.7727 4.7764 6.0195 6.0514 6.2520 6.2696 6.2858 6.2881 6.5164 6.5180 6.5694 6.5975 6.9545 7.0182 7.2105 7.2343 7.4154 7.4354 7.6979 7.9066 8.0072 8.1402 8.6312 8.6501 8.8036 8.8392 9.1126 9.1408 9.2947 9.2970 9.7929 9.7956 10.0248 10.0383 10.2278 10.2413 10.3366 10.3567 k = 0.0789 0.0789 0.2270 ( 10854 PWs) bands (ev): -48.2861 -48.2861 -48.2860 -48.2860 -24.9510 -24.9509 -24.9502 -24.9501 -24.3267 -24.3261 -24.3255 -24.3253 -24.2513 -24.2510 -24.2508 -24.2507 -1.8179 -1.8179 -1.3015 -1.3014 0.9823 0.9827 4.7532 4.7564 6.0327 6.0626 6.2782 6.2872 6.3219 6.3224 6.5282 6.5302 6.5749 6.5976 7.0137 7.0792 7.2761 7.3015 7.4714 7.4899 7.7312 7.9322 8.0170 8.1391 8.6316 8.6486 8.7805 8.8183 9.1164 9.1425 9.3178 9.3198 9.8144 9.8166 10.0013 10.0138 10.1989 10.2130 10.3032 10.3215 k = 0.0702 0.0702 0.2270 ( 10868 PWs) bands (ev): -48.2861 -48.2861 -48.2860 -48.2860 -24.9509 -24.9508 -24.9501 -24.9500 -24.3266 -24.3260 -24.3254 -24.3253 -24.2511 -24.2508 -24.2507 -24.2506 -1.8409 -1.8409 -1.3224 -1.3224 0.9758 0.9762 4.7356 4.7383 6.0447 6.0719 6.2960 6.3007 6.3538 6.3556 6.5382 6.5426 6.5806 6.5982 7.0731 7.1398 7.3433 7.3706 7.5312 7.5471 7.7616 7.9402 8.0404 8.1399 8.6260 8.6402 8.7546 8.7935 9.0950 9.1151 9.3618 9.3653 9.8346 9.8363 9.9789 9.9903 10.1718 10.1855 10.2680 10.2845 k = 0.0614 0.0614 0.2270 ( 10860 PWs) bands (ev): -48.2862 -48.2862 -48.2861 -48.2861 -24.9509 -24.9507 -24.9500 -24.9499 -24.3265 -24.3260 -24.3253 -24.3252 -24.2509 -24.2507 -24.2506 -24.2504 -1.8612 -1.8612 -1.3410 -1.3409 0.9698 0.9702 4.7199 4.7222 6.0554 6.0797 6.3090 6.3112 6.3807 6.3846 6.5477 6.5535 6.5862 6.5990 7.1322 7.1993 7.4101 7.4399 7.5938 7.6048 7.7909 7.9388 8.0702 8.1428 8.6138 8.6246 8.7276 8.7666 9.0569 9.0700 9.4179 9.4220 9.8532 9.8544 9.9583 9.9682 10.1474 10.1598 10.2311 10.2456 k = 0.0526 0.0526 0.2270 ( 10834 PWs) bands (ev): -48.2862 -48.2862 -48.2861 -48.2861 -24.9508 -24.9507 -24.9499 -24.9498 -24.3264 -24.3260 -24.3253 -24.3252 -24.2508 -24.2505 -24.2505 -24.2503 -1.8788 -1.8788 -1.3571 -1.3570 0.9645 0.9648 4.7061 4.7081 6.0649 6.0861 6.3188 6.3196 6.4031 6.4086 6.5564 6.5625 6.5915 6.6002 7.1899 7.2562 7.4746 7.5071 7.6565 7.6589 7.8231 7.9360 8.1002 8.1482 8.5944 8.6014 8.7012 8.7388 9.0092 9.0153 9.4789 9.4834 9.8697 9.8705 9.9399 9.9481 10.1260 10.1367 10.1926 10.2050 k = 0.0439 0.0439 0.2270 ( 10826 PWs) bands (ev): -48.2862 -48.2862 -48.2861 -48.2861 -24.9507 -24.9506 -24.9498 -24.9498 -24.3263 -24.3260 -24.3252 -24.3251 -24.2507 -24.2504 -24.2504 -24.2503 -1.8937 -1.8937 -1.3708 -1.3707 0.9599 0.9601 4.6944 4.6961 6.0732 6.0911 6.3261 6.3263 6.4214 6.4278 6.5641 6.5698 6.5963 6.6016 7.2449 7.3089 7.5347 7.5703 7.7040 7.7141 7.8633 7.9380 8.1285 8.1563 8.5673 8.5703 8.6769 8.7114 8.9563 8.9569 9.5416 9.5463 9.8837 9.8842 9.9241 9.9303 10.1073 10.1165 10.1532 10.1632 k = 0.0351 0.0351 0.2270 ( 10834 PWs) bands (ev): -48.2862 -48.2862 -48.2861 -48.2861 -24.9506 -24.9506 -24.9498 -24.9497 -24.3263 -24.3260 -24.3251 -24.3251 -24.2506 -24.2504 -24.2503 -24.2502 -1.9060 -1.9060 -1.3820 -1.3820 0.9560 0.9562 4.6849 4.6861 6.0804 6.0948 6.3312 6.3317 6.4360 6.4424 6.5705 6.5755 6.6004 6.6032 7.2958 7.3550 7.5880 7.6271 7.7367 7.7575 7.9139 7.9523 8.1552 8.1680 8.5312 8.5320 8.6559 8.6855 8.8980 8.9042 9.6041 9.6086 9.8947 9.8951 9.9112 9.9154 10.0884 10.0970 10.1163 10.1229 k = 0.0263 0.0263 0.2270 ( 10818 PWs) bands (ev): -48.2862 -48.2862 -48.2861 -48.2861 -24.9506 -24.9505 -24.9497 -24.9497 -24.3262 -24.3260 -24.3251 -24.3250 -24.2505 -24.2503 -24.2502 -24.2501 -1.9155 -1.9155 -1.3907 -1.3907 0.9530 0.9531 4.6774 4.6783 6.0863 6.0972 6.3350 6.3356 6.4473 6.4530 6.5758 6.5796 6.6035 6.6047 7.3411 7.3919 7.6328 7.6746 7.7594 7.7792 7.9691 7.9835 8.1823 8.1857 8.4846 8.4885 8.6392 8.6624 8.8460 8.8556 9.6646 9.6686 9.8973 9.8987 9.9064 9.9075 10.0584 10.0662 10.0937 10.0973 k = 0.0175 0.0175 0.2270 ( 10818 PWs) bands (ev): -48.2862 -48.2862 -48.2861 -48.2861 -24.9506 -24.9505 -24.9497 -24.9497 -24.3261 -24.3260 -24.3251 -24.3250 -24.2504 -24.2503 -24.2502 -24.2501 -1.9223 -1.9223 -1.3970 -1.3970 0.9508 0.9509 4.6721 4.6727 6.0911 6.0984 6.3376 6.3382 6.4555 6.4598 6.5797 6.5824 6.6057 6.6061 7.3790 7.4169 7.6685 7.7085 7.7754 7.7842 8.0184 8.0217 8.2135 8.2140 8.4313 8.4370 8.6276 8.6433 8.8057 8.8154 9.7205 9.7237 9.8893 9.8899 9.9111 9.9113 10.0210 10.0265 10.0838 10.0861 k = 0.0088 0.0088 0.2270 ( 10806 PWs) bands (ev): -48.2862 -48.2862 -48.2861 -48.2861 -24.9505 -24.9505 -24.9497 -24.9496 -24.3261 -24.3260 -24.3250 -24.3250 -24.2504 -24.2503 -24.2501 -24.2501 -1.9264 -1.9264 -1.4008 -1.4008 0.9495 0.9495 4.6690 4.6693 6.0947 6.0984 6.3393 6.3396 6.4609 6.4632 6.5824 6.5837 6.6070 6.6070 7.4075 7.4280 7.6960 7.7225 7.7850 7.7853 8.0507 8.0509 8.2546 8.2551 8.3748 8.3801 8.6218 8.6297 8.7816 8.7877 9.7665 9.7684 9.8804 9.8808 9.9138 9.9139 9.9901 9.9931 10.0792 10.0803 k = 0.0000 0.0000 0.2270 ( 10790 PWs) bands (ev): -48.2862 -48.2862 -48.2861 -48.2861 -24.9505 -24.9505 -24.9496 -24.9496 -24.3260 -24.3260 -24.3250 -24.3250 -24.2503 -24.2503 -24.2501 -24.2501 -1.9278 -1.9278 -1.4020 -1.4020 0.9491 0.9491 4.6680 4.6680 6.0971 6.0971 6.3399 6.3399 6.4635 6.4635 6.5837 6.5837 6.6074 6.6074 7.4245 7.4245 7.7156 7.7156 7.7874 7.7874 8.0614 8.0614 8.2918 8.2918 8.3353 8.3353 8.6224 8.6224 8.7757 8.7757 9.7878 9.7878 9.8751 9.8751 9.9144 9.9144 9.9785 9.9785 10.0781 10.0781 k = 0.0000 0.5000-0.0000 ( 10866 PWs) bands (ev): -48.2854 -48.2854 -48.2854 -48.2854 -24.9550 -24.9550 -24.9530 -24.9530 -24.3338 -24.3338 -24.3235 -24.3235 -24.2625 -24.2625 -24.2496 -24.2496 -0.4170 -0.4170 -0.0391 -0.0391 0.3621 0.3621 3.6393 3.6393 4.3395 4.3395 4.8112 4.8112 5.8112 5.8112 6.2347 6.2347 6.4041 6.4041 6.5610 6.5610 6.6787 6.6787 7.9332 7.9332 7.9903 7.9903 8.1526 8.1526 8.2921 8.2921 8.3206 8.3206 9.4054 9.4054 9.4218 9.4218 9.7014 9.7014 10.2829 10.2829 10.3698 10.3698 10.8759 10.8759 k = 0.0000 0.5000 0.0119 ( 10848 PWs) bands (ev): -48.2854 -48.2854 -48.2854 -48.2854 -24.9550 -24.9550 -24.9530 -24.9530 -24.3338 -24.3338 -24.3235 -24.3235 -24.2625 -24.2625 -24.2496 -24.2496 -0.4162 -0.4162 -0.0390 -0.0390 0.3607 0.3607 3.6363 3.6363 4.3429 4.3429 4.8155 4.8155 5.8112 5.8112 6.2346 6.2346 6.4035 6.4035 6.5612 6.5612 6.6786 6.6786 7.9276 7.9276 7.9890 7.9890 8.1325 8.1325 8.2941 8.2941 8.3388 8.3388 9.4048 9.4048 9.4204 9.4204 9.7021 9.7021 10.2840 10.2840 10.3700 10.3700 10.8767 10.8767 k = 0.0000 0.5000 0.0239 ( 10854 PWs) bands (ev): -48.2854 -48.2854 -48.2854 -48.2854 -24.9550 -24.9550 -24.9530 -24.9530 -24.3338 -24.3338 -24.3235 -24.3235 -24.2625 -24.2625 -24.2496 -24.2496 -0.4141 -0.4141 -0.0386 -0.0386 0.3568 0.3568 3.6276 3.6276 4.3532 4.3532 4.8282 4.8282 5.8111 5.8111 6.2342 6.2342 6.4017 6.4017 6.5617 6.5617 6.6781 6.6781 7.9084 7.9084 7.9858 7.9858 8.0951 8.0951 8.2885 8.2885 8.3843 8.3843 9.4007 9.4007 9.4185 9.4185 9.7042 9.7042 10.2872 10.2872 