Program PWSCF v.5.1.1 starts on 2Nov2015 at 0: 0:24 This program is part of the open-source Quantum ESPRESSO suite for quantum simulation of materials; please cite "P. Giannozzi et al., J. Phys.:Condens. Matter 21 395502 (2009); URL http://www.quantum-espresso.org", in publications or presentations arising from this work. More details at http://www.quantum-espresso.org/quote Parallel version (MPI), running on 48 processors R & G space division: proc/nbgrp/npool/nimage = 48 Waiting for input... Reading input from standard input Current dimensions of program PWSCF are: Max number of different atomic species (ntypx) = 10 Max number of k-points (npk) = 40000 Max angular momentum in pseudopotentials (lmaxx) = 3 Atomic positions and unit cell read from directory: ./VCu3S4.save/ file Cu.rel-pbe-dn-rrkjus_psl.1.0.0.UPF: wavefunction(s) 3D renormalized file V.rel-pbe-spnl-rrkjus_psl.1.0.0.UPF: wavefunction(s) 3P 3P 3D 3D renormalized Subspace diagonalization in iterative solution of the eigenvalue problem: a serial algorithm will be used Parallelization info -------------------- sticks: dense smooth PW G-vecs: dense smooth PW Min 111 33 9 6109 977 153 Max 112 34 10 6114 1000 158 Sum 5345 1597 465 293291 47497 7441 bravais-lattice index = 14 lattice parameter (alat) = 10.1913 a.u. unit-cell volume = 1058.4925 (a.u.)^3 number of atoms/cell = 8 number of atomic types = 3 number of electrons = 70.00 number of Kohn-Sham states= 84 kinetic-energy cutoff = 48.0000 Ry charge density cutoff = 646.0000 Ry Exchange-correlation = PBE ( 1 4 3 4 0 0) Non magnetic calculation with spin-orbit celldm(1)= 10.191292 celldm(2)= 1.000000 celldm(3)= 1.000000 celldm(4)= 0.000000 celldm(5)= 0.000000 celldm(6)= 0.000000 crystal axes: (cart. coord. in units of alat) a(1) = ( 1.000000 0.000000 0.000000 ) a(2) = ( 0.000000 1.000000 0.000000 ) a(3) = ( 0.000000 0.000000 1.000000 ) reciprocal axes: (cart. coord. in units 2 pi/alat) b(1) = ( 1.000000 -0.000000 -0.000000 ) b(2) = ( 0.000000 1.000000 -0.000000 ) b(3) = ( 0.000000 0.000000 1.000000 ) PseudoPot. # 1 for S read from file: /home/autes/Pseudo/S.rel-pbe-n-rrkjus_psl.1.0.0.UPF MD5 check sum: 95f1324244b600346090892298cb4451 Pseudo is Ultrasoft + core correction, Zval = 6.0 Generated using "atomic" code by A. Dal Corso v.5.0.2 svn rev. 9656 Using radial grid of 1151 points, 10 beta functions with: l(1) = 0 l(2) = 0 l(3) = 1 l(4) = 1 l(5) = 1 l(6) = 1 l(7) = 2 l(8) = 2 l(9) = 2 l(10) = 2 Q(r) pseudized with 0 coefficients PseudoPot. # 2 for Cu read from file: /home/autes/Pseudo/Cu.rel-pbe-dn-rrkjus_psl.1.0.0.UPF MD5 check sum: bfb9b73be46f5385f72b338ff57911ad Pseudo is Ultrasoft + core correction, Zval = 11.0 Generated using "atomic" code by A. Dal Corso v.5.0.2 svn rev. 9656 Using radial grid of 1199 points, 10 beta functions with: l(1) = 0 l(2) = 0 l(3) = 1 l(4) = 1 l(5) = 1 l(6) = 1 l(7) = 2 l(8) = 2 l(9) = 2 l(10) = 2 Q(r) pseudized with 0 coefficients PseudoPot. # 3 for V read from file: /home/autes/Pseudo/V.rel-pbe-spnl-rrkjus_psl.1.0.0.UPF MD5 check sum: 97c593a54d8a0043da5648c660d67431 Pseudo is Ultrasoft + core correction, Zval = 13.0 Generated using "atomic" code by A. Dal Corso v.5.0.2 svn rev. 9656 Using radial grid of 1181 points, 10 beta functions with: l(1) = 0 l(2) = 0 l(3) = 1 l(4) = 1 l(5) = 1 l(6) = 1 l(7) = 2 l(8) = 2 l(9) = 2 l(10) = 2 Q(r) pseudized with 0 coefficients atomic species valence mass pseudopotential S 6.00 32.06500 S( 1.00) Cu 11.00 63.54600 Cu( 1.00) V 13.00 50.94150 V( 1.00) 24 Sym. Ops. (no inversion) found s frac. trans. isym = 1 identity cryst. s( 1) = ( 1 0 0 ) ( 0 1 0 ) ( 0 0 1 ) cart. s( 1) = ( 1.0000000 0.0000000 0.0000000 ) ( 0.0000000 1.0000000 0.0000000 ) ( 0.0000000 0.0000000 1.0000000 ) isym = 2 180 deg rotation - cart. axis [0,0,1] cryst. s( 2) = ( -1 0 0 ) ( 0 -1 0 ) ( 0 0 1 ) cart. s( 2) = ( -1.0000000 0.0000000 0.0000000 ) ( 0.0000000 -1.0000000 0.0000000 ) ( 0.0000000 0.0000000 1.0000000 ) isym = 3 180 deg rotation - cart. axis [0,1,0] cryst. s( 3) = ( -1 0 0 ) ( 0 1 0 ) ( 0 0 -1 ) cart. s( 3) = ( -1.0000000 0.0000000 -0.0000000 ) ( 0.0000000 1.0000000 -0.0000000 ) ( 0.0000000 0.0000000 -1.0000000 ) isym = 4 180 deg rotation - cart. axis [1,0,0] cryst. s( 4) = ( 1 0 0 ) ( 0 -1 0 ) ( 0 0 -1 ) cart. s( 4) = ( 1.0000000 -0.0000000 -0.0000000 ) ( 0.0000000 -1.0000000 0.0000000 ) ( 0.0000000 0.0000000 -1.0000000 ) isym = 5 120 deg rotation - cart. axis [-1,-1,-1] cryst. s( 5) = ( 0 0 1 ) ( 1 0 0 ) ( 0 1 0 ) cart. s( 5) = ( 0.0000000 1.0000000 -0.0000000 ) ( 0.0000000 -0.0000000 1.0000000 ) ( 1.0000000 -0.0000000 -0.0000000 ) isym = 6 120 deg rotation - cart. axis [-1,1,1] cryst. s( 6) = ( 0 0 -1 ) ( -1 0 0 ) ( 0 1 0 ) cart. s( 6) = ( -0.0000000 -1.0000000 0.0000000 ) ( -0.0000000 0.0000000 1.0000000 ) ( -1.0000000 0.0000000 0.0000000 ) isym = 7 120 deg rotation - cart. axis [1,1,-1] cryst. s( 7) = ( 0 0 -1 ) ( 1 0 0 ) ( 0 -1 0 ) cart. s( 7) = ( -0.0000000 1.0000000 -0.0000000 ) ( -0.0000000 0.0000000 -1.0000000 ) ( -1.0000000 0.0000000 0.0000000 ) isym = 8 120 deg rotation - cart. axis [1,-1,1] cryst. s( 8) = ( 0 0 1 ) ( -1 0 0 ) ( 0 -1 0 ) cart. s( 8) = ( 0.0000000 -1.0000000 -0.0000000 ) ( 0.0000000 -0.0000000 -1.0000000 ) ( 1.0000000 -0.0000000 -0.0000000 ) isym = 9 120 deg rotation - cart. axis [1,1,1] cryst. s( 9) = ( 0 1 0 ) ( 0 0 1 ) ( 1 0 0 ) cart. s( 9) = ( 0.0000000 0.0000000 1.0000000 ) ( 1.0000000 0.0000000 -0.0000000 ) ( 0.0000000 1.0000000 -0.0000000 ) isym = 10 120 deg rotation - cart. axis [-1,1,-1] cryst. s(10) = ( 0 -1 0 ) ( 0 0 -1 ) ( 1 0 0 ) cart. s(10) = ( -0.0000000 -0.0000000 1.0000000 ) ( -1.0000000 0.0000000 0.0000000 ) ( 0.0000000 -1.0000000 0.0000000 ) isym = 11 120 deg rotation - cart. axis [1,-1,-1] cryst. s(11) = ( 0 -1 0 ) ( 0 0 1 ) ( -1 0 0 ) cart. s(11) = ( -0.0000000 0.0000000 -1.0000000 ) ( -1.0000000 0.0000000 0.0000000 ) ( 0.0000000 1.0000000 -0.0000000 ) isym = 12 120 deg rotation - cart. axis [-1,-1,1] cryst. s(12) = ( 0 1 0 ) ( 0 0 -1 ) ( -1 0 0 ) cart. s(12) = ( 0.0000000 -0.0000000 -1.0000000 ) ( 1.0000000 -0.0000000 -0.0000000 ) ( 0.0000000 -1.0000000 0.0000000 ) isym = 13 inv. 180 deg rotation - cart. axis [1,1,0] cryst. s(13) = ( 0 -1 0 ) ( -1 0 0 ) ( 0 0 1 ) cart. s(13) = ( -0.0000000 -1.0000000 0.0000000 ) ( -1.0000000 0.0000000 0.0000000 ) ( 0.0000000 0.0000000 1.0000000 ) isym = 14 inv. 180 deg rotation - cart. axis [1,-1,0] cryst. s(14) = ( 0 1 0 ) ( 1 0 0 ) ( 0 0 1 ) cart. s(14) = ( 0.0000000 1.0000000 -0.0000000 ) ( 1.0000000 -0.0000000 0.0000000 ) ( 0.0000000 0.0000000 1.0000000 ) isym = 15 inv. 90 deg rotation - cart. axis [0,0,-1] cryst. s(15) = ( 0 1 0 ) ( -1 0 0 ) ( 0 0 -1 ) cart. s(15) = ( 0.0000000 -1.0000000 -0.0000000 ) ( 1.0000000 -0.0000000 -0.0000000 ) ( 0.0000000 0.0000000 -1.0000000 ) isym = 16 inv. 90 deg rotation - cart. axis [0,0,1] cryst. s(16) = ( 0 -1 0 ) ( 1 0 0 ) ( 0 0 -1 ) cart. s(16) = ( -0.0000000 1.0000000 -0.0000000 ) ( -1.0000000 0.0000000 -0.0000000 ) ( 0.0000000 0.0000000 -1.0000000 ) isym = 17 inv. 180 deg rotation - cart. axis [1,0,1] cryst. s(17) = ( 0 0 -1 ) ( 0 1 0 ) ( -1 0 0 ) cart. s(17) = ( -0.0000000 0.0000000 -1.0000000 ) ( -0.0000000 1.0000000 -0.0000000 ) ( -1.0000000 0.0000000 0.0000000 ) isym = 18 inv. 180 deg rotation - cart. axis [-1,0,1] cryst. s(18) = ( 0 0 1 ) ( 0 1 0 ) ( 1 0 0 ) cart. s(18) = ( 0.0000000 0.0000000 1.0000000 ) ( 0.0000000 1.0000000 -0.0000000 ) ( 1.0000000 -0.0000000 -0.0000000 ) isym = 19 inv. 90 deg rotation - cart. axis [0,1,0] cryst. s(19) = ( 0 0 1 ) ( 0 -1 0 ) ( -1 0 0 ) cart. s(19) = ( 0.0000000 -0.0000000 -1.0000000 ) ( 0.0000000 -1.0000000 0.0000000 ) ( 1.0000000 -0.0000000 -0.0000000 ) isym = 20 inv. 90 deg rotation - cart. axis [0,-1,0] cryst. s(20) = ( 0 0 -1 ) ( 0 -1 0 ) ( 1 0 0 ) cart. s(20) = ( -0.0000000 -0.0000000 1.0000000 ) ( -0.0000000 -1.0000000 0.0000000 ) ( -1.0000000 0.0000000 0.0000000 ) isym = 21 inv. 180 deg rotation - cart. axis [0,1,1] cryst. s(21) = ( 1 0 0 ) ( 0 0 -1 ) ( 0 -1 0 ) cart. s(21) = ( 1.0000000 -0.0000000 -0.0000000 ) ( 0.0000000 -0.0000000 -1.0000000 ) ( 0.0000000 -1.0000000 0.0000000 ) isym = 22 inv. 180 deg rotation - cart. axis [0,1,-1] cryst. s(22) = ( 1 0 0 ) ( 0 0 1 ) ( 0 1 0 ) cart. s(22) = ( 1.0000000 0.0000000 0.0000000 ) ( 0.0000000 0.0000000 1.0000000 ) ( 0.0000000 1.0000000 -0.0000000 ) isym = 23 inv. 90 deg rotation - cart. axis [-1,0,0] cryst. s(23) = ( -1 0 0 ) ( 0 0 1 ) ( 0 -1 0 ) cart. s(23) = ( -1.0000000 0.0000000 -0.0000000 ) ( 0.0000000 0.0000000 -1.0000000 ) ( 0.0000000 1.0000000 -0.0000000 ) isym = 24 inv. 90 deg rotation - cart. axis [1,0,0] cryst. s(24) = ( -1 0 0 ) ( 0 0 -1 ) ( 0 1 0 ) cart. s(24) = ( -1.0000000 0.0000000 0.0000000 ) ( 0.0000000 -0.0000000 1.0000000 ) ( 0.0000000 -1.0000000 0.0000000 ) double point group T_d (-43m) there are 8 classes and 3 irreducible representations the character table: E -E 8C3 -8C3 3C2 6s_d 6S4 -6S4 -3C2 -6s_d G_6 2.00 -2.00 1.00 -1.00 0.00 0.00 1.41 -1.41 G_7 2.00 -2.00 1.00 -1.00 0.00 0.00 -1.41 1.41 G_8 4.00 -4.00 -1.00 1.00 0.00 0.00 0.00 0.00 the symmetry operations in each class: E 1 3C2 -3C2 2 -2 3 -3 4 -4 8C3 5 7 8 6 12 9 10 11 6s_d -6s_d 13 -13 14 -14 17 -17 18 -18 21 -21 22 -22 6S4 15 16 20 19 23 24 -E -1 -8C3 -5 -7 -8 -6 -12 -9 -10 -11 -6S4 -15 -16 -20 -19 -23 -24 Cartesian axes number of k points= 231 Fermi-Dirac smearing, width (Ry)= 0.0010 cart. coord. in units 2pi/alat k( 1) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0043290 k( 2) = ( 0.0000000 0.0166667 -0.0000000), wk = 0.0043290 k( 3) = ( 0.0000000 0.0333333 -0.0000000), wk = 0.0043290 k( 4) = ( 0.0000000 0.0500000 -0.0000000), wk = 0.0043290 k( 5) = ( 0.0000000 0.0666667 -0.0000000), wk = 0.0043290 k( 6) = ( 0.0000000 0.0833333 -0.0000000), wk = 0.0043290 k( 7) = ( 0.0000000 0.1000000 -0.0000000), wk = 0.0043290 k( 8) = ( 0.0000000 0.1166667 -0.0000000), wk = 0.0043290 k( 9) = ( 0.0000000 0.1333333 -0.0000000), wk = 0.0043290 k( 10) = ( 0.0000000 0.1500000 -0.0000000), wk = 0.0043290 k( 11) = ( 0.0000000 0.1666667 -0.0000000), wk = 0.0043290 k( 12) = ( 0.0000000 0.1833333 -0.0000000), wk = 0.0043290 k( 13) = ( 0.0000000 0.2000000 -0.0000000), wk = 0.0043290 k( 14) = ( 0.0000000 0.2166667 -0.0000000), wk = 0.0043290 k( 15) = ( 0.0000000 0.2333333 -0.0000000), wk = 0.0043290 k( 16) = ( 0.0000000 0.2500000 -0.0000000), wk = 0.0043290 k( 17) = ( 0.0000000 0.2666667 -0.0000000), wk = 0.0043290 k( 18) = ( 0.0000000 0.2833333 -0.0000000), wk = 0.0043290 k( 19) = ( 0.0000000 0.3000000 -0.0000000), wk = 0.0043290 k( 20) = ( 0.0000000 0.3166667 -0.0000000), wk = 0.0043290 k( 21) = ( 0.0000000 0.3333333 -0.0000000), wk = 0.0043290 k( 22) = ( 0.0000000 0.3500000 -0.0000000), wk = 0.0043290 k( 23) = ( 0.0000000 0.3666667 -0.0000000), wk = 0.0043290 k( 24) = ( 0.0000000 0.3833333 -0.0000000), wk = 0.0043290 k( 25) = ( 0.0000000 0.4000000 -0.0000000), wk = 0.0043290 k( 26) = ( 0.0000000 0.4166667 -0.0000000), wk = 0.0043290 k( 27) = ( 0.0000000 0.4333333 -0.0000000), wk = 0.0043290 k( 28) = ( 0.0000000 0.4500000 -0.0000000), wk = 0.0043290 k( 29) = ( 0.0000000 0.4666667 -0.0000000), wk = 0.0043290 k( 30) = ( 0.0000000 