10.3708 10.3708 10.8789 10.8789 k = 0.0000 0.5000 0.0358 ( 10844 PWs) bands (ev): -48.2854 -48.2854 -48.2854 -48.2854 -24.9550 -24.9550 -24.9530 -24.9530 -24.3338 -24.3338 -24.3234 -24.3234 -24.2625 -24.2625 -24.2496 -24.2496 -0.4105 -0.4105 -0.0381 -0.0381 0.3502 0.3502 3.6136 3.6136 4.3703 4.3703 4.8486 4.8486 5.8110 5.8110 6.2329 6.2329 6.3992 6.3992 6.5627 6.5627 6.6774 6.6774 7.8710 7.8710 7.9815 7.9815 8.0635 8.0635 8.2760 8.2760 8.4371 8.4371 9.3902 9.3902 9.4196 9.4196 9.7075 9.7075 10.2922 10.2922 10.3720 10.3720 10.8826 10.8826 k = 0.0000 0.5000 0.0478 ( 10832 PWs) bands (ev): -48.2854 -48.2854 -48.2854 -48.2854 -24.9550 -24.9550 -24.9530 -24.9530 -24.3338 -24.3338 -24.3234 -24.3234 -24.2625 -24.2625 -24.2496 -24.2496 -0.4055 -0.4055 -0.0373 -0.0373 0.3413 0.3413 3.5953 3.5953 4.3940 4.3940 4.8756 4.8756 5.8108 5.8108 6.2296 6.2296 6.3968 6.3968 6.5642 6.5642 6.6765 6.6765 7.8169 7.8169 7.9768 7.9768 8.0427 8.0427 8.2580 8.2580 8.4895 8.4895 9.3743 9.3743 9.4232 9.4232 9.7120 9.7120 10.2988 10.2988 10.3737 10.3737 10.8876 10.8876 k = 0.0000 0.5000 0.0597 ( 10832 PWs) bands (ev): -48.2854 -48.2854 -48.2854 -48.2854 -24.9550 -24.9550 -24.9530 -24.9530 -24.3338 -24.3338 -24.3234 -24.3234 -24.2625 -24.2625 -24.2496 -24.2496 -0.3992 -0.3992 -0.0363 -0.0363 0.3301 0.3301 3.5735 3.5735 4.4242 4.4242 4.9081 4.9081 5.8105 5.8105 6.2228 6.2228 6.3957 6.3957 6.5664 6.5664 6.6753 6.6753 7.7528 7.7528 7.9715 7.9715 8.0293 8.0293 8.2351 8.2351 8.5387 8.5387 9.3545 9.3545 9.4285 9.4285 9.7176 9.7176 10.3066 10.3066 10.3757 10.3757 10.8938 10.8938 k = 0.0000 0.5000 0.0717 ( 10832 PWs) bands (ev): -48.2854 -48.2854 -48.2854 -48.2854 -24.9550 -24.9550 -24.9530 -24.9530 -24.3339 -24.3339 -24.3234 -24.3234 -24.2625 -24.2625 -24.2496 -24.2496 -0.3917 -0.3917 -0.0352 -0.0352 0.3168 0.3168 3.5492 3.5492 4.4606 4.4606 4.9447 4.9447 5.8102 5.8102 6.2107 6.2107 6.3972 6.3972 6.5694 6.5694 6.6741 6.6741 7.6849 7.6849 7.9647 7.9647 8.0196 8.0196 8.2080 8.2080 8.5837 8.5837 9.3323 9.3323 9.4351 9.4351 9.7241 9.7241 10.3152 10.3152 10.3779 10.3779 10.9011 10.9011 k = 0.0000 0.5000 0.0836 ( 10836 PWs) bands (ev): -48.2854 -48.2854 -48.2854 -48.2854 -24.9550 -24.9550 -24.9530 -24.9530 -24.3339 -24.3339 -24.3234 -24.3234 -24.2625 -24.2625 -24.2496 -24.2496 -0.3830 -0.3830 -0.0339 -0.0339 0.3018 0.3018 3.5235 3.5235 4.5030 4.5030 4.9840 4.9840 5.8099 5.8099 6.1916 6.1916 6.4023 6.4023 6.5736 6.5736 6.6728 6.6728 7.6170 7.6170 7.9549 7.9549 8.0118 8.0118 8.1778 8.1778 8.6242 8.6242 9.3088 9.3088 9.4425 9.4425 9.7314 9.7314 10.3240 10.3240 10.3802 10.3802 10.9091 10.9091 k = 0.0000 0.5000 0.0956 ( 10848 PWs) bands (ev): -48.2854 -48.2854 -48.2854 -48.2854 -24.9550 -24.9550 -24.9530 -24.9530 -24.3339 -24.3339 -24.3234 -24.3234 -24.2625 -24.2625 -24.2496 -24.2496 -0.3732 -0.3732 -0.0326 -0.0326 0.2853 0.2853 3.4971 3.4971 4.5510 4.5510 5.0248 5.0248 5.8095 5.8095 6.1647 6.1647 6.4114 6.4114 6.5792 6.5792 6.6716 6.6716 7.5516 7.5516 7.9401 7.9401 8.0056 8.0056 8.1463 8.1463 8.6600 8.6600 9.2850 9.2850 9.4507 9.4507 9.7392 9.7392 10.3329 10.3329 10.3826 10.3826 10.9178 10.9178 k = 0.0000 0.5000 0.1075 ( 10852 PWs) bands (ev): -48.2854 -48.2854 -48.2854 -48.2854 -24.9550 -24.9550 -24.9530 -24.9530 -24.3339 -24.3339 -24.3234 -24.3234 -24.2625 -24.2625 -24.2496 -24.2496 -0.3625 -0.3625 -0.0312 -0.0312 0.2677 0.2677 3.4709 3.4709 4.6042 4.6042 5.0657 5.0657 5.8092 5.8092 6.1295 6.1295 6.4237 6.4237 6.5870 