0.4833333 -0.0000000), wk = 0.0043290 k( 31) = ( 0.0000000 0.5000000 -0.0000000), wk = 0.0043290 k( 32) = ( 0.0000000 0.5000000 -0.0000000), wk = 0.0043290 k( 33) = ( 0.0166667 0.5000000 -0.0000000), wk = 0.0043290 k( 34) = ( 0.0333333 0.5000000 -0.0000000), wk = 0.0043290 k( 35) = ( 0.0500000 0.5000000 -0.0000000), wk = 0.0043290 k( 36) = ( 0.0666667 0.5000000 -0.0000000), wk = 0.0043290 k( 37) = ( 0.0833333 0.5000000 -0.0000000), wk = 0.0043290 k( 38) = ( 0.1000000 0.5000000 -0.0000000), wk = 0.0043290 k( 39) = ( 0.1166667 0.5000000 -0.0000000), wk = 0.0043290 k( 40) = ( 0.1333333 0.5000000 -0.0000000), wk = 0.0043290 k( 41) = ( 0.1500000 0.5000000 -0.0000000), wk = 0.0043290 k( 42) = ( 0.1666667 0.5000000 -0.0000000), wk = 0.0043290 k( 43) = ( 0.1833333 0.5000000 -0.0000000), wk = 0.0043290 k( 44) = ( 0.2000000 0.5000000 -0.0000000), wk = 0.0043290 k( 45) = ( 0.2166667 0.5000000 -0.0000000), wk = 0.0043290 k( 46) = ( 0.2333333 0.5000000 -0.0000000), wk = 0.0043290 k( 47) = ( 0.2500000 0.5000000 -0.0000000), wk = 0.0043290 k( 48) = ( 0.2666667 0.5000000 -0.0000000), wk = 0.0043290 k( 49) = ( 0.2833333 0.5000000 -0.0000000), wk = 0.0043290 k( 50) = ( 0.3000000 0.5000000 -0.0000000), wk = 0.0043290 k( 51) = ( 0.3166667 0.5000000 -0.0000000), wk = 0.0043290 k( 52) = ( 0.3333333 0.5000000 -0.0000000), wk = 0.0043290 k( 53) = ( 0.3500000 0.5000000 -0.0000000), wk = 0.0043290 k( 54) = ( 0.3666667 0.5000000 -0.0000000), wk = 0.0043290 k( 55) = ( 0.3833333 0.5000000 -0.0000000), wk = 0.0043290 k( 56) = ( 0.4000000 0.5000000 -0.0000000), wk = 0.0043290 k( 57) = ( 0.4166667 0.5000000 -0.0000000), wk = 0.0043290 k( 58) = ( 0.4333333 0.5000000 -0.0000000), wk = 0.0043290 k( 59) = ( 0.4500000 0.5000000 -0.0000000), wk = 0.0043290 k( 60) = ( 0.4666667 0.5000000 -0.0000000), wk = 0.0043290 k( 61) = ( 0.4833333 0.5000000 -0.0000000), wk = 0.0043290 k( 62) = ( 0.5000000 0.5000000 -0.0000000), wk = 0.0043290 k( 63) = ( 0.5000000 0.5000000 -0.0000000), wk = 0.0043290 k( 64) = ( 0.4880952 0.4880952 -0.0000000), wk = 0.0043290 k( 65) = ( 0.4761905 0.4761905 -0.0000000), wk = 0.0043290 k( 66) = ( 0.4642857 0.4642857 -0.0000000), wk = 0.0043290 k( 67) = ( 0.4523810 0.4523809 -0.0000000), wk = 0.0043290 k( 68) = ( 0.4404762 0.4404762 -0.0000000), wk = 0.0043290 k( 69) = ( 0.4285714 0.4285714 -0.0000000), wk = 0.0043290 k( 70) = ( 0.4166667 0.4166667 -0.0000000), wk = 0.0043290 k( 71) = ( 0.4047619 0.4047619 -0.0000000), wk = 0.0043290 k( 72) = ( 0.3928571 0.3928571 -0.0000000), wk = 0.0043290 k( 73) = ( 0.3809524 0.3809524 -0.0000000), wk = 0.0043290 k( 74) = ( 0.3690476 0.3690476 -0.0000000), wk = 0.0043290 k( 75) = ( 0.3571429 0.3571429 -0.0000000), wk = 0.0043290 k( 76) = ( 0.3452381 0.3452381 -0.0000000), wk = 0.0043290 k( 77) = ( 0.3333333 0.3333333 -0.0000000), wk = 0.0043290 k( 78) = ( 0.3214286 0.3214286 -0.0000000), wk = 0.0043290 k( 79) = ( 0.3095238 0.3095238 -0.0000000), wk = 0.0043290 k( 80) = ( 0.2976190 0.2976190 -0.0000000), wk = 0.0043290 k( 81) = ( 0.2857143 0.2857143 -0.0000000), wk = 0.0043290 k( 82) = ( 0.2738095 0.2738095 -0.0000000), wk = 0.0043290 k( 83) = ( 0.2619048 0.2619048 -0.0000000), wk = 0.0043290 k( 84) = ( 0.2500000 0.2500000 -0.0000000), wk = 0.0043290 k( 85) = ( 0.2380952 0.2380952 -0.0000000), wk = 0.0043290 k( 86) = ( 0.2261905 0.2261905 -0.0000000), wk = 0.0043290 k( 87) = ( 0.2142857 0.2142857 -0.0000000), wk = 0.0043290 k( 88) = ( 0.2023810 0.2023809 -0.0000000), wk = 0.0043290 k( 89) = ( 0.1904762 0.1904762 -0.0000000), wk = 0.0043290 k( 90) = ( 0.1785714 0.1785714 -0.0000000), wk = 0.0043290 k( 91) = ( 0.1666667 0.1666667 -0.0000000), wk = 0.0043290 k( 92) = ( 0.1547619 0.1547619 -0.0000000), wk = 0.0043290 k( 93) = ( 0.1428571 0.1428571 -0.0000000), wk = 0.0043290 k( 94) = ( 0.1309524 0.1309524 -0.0000000), wk = 0.0043290 k( 95) = ( 0.1190476 0.1190476 -0.0000000), wk = 0.0043290 k( 96) = ( 0.1071429 0.1071429 -0.0000000), wk = 0.0043290 k( 97) = ( 0.0952381 0.0952381 -0.0000000), wk = 0.0043290 k( 98) = ( 0.0833333 0.0833333 -0.0000000), wk = 0.0043290 k( 99) = ( 0.0714286 0.0714286 -0.0000000), wk = 0.0043290 k( 100) = ( 0.0595238 0.0595238 -0.0000000), wk = 0.0043290 k( 101) = ( 0.0476191 0.0476190 -0.0000000), wk = 0.0043290 k( 102) = ( 0.0357143 0.0357143 -0.0000000), wk = 0.0043290 k( 103) = ( 0.0238095 0.0238095 -0.0000000), wk = 0.0043290 k( 104) = ( 0.0119048 0.0119048 -0.0000000), wk = 0.0043290 k( 105) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0043290 k( 106) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0043290 k( 107) = ( 0.0098039 0.0098039 0.0098039), wk = 0.0043290 k( 108) = ( 0.0196078 0.0196078 0.0196078), wk = 0.0043290 k( 109) = ( 0.0294118 0.0294118 0.0294118), wk = 0.0043290 k( 110) = ( 0.0392157 0.0392157 0.0392157), wk = 0.0043290 k( 111) = ( 0.0490196 0.0490196 0.0490196), wk = 0.0043290 k( 112) = ( 0.0588235 0.0588235 0.0588235), wk = 0.0043290 k( 113) = ( 0.0686275 0.0686275 0.0686274), wk = 0.0043290 k( 114) = ( 0.0784314 0.0784314 0.0784314), wk = 0.0043290 k( 115) = ( 0.0882353 0.0882353 0.0882353), wk = 0.0043290 k( 116) = ( 0.0980392 0.0980392 0.0980392), wk = 0.0043290 k( 117) = ( 0.1078431 0.1078431 0.1078431), wk = 0.0043290 k( 118) = ( 0.1176471 0.1176471 0.1176471), wk = 0.0043290 k( 119) = ( 0.1274510 0.1274510 0.1274510), wk = 0.0043290 k( 120) = ( 0.1372549 0.1372549 0.1372549), wk = 0.0043290 k( 121) = ( 0.1470588 0.1470588 0.1470588), wk = 0.0043290 k( 122) = ( 0.1568627 0.1568627 0.1568627), wk = 0.0043290 k( 123) = ( 0.1666667 0.1666667 0.1666667), wk = 