6.5870 6.6707 6.6707 7.4903 7.4903 7.9177 7.9177 8.0006 8.0006 8.1162 8.1162 8.6913 8.6913 9.2617 9.2617 9.4594 9.4594 9.7474 9.7474 10.3415 10.3415 10.3850 10.3850 10.9270 10.9270 k = 0.0000 0.5000 0.1194 ( 10856 PWs) bands (ev): -48.2854 -48.2854 -48.2854 -48.2854 -24.9550 -24.9550 -24.9530 -24.9530 -24.3339 -24.3339 -24.3234 -24.3234 -24.2625 -24.2625 -24.2496 -24.2496 -0.3511 -0.3511 -0.0297 -0.0297 0.2494 0.2494 3.4455 3.4455 4.6622 4.6622 5.1058 5.1058 5.8088 5.8088 6.0865 6.0865 6.4382 6.4382 6.5976 6.5976 6.6704 6.6704 7.4344 7.4344 7.8860 7.8860 7.9968 7.9968 8.0900 8.0900 8.7183 8.7183 9.2398 9.2398 9.4683 9.4683 9.7557 9.7557 10.3495 10.3495 10.3873 10.3873 10.9362 10.9362 k = 0.0000 0.5000 0.1314 ( 10860 PWs) bands (ev): -48.2854 -48.2854 -48.2854 -48.2854 -24.9550 -24.9550 -24.9530 -24.9530 -24.3339 -24.3339 -24.3234 -24.3234 -24.2625 -24.2625 -24.2496 -24.2496 -0.3393 -0.3393 -0.0283 -0.0283 0.2307 0.2307 3.4214 3.4214 4.7244 4.7244 5.1439 5.1439 5.8083 5.8083 6.0361 6.0361 6.4533 6.4533 6.6115 6.6115 6.6713 6.6713 7.3845 7.3845 7.8445 7.8445 7.9938 7.9938 8.0691 8.0691 8.7413 8.7413 9.2196 9.2196 9.4772 9.4772 9.7639 9.7639 10.3569 10.3569 10.3895 10.3895 10.9454 10.9454 k = 0.0000 0.5000 0.1433 ( 10860 PWs) bands (ev): -48.2854 -48.2854 -48.2854 -48.2854 -24.9550 -24.9550 -24.9530 -24.9530 -24.3339 -24.3339 -24.3234 -24.3234 -24.2625 -24.2625 -24.2496 -24.2496 -0.3272 -0.3272 -0.0269 -0.0269 0.2121 0.2121 3.3993 3.3993 4.7901 4.7901 5.1791 5.1791 5.8078 5.8078 5.9793 5.9793 6.4672 6.4672 6.6276 6.6276 6.6753 6.6753 7.3411 7.3411 7.7950 7.7950 7.9916 7.9916 8.0534 8.0534 8.7607 8.7607 9.2016 9.2016 9.4859 9.4859 9.7718 9.7718 10.3634 10.3634 10.3916 10.3916 10.9543 10.9543 k = 0.0000 0.5000 0.1553 ( 10862 PWs) bands (ev): -48.2854 -48.2854 -48.2854 -48.2854 -24.9550 -24.9550 -24.9530 -24.9530 -24.3339 -24.3339 -24.3234 -24.3234 -24.2625 -24.2625 -24.2496 -24.2496 -0.3152 -0.3152 -0.0257 -0.0257 0.1941 0.1941 3.3794 3.3794 4.8587 4.8587 5.2108 5.2108 5.8071 5.8071 5.9175 5.9175 6.4789 6.4789 6.6414 6.6414 6.6874 6.6874 7.3043 7.3043 7.7403 7.7403 7.9899 7.9899 8.0417 8.0417 8.7768 8.7768 9.1859 9.1859 9.4941 9.4941 9.7791 9.7791 10.3691 10.3691 10.3934 10.3934 10.9626 10.9626 k = 0.0000 0.5000 0.1672 ( 10856 PWs) bands (ev): -48.2854 -48.2854 -48.2854 -48.2854 -24.9550 -24.9550 -24.9530 -24.9530 -24.3339 -24.3339 -24.3234 -24.3234 -24.2625 -24.2625 -24.2496 -24.2496 -0.3037 -0.3037 -0.0245 -0.0245 0.1774 0.1774 3.3620 3.3620 4.9291 4.9291 5.2382 5.2382 5.8054 5.8054 5.8529 5.8529 6.4881 6.4881 6.6484 6.6484 6.7110 6.7110 7.2739 7.2739 7.6835 7.6835 7.9885 7.9885 8.0329 8.0329 8.7899 8.7899 9.1727 9.1727 9.5015 9.5015 9.7857 9.7857 10.3739 10.3739 10.3950 10.3950 10.9701 10.9701 k = 0.0000 0.5000 0.1792 ( 10850 PWs) bands (ev): -48.2854 -48.2854 -48.2854 -48.2854 -24.9550 -24.9550 -24.9530 -24.9530 -24.3339 -24.3339 -24.3234 -24.3234 -24.2625 -24.2625 -24.2496 -24.2496 -0.2933 -0.2933 -0.0235 -0.0235 0.1624 0.1624 3.3475 3.3475 4.9997 4.9997 5.2609 5.2609 5.7786 5.7786 5.8117 5.8117 6.4949 6.4949 6.6510 6.6510 6.7416 6.7416 7.2496 7.2496 7.6280 7.6280 7.9875 7.9875 8.0264 8.0264 8.8002 8.8002 9.1619 9.1619 9.5079 9.5079 9.7913 9.7913 10.3778 10.3778 10.3964 10.3964 10.9766 10.9766 k = 0.0000 0.5000 0.1911 ( 10868 PWs) bands (ev): -48.2854 -48.2854 -48.2854 -48.2854 -24.9550 -24.9550 -24.9530 -24.9530 -24.3339 -24.3339 -24.3234 -24.3234 -24.2625 -24.2625 -24.2496 -24.2496 -0.2843 -0.2843 -0.0227 -0.0227 0.1498 0.1498 3.3359 3.3359 5.0683 5.0683 5.2784 5.2784 5.7148 5.7148 5.8088 5.8088 6.4996 6.4996 6.6519 6.6519 6.7735 6.7735 7.2311 7.2311 7.5774 7.5774 7.9867 7.9867 8.0217 8.0217 8.8079 8.8079 9.1536 9.1536 9.5132 9.5132 9.7959 9.7959 10.3808 10.3808 10.3975 10.3975 10.9818 10.9818 k = 0.0000 0.5000 0.2031 ( 10872 PWs) bands (ev): -48.2854 -48.2854 -48.2854 -48.2854 -24.9550 -24.9550 -24.9530 -24.9530 -24.3339 -24.3339 -24.3234 -24.3234 -24.2625 -24.2625 -24.2496 -24.2496 -0.2775 -0.2775 -0.0221 -0.0221 0.1402 0.1402 3.3276 3.3276 5.1303 5.1303 5.2902 5.2902 5.6551 5.6551 5.8082 5.8082 6.5028 6.5028 6.6522 6.6522 6.8018 6.8018 7.2182 7.2182 7.5360 7.5360 7.9862 7.9862 8.0184 8.0184 8.8133 8.8133 9.1478 9.1478 9.5171 9.5171 9.7993 9.7993 10.3829 10.3829 10.3983 10.3983 10.9857 10.9857 k = 0.0000 0.5000 0.2150 ( 10864 PWs) bands (ev): -48.2854 -48.2854 -48.2854 -48.2854 -24.9550 -24.9550 -24.9530 -24.9530 -24.3339 -24.3339 -24.3234 -24.3234 -24.2625 -24.2625 -24.2496 -24.2496 -0.2731 -0.2731 -0.0218 -0.0218 0.1342 0.1342 3.3226 3.3226 5.1776 5.1776 5.2962 5.2962 5.6102 5.6102 5.8079 5.8079 6.5045 6.5045 6.6523 6.6523 6.8215 6.8215 7.2106 7.2106 7.5084 7.5084 7.9859 7.9859 8.0165 8.0165 8.8165 8.8165 9.1442 9.1442 9.5194 9.5194 9.8013 9.8013 10.3842 10.3842 10.3987 10.3987 10.9880 10.9880 k = 0.0000 0.5000 0.2270 ( 10856 PWs) bands (ev): -48.2854 -48.2854 -48.2854 -48.2854 -24.9550 -24.9550 -24.9530 -24.9530 -24.3339 -24.3339 -24.3234 -24.3234 -24.2625 -24.2625 -24.2496 -24.2496 -0.2716 -0.2716 -0.0217 -0.0217 0.1322 0.1322 3.3209 3.3209 5.1964 5.1964 5.2975 5.2975 5.5928 5.5928 5.8078 5.8078 6.5051 6.5051 6.6524 6.6524 6.8286 6.8286 7.2080 7.2080 7.4987 7.4987 7.9858 7.9858 8.0159 8.0159 8.8176 8.8176 9.1431 9.1431 9.5202 9.5202 9.8020 9.8020 10.3846 10.3846 10.3989 10.3989 10.9888 10.9888 k = 0.5000 0.5000-0.0000 ( 10828 PWs) bands (ev): -48.2846 -48.2846 -48.2846 -48.2846 -24.9576 -24.9576 -24.9575 -24.9575 -24.3319 -24.3319 -24.3314 -24.3314 -24.2618 -24.2618 -24.2613 -24.2613 0.5723 0.5723 0.7259 0.7259 0.7273 0.7273 4.7126 4.7126 4.7877 4.7877 5.3319 5.3319 5.5784 5.5784 6.1303 6.1303 6.2205 6.2205 6.5310 6.5310 6.6588 6.6588 6.6912 6.6912 7.0761 7.0761 7.1442 7.1442 7.3232 7.3232 7.3684 7.3684 7.5516 7.5516 7.9693 7.9693 9.1365 9.1365 10.4944 10.4944 10.4986 10.4986 10.5787 10.5787 k = 0.5000 0.5000 0.0119 ( 10812 PWs) bands (ev): -48.2846 -48.2846 -48.2846 -48.2846 -24.9576 -24.9576 -24.9575 -24.9575 -24.3319 -24.3319 -24.3314 -24.3314 -24.2618 -24.2618 -24.2613 -24.2613 0.5723 0.5723 0.7259 0.7259 0.7274 0.7274 4.7128 4.7128 4.7871 4.7871 5.3295 5.3295 5.5753 5.5753 6.1322 6.1322 6.2222 6.2222 6.5301 6.5301 6.6589 6.6589 6.6934 6.6934 7.0762 7.0762 7.1426 7.1426 7.3257 7.3257 7.3714 7.3714 7.5540 7.5540 7.9679 7.9679 9.1364 9.1364 10.4943 10.4943 10.4985 10.4985 10.5780 10.5780 k = 0.5000 0.5000 0.0239 ( 10812 PWs) bands (ev): -48.2846 -48.2846 -48.2846 -48.2846 -24.9576 -24.9576 -24.9575 -24.9575 -24.3319 -24.3319 -24.3314 -24.3314 -24.2618 -24.2618 -24.2613 -24.2613 0.5723 0.5723 0.7261 0.7261 0.7276 0.7276 4.7132 4.7132 4.7856 4.7856 5.3225 5.3225 5.5663 5.5663 6.1376 6.1376 6.2274 6.2274 6.5275 6.5275 6.6591 6.6591 6.6997 6.6997 7.0765 7.0765 7.1381 7.1381 7.3332 7.3332 7.3801 7.3801 7.5613 7.5613 7.9639 7.9639 9.1362 9.1362 10.4939 10.4939 10.4983 10.4983 10.5761 10.5761 k = 0.5000 0.5000 0.0358 ( 10796 PWs) bands (ev): -48.2846 -48.2846 -48.2846 -48.2846 -24.9576 -24.9576 -24.9575 -24.9575 -24.3319 -24.3319 -24.3314 -24.3314 -24.2618 -24.2618 -24.2613 -24.2613 0.5724 0.5724 0.7264 0.7264 0.7279 0.7279 4.7139 4.7139 4.7831 4.7831 5.3113 5.3113 5.5521 5.5521 6.1459 6.1459 6.2355 6.2355 6.5232 6.5232 6.6595 6.6595 6.7101 6.7101 7.0770 7.0770 7.1314 7.1314 7.3452 7.3452 7.3941 7.3941 7.5730 7.5730 7.9571 7.9571 9.1358 9.1358 10.4933 10.4933 10.4978 10.4978 10.5729 10.5729 k = 0.5000 0.5000 0.0478 ( 10816 PWs) bands (ev): -48.2846 -48.2846 -48.2846 -48.2846 -24.9576 -24.9576 -24.9575 -24.9575 -24.3318 -24.3318 -24.3314 -24.3314 -24.2618 -24.2618 -24.2613 -24.2613 0.5724 0.5724 0.7269 0.7269 0.7283 0.7283 4.7149 4.7149 4.7797 4.7797 5.2964 5.2964 5.5336 5.5336 6.1563 6.1563 6.2461 6.2461 6.5174 6.5174 6.6603 6.6603 6.7241 6.7241 7.0776 7.0776 7.1234 7.1234 7.3614 7.3614 7.4131 7.4131 7.5886 7.5886 7.9478 7.9478 9.1352 9.1352 10.4923 10.4923 10.4972 10.4972 10.5685 10.5685 k = 0.5000 0.5000 0.0597 ( 10800 PWs) bands (ev): -48.2846 -48.2846 -48.2846 -48.2846 -24.9576 -24.9576 -24.9575 -24.9575 -24.3318 -24.3318 -24.3314 -24.3314 -24.2618 -24.2618 -24.2613 -24.2613 0.5725 0.5725 0.7274 0.7274 0.7288 0.7288 4.7161 4.7161 4.7756 4.7756 5.2786 5.2786 5.5119 5.5119 6.1678 6.1678 6.2585 6.2585 6.5104 6.5104 6.6614 6.6614 6.7417 6.7417 7.0782 7.0782 7.1149 7.1149 7.3812 7.3812 7.4363 7.4363 7.6075 7.6075 7.9362 7.9362 9.1345 9.1345 10.4909 10.4909 10.4962 10.4962 10.5630 10.5630 k = 0.5000 0.5000 0.0717 ( 10800 PWs) bands (ev): -48.2846 -48.2846 -48.2846 -48.2846 -24.9576 -24.9576 -24.9575 -24.9575 -24.3318 -24.3318 -24.3314 -24.3314 -24.2618 -24.2618 -24.2613 -24.2613 0.5725 0.5725 0.7281 0.7281 0.7293 0.7293 4.7175 4.7175 4.7708 4.7708 5.2587 5.2587 5.4882 5.4882 6.1797 6.1797 6.2719 6.2719 6.5023 6.5023 6.6628 6.6628 6.7625 6.7625 7.0786 7.0786 7.1066 7.1066 7.4041 7.4041 7.4631 7.4631 7.6288 7.6288 7.9225 7.9225 9.1337 9.1337 10.4890 10.4890 10.4947 10.4947 10.5566 10.5566 k = 0.5000 0.5000 0.0836 ( 10808 PWs) bands (ev): -48.2846 -48.2846 -48.2846 -48.2846 -24.9576 -24.9576 -24.9575 -24.9575 -24.3318 -24.3318 -24.3314 -24.3314 -24.2618 -24.2618 -24.2613 -24.2613 0.5726 0.5726 0.7288 0.7288 0.7300 0.7300 4.7191 4.7191 4.7655 4.7655 5.2374 5.2374 5.4632 5.4632 6.1912 6.1912 6.2857 6.2857 6.4935 6.4935 6.6644 6.6644 6.7862 6.7862 7.0785 7.0785 7.0993 7.0993 7.4296 7.4296 7.4927 7.4927 7.6520 7.6520 7.9071 7.9071 9.1328 9.1328 10.4863 10.4863 10.4926 10.4926 10.5495 10.5495 k = 0.5000 0.5000 0.0956 ( 10796 PWs) bands (ev): -48.2846 -48.2846 -48.2846 -48.2846 -24.9576 -24.9576 -24.9575 -24.9575 -24.3318 -24.3318 -24.3314 -24.3314 -24.2618 -24.2618 -24.2613 -24.2613 0.5727 0.5727 0.7295 0.7295 0.7307 0.7307 4.7207 4.7207 4.7599 4.7599 5.2154 5.2154 5.4379 5.4379 6.2019 6.2019 6.2994 6.2994 6.4843 6.4843 6.6661 6.6661 6.8125 6.8125 7.0771 7.0771 7.0941 7.0941 7.4570 7.4570 7.5241 7.5241 7.6763 7.6763 7.8906 7.8906 9.1318 9.1318 10.4828 10.4828 10.4895 10.4895 10.5422 10.5422 k = 0.5000 0.5000 0.1075 ( 10800 PWs) bands (ev): -48.2846 -48.2846 -48.2846 -48.2846 -24.9576 -24.9576 -24.9575 -24.9575 -24.3318 -24.3318 -24.3314 -24.3314 -24.2618 -24.2618 -24.2613 -24.2613 0.5728 0.5728 0.7303 0.7303 0.7314 0.7314 4.7225 4.7225 4.7542 4.7542 5.1934 5.1934 5.4130 5.4130 6.2114 6.2114 6.3125 6.3125 6.4751 6.4751 6.6679 6.6679 6.8409 6.8409 7.0737 7.0737 7.0917 7.0917 7.4855 7.4855 7.5557 7.5557 7.7011 7.7011 