0.0043290 k( 124) = ( 0.1764706 0.1764706 0.1764706), wk = 0.0043290 k( 125) = ( 0.1862745 0.1862745 0.1862745), wk = 0.0043290 k( 126) = ( 0.1960784 0.1960784 0.1960784), wk = 0.0043290 k( 127) = ( 0.2058823 0.2058823 0.2058823), wk = 0.0043290 k( 128) = ( 0.2156863 0.2156863 0.2156863), wk = 0.0043290 k( 129) = ( 0.2254902 0.2254902 0.2254902), wk = 0.0043290 k( 130) = ( 0.2352941 0.2352941 0.2352941), wk = 0.0043290 k( 131) = ( 0.2450980 0.2450980 0.2450980), wk = 0.0043290 k( 132) = ( 0.2549020 0.2549020 0.2549020), wk = 0.0043290 k( 133) = ( 0.2647059 0.2647059 0.2647059), wk = 0.0043290 k( 134) = ( 0.2745098 0.2745098 0.2745098), wk = 0.0043290 k( 135) = ( 0.2843137 0.2843137 0.2843137), wk = 0.0043290 k( 136) = ( 0.2941177 0.2941176 0.2941176), wk = 0.0043290 k( 137) = ( 0.3039216 0.3039216 0.3039216), wk = 0.0043290 k( 138) = ( 0.3137255 0.3137255 0.3137255), wk = 0.0043290 k( 139) = ( 0.3235294 0.3235294 0.3235294), wk = 0.0043290 k( 140) = ( 0.3333333 0.3333333 0.3333333), wk = 0.0043290 k( 141) = ( 0.3431373 0.3431372 0.3431372), wk = 0.0043290 k( 142) = ( 0.3529412 0.3529412 0.3529412), wk = 0.0043290 k( 143) = ( 0.3627451 0.3627451 0.3627451), wk = 0.0043290 k( 144) = ( 0.3725490 0.3725490 0.3725490), wk = 0.0043290 k( 145) = ( 0.3823529 0.3823529 0.3823529), wk = 0.0043290 k( 146) = ( 0.3921569 0.3921569 0.3921569), wk = 0.0043290 k( 147) = ( 0.4019608 0.4019608 0.4019608), wk = 0.0043290 k( 148) = ( 0.4117647 0.4117647 0.4117647), wk = 0.0043290 k( 149) = ( 0.4215686 0.4215686 0.4215686), wk = 0.0043290 k( 150) = ( 0.4313726 0.4313725 0.4313725), wk = 0.0043290 k( 151) = ( 0.4411765 0.4411765 0.4411765), wk = 0.0043290 k( 152) = ( 0.4509804 0.4509804 0.4509804), wk = 0.0043290 k( 153) = ( 0.4607843 0.4607843 0.4607843), wk = 0.0043290 k( 154) = ( 0.4705882 0.4705882 0.4705882), wk = 0.0043290 k( 155) = ( 0.4803922 0.4803922 0.4803922), wk = 0.0043290 k( 156) = ( 0.4901961 0.4901961 0.4901961), wk = 0.0043290 k( 157) = ( 0.5000000 0.5000000 0.5000000), wk = 0.0043290 k( 158) = ( 0.5000000 0.5000000 0.5000000), wk = 0.0043290 k( 159) = ( 0.4880952 0.5000000 0.4880952), wk = 0.0043290 k( 160) = ( 0.4761905 0.5000000 0.4761905), wk = 0.0043290 k( 161) = ( 0.4642857 0.5000000 0.4642857), wk = 0.0043290 k( 162) = ( 0.4523810 0.5000000 0.4523809), wk = 0.0043290 k( 163) = ( 0.4404762 0.5000000 0.4404762), wk = 0.0043290 k( 164) = ( 0.4285714 0.5000000 0.4285714), wk = 0.0043290 k( 165) = ( 0.4166667 0.5000000 0.4166667), wk = 0.0043290 k( 166) = ( 0.4047619 0.5000000 0.4047619), wk = 0.0043290 k( 167) = ( 0.3928571 0.5000000 0.3928571), wk = 0.0043290 k( 168) = ( 0.3809524 0.5000000 0.3809524), wk = 0.0043290 k( 169) = ( 0.3690476 0.5000000 0.3690476), wk = 0.0043290 k( 170) = ( 0.3571429 0.5000000 0.3571429), wk = 