7.8740 7.8740 9.1307 9.1307 10.4780 10.4780 10.4849 10.4849 10.5352 10.5352 k = 0.5000 0.5000 0.1194 ( 10816 PWs) bands (ev): -48.2846 -48.2846 -48.2846 -48.2846 -24.9576 -24.9576 -24.9575 -24.9575 -24.3318 -24.3318 -24.3314 -24.3314 -24.2618 -24.2618 -24.2613 -24.2613 0.5729 0.5729 0.7311 0.7311 0.7322 0.7322 4.7242 4.7242 4.7484 4.7484 5.1720 5.1720 5.3891 5.3891 6.2196 6.2196 6.3248 6.3248 6.4660 6.4660 6.6697 6.6697 6.8707 6.8707 7.0689 7.0689 7.0918 7.0918 7.5145 7.5145 7.5858 7.5858 7.7257 7.7257 7.8588 7.8588 9.1296 9.1296 10.4718 10.4718 10.4787 10.4787 10.5292 10.5292 k = 0.5000 0.5000 0.1314 ( 10804 PWs) bands (ev): -48.2846 -48.2846 -48.2846 -48.2846 -24.9576 -24.9576 -24.9575 -24.9575 -24.3318 -24.3318 -24.3314 -24.3314 -24.2618 -24.2618 -24.2613 -24.2613 0.5730 0.5730 0.7319 0.7319 0.7329 0.7329 4.7258 4.7258 4.7429 4.7429 5.1517 5.1517 5.3666 5.3666 6.2263 6.2263 6.3359 6.3359 6.4575 6.4575 6.6715 6.6715 6.9013 6.9013 7.0640 7.0640 7.0933 7.0933 7.5428 7.5428 7.6117 7.6117 7.7495 7.7495 7.8472 7.8472 9.1284 9.1284 10.4639 10.4639 10.4707 10.4707 10.5245 10.5245 k = 0.5000 0.5000 0.1433 ( 10804 PWs) bands (ev): -48.2846 -48.2846 -48.2846 -48.2846 -24.9576 -24.9576 -24.9575 -24.9575 -24.3318 -24.3318 -24.3314 -24.3314 -24.2618 -24.2618 -24.2613 -24.2613 0.5731 0.5731 0.7327 0.7327 0.7336 0.7336 4.7272 4.7272 4.7378 4.7378 5.1328 5.1328 5.3459 5.3459 6.2316 6.2316 6.3458 6.3458 6.4497 6.4497 6.6731 6.6731 6.9317 6.9317 7.0595 7.0595 7.0960 7.0960 7.5696 7.5696 7.6300 7.6300 7.7721 7.7721 7.8419 7.8419 9.1273 9.1273 10.4545 10.4545 10.4615 10.4615 10.5211 10.5211 k = 0.5000 0.5000 0.1553 ( 10796 PWs) bands (ev): -48.2846 -48.2846 -48.2846 -48.2846 -24.9576 -24.9576 -24.9575 -24.9575 -24.3318 -24.3318 -24.3314 -24.3314 -24.2618 -24.2618 -24.2613 -24.2613 0.5731 0.5731 0.7334 0.7334 0.7343 0.7343 4.7278 4.7278 4.7338 4.7338 5.1158 5.1158 5.3274 5.3274 6.2356 6.2356 6.3544 6.3544 6.4427 6.4427 6.6746 6.6746 6.9608 6.9608 7.0555 7.0555 7.1001 7.1001 7.5930 7.5930 7.6389 7.6389 7.7938 7.7938 7.8446 7.8446 9.1263 9.1263 10.4440 10.4440 10.4516 10.4516 10.5187 10.5187 k = 0.5000 0.5000 0.1672 ( 10796 PWs) bands (ev): -48.2846 -48.2846 -48.2846 -48.2846 -24.9576 -24.9576 -24.9575 -24.9575 -24.3318 -24.3318 -24.3315 -24.3315 -24.2618 -24.2618 -24.2614 -24.2614 0.5732 0.5732 0.7340 0.7340 0.7349 0.7349 4.7262 4.7262 4.7325 4.7325 5.1010 5.1010 5.3114 5.3114 6.2385 6.2385 6.3617 6.3617 6.4368 6.4368 6.6760 6.6760 6.9868 6.9868 7.0521 7.0521 7.1060 7.1060 7.6089 7.6089 7.6422 7.6422 7.8148 7.8148 7.8535 7.8535 9.1254 9.1254 10.4332 10.4332 10.4416 10.4416 10.5171 10.5171 k = 0.5000 0.5000 0.1792 ( 10796 PWs) bands (ev): -48.2846 -48.2846 -48.2846 -48.2846 -24.9576 -24.9576 -24.9575 -24.9575 -24.3318 -24.3318 -24.3315 -24.3315 -24.2618 -24.2618 -24.2614 -24.2614 0.5733 0.5733 0.7346 0.7346 0.7354 0.7354 4.7231 4.7231 4.7330 4.7330 5.0885 5.0885 5.2980 5.2980 6.2404 6.2404 6.3677 6.3677 6.4320 6.4320 6.6771 6.6771 7.0083 7.0083 7.0494 7.0494 7.1142 7.1142 7.6097 7.6097 7.6504 7.6504 7.8349 7.8349 7.8653 7.8653 9.1245 9.1245 10.4231 10.4231 10.4323 10.4323 10.5159 10.5159 k = 0.5000 0.5000 0.1911 ( 10796 PWs) bands (ev): -48.2846 -48.2846 -48.2846 -48.2846 -24.9576 -24.9576 -24.9575 -24.9575 -24.3318 -24.3318 -24.3315 -24.3315 -24.2618 -24.2618 -24.2614 -24.2614 0.5733 0.5733 0.7350 0.7350 0.7358 0.7358 4.7204 4.7204 4.7338 4.7338 5.0786 5.0786 5.2874 5.2874 6.2416 6.2416 6.3724 6.3724 6.4282 6.4282 6.6780 6.6780 7.0241 7.0241 7.0473 7.0473 7.1242 7.1242 7.6000 7.6000 7.6624 7.6624 7.8527 7.8527 7.8766 7.8766 9.1239 9.1239 10.4142 10.4142 10.4243 10.4243 10.5152 10.5152 k = 0.5000 0.5000 0.2031 ( 10816 PWs) bands (ev): -48.2846 -48.2846 -48.2846 -48.2846 -24.9576 -24.9576 -24.9575 -24.9575 -24.3318 -24.3318 -24.3315 -24.3315 -24.2618 -24.2618 -24.2614 -24.2614 0.5733 0.5733 0.7354 0.7354 0.7361 0.7361 4.7183 4.7183 4.7344 4.7344 5.0714 5.0714 5.2798 5.2798 6.2423 6.2423 6.3757 6.3757 6.4255 6.4255 6.6787 6.6787 7.0342 7.0342 7.0458 7.0458 7.1345 7.1345 7.5888 7.5888 7.6725 7.6725 7.8665 7.8665 7.8858 7.8858 9.1234 9.1234 10.4074 10.4074 10.4181 10.4181 10.5147 10.5147 k = 0.5000 0.5000 0.2150 ( 10824 PWs) bands (ev): -48.2846 -48.2846 -48.2846 -48.2846 -24.9576 -24.9576 -24.9575 -24.9575 -24.3318 -24.3318 -24.3315 -24.3315 -24.2618 -24.2618 -24.2614 -24.2614 0.5734 0.5734 0.7356 0.7356 0.7363 0.7363 4.7170 4.7170 4.7348 4.7348 5.0671 5.0671 5.2751 5.2751 6.2426 6.2426 6.3778 6.3778 6.4239 6.4239 6.6791 6.6791 7.0397 7.0397 7.0449 7.0449 7.1422 7.1422 7.5806 7.5806 7.6790 7.6790 7.8754 7.8754 7.8916 7.8916 9.1230 9.1230 10.4030 10.4030 10.4142 10.4142 10.5144 10.5144 k = 0.5000 0.5000 0.2270 ( 10824 PWs) bands (ev): -48.2846 -48.2846 -48.2846 -48.2846 -24.9576 -24.9576 -24.9575 -24.9575 -24.3318 -24.3318 -24.3315 -24.3315 -24.2618 -24.2618 -24.2614 -24.2614 0.5734 0.5734 0.7356 0.7356 0.7363 0.7363 4.7166 4.7166 4.7349 4.7349 5.0656 5.0656 5.2736 5.2736 6.2427 6.2427 6.3785 6.3785 6.4234 6.4234 6.6792 6.6792 7.0414 7.0414 7.0446 7.0446 7.1450 7.1450 7.5776 7.5776 7.6812 7.6812 7.8784 7.8784 7.8936 7.8936 9.1229 9.1229 10.4016 10.4016 10.4129 10.4129 10.5143 10.5143 Writing output data file Ti2CuSb3.save init_run : 0.99s CPU 0.58s WALL ( 1 calls) electrons : 768.56s CPU 623.02s WALL ( 1 calls) Called by init_run: wfcinit : 0.00s CPU 0.00s WALL ( 1 calls) potinit : 0.08s CPU 0.05s WALL ( 1 calls) Called by electrons: c_bands : 768.54s CPU 623.00s 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 : 0.36s CPU 0.21s WALL ( 1 calls) Called by c_bands: init_us_2 : 0.62s CPU 0.75s WALL ( 344 calls) cegterg : 697.91s CPU 580.15s WALL ( 709 calls) Called by sum_band: Called by *egterg: h_psi : 480.93s CPU 354.69s WALL ( 13083 calls) s_psi : 28.42s CPU 23.76s WALL ( 13083 calls) g_psi : 1.58s CPU 1.44s WALL ( 12030 calls) cdiaghg : 135.32s CPU 132.43s WALL ( 12374 calls) cegterg:over : 36.22s CPU 34.34s WALL ( 12030 calls) cegterg:upda : 35.32s CPU 33.58s WALL ( 12030 calls) cegterg:last : 17.01s CPU 17.04s WALL ( 2286 calls) cdiaghg:chol : 7.82s CPU 7.78s WALL ( 12374 calls) cdiaghg:inve : 5.17s CPU 5.07s WALL ( 12374 calls) cdiaghg:para : 8.20s CPU 8.51s WALL ( 24748 calls) Called by h_psi: h_psi:vloc : 410.26s CPU 294.72s WALL ( 13083 calls) h_psi:vnl : 69.08s CPU 58.62s WALL ( 13083 calls) add_vuspsi : 38.18s CPU 31.65s WALL ( 13083 calls) General routines calbec : 30.80s CPU 26.92s WALL ( 13083 calls) fft : 0.04s CPU 0.03s WALL ( 15 calls) fftw : 393.56s CPU 279.62s WALL ( 1674792 calls) davcio : 0.68s CPU 2.70s WALL ( 688 calls) Parallel routines fft_scatter : 133.50s CPU 112.72s WALL ( 1674807 calls) PWSCF : 13m26.15s CPU 11m16.92s WALL This run was terminated on: 3:12:46 12Feb2017 =------------------------------------------------------------------------------= JOB DONE. =------------------------------------------------------------------------------=