0.0043290 k( 171) = ( 0.3452381 0.5000000 0.3452381), wk = 0.0043290 k( 172) = ( 0.3333333 0.5000000 0.3333333), wk = 0.0043290 k( 173) = ( 0.3214286 0.5000000 0.3214286), wk = 0.0043290 k( 174) = ( 0.3095238 0.5000000 0.3095238), wk = 0.0043290 k( 175) = ( 0.2976190 0.5000000 0.2976190), wk = 0.0043290 k( 176) = ( 0.2857143 0.5000000 0.2857143), wk = 0.0043290 k( 177) = ( 0.2738095 0.5000000 0.2738095), wk = 0.0043290 k( 178) = ( 0.2619048 0.5000000 0.2619048), wk = 0.0043290 k( 179) = ( 0.2500000 0.5000000 0.2500000), wk = 0.0043290 k( 180) = ( 0.2380952 0.5000000 0.2380952), wk = 0.0043290 k( 181) = ( 0.2261905 0.5000000 0.2261905), wk = 0.0043290 k( 182) = ( 0.2142857 0.5000000 0.2142857), wk = 0.0043290 k( 183) = ( 0.2023810 0.5000000 0.2023809), wk = 0.0043290 k( 184) = ( 0.1904762 0.5000000 0.1904762), wk = 0.0043290 k( 185) = ( 0.1785714 0.5000000 0.1785714), wk = 0.0043290 k( 186) = ( 0.1666667 0.5000000 0.1666667), wk = 0.0043290 k( 187) = ( 0.1547619 0.5000000 0.1547619), wk = 0.0043290 k( 188) = ( 0.1428571 0.5000000 0.1428571), wk = 0.0043290 k( 189) = ( 0.1309524 0.5000000 0.1309524), wk = 0.0043290 k( 190) = ( 0.1190476 0.5000000 0.1190476), wk = 0.0043290 k( 191) = ( 0.1071429 0.5000000 0.1071429), wk = 0.0043290 k( 192) = ( 0.0952381 0.5000000 0.0952381), wk = 0.0043290 k( 193) = ( 0.0833333 0.5000000 0.0833333), wk = 0.0043290 k( 194) = ( 0.0714286 0.5000000 0.0714286), wk = 0.0043290 k( 195) = ( 0.0595238 0.5000000 0.0595238), wk = 0.0043290 k( 196) = ( 0.0476191 0.5000000 0.0476190), wk = 0.0043290 k( 197) = ( 0.0357143 0.5000000 0.0357143), wk = 0.0043290 k( 198) = ( 0.0238095 0.5000000 0.0238095), wk = 0.0043290 k( 199) = ( 0.0119048 0.5000000 0.0119048), wk = 0.0043290 k( 200) = ( 0.0000000 0.5000000 -0.0000000), wk = 0.0043290 k( 201) = ( 0.5000000 0.5000000 -0.0000000), wk = 0.0043290 k( 202) = ( 0.5000000 0.5000000 0.0166667), wk = 0.0043290 k( 203) = ( 0.5000000 0.5000000 0.0333333), wk = 0.0043290 k( 204) = ( 0.5000000 0.5000000 0.0500000), wk = 0.0043290 k( 205) = ( 0.5000000 0.5000000 0.0666667), wk = 0.0043290 k( 206) = ( 0.5000000 0.5000000 0.0833333), wk = 0.0043290 k( 207) = ( 0.5000000 0.5000000 0.1000000), wk = 0.0043290 k( 208) = ( 0.5000000 0.5000000 0.1166667), wk = 0.0043290 k( 209) = ( 0.5000000 0.5000000 0.1333333), wk = 0.0043290 k( 210) = ( 0.5000000 0.5000000 0.1500000), wk = 0.0043290 k( 211) = ( 0.5000000 0.5000000 0.1666667), wk = 0.0043290 k( 212) = ( 0.5000000 0.5000000 0.1833333), wk = 0.0043290 k( 213) = ( 0.5000000 0.5000000 0.2000000), wk = 0.0043290 k( 214) = ( 0.5000000 0.5000000 0.2166667), wk = 0.0043290 k( 215) = ( 0.5000000 0.5000000 0.2333333), wk = 0.0043290 k( 216) = ( 0.5000000 0.5000000 0.2500000), wk = 0.0043290 k( 217) = ( 0.5000000 0.5000000 0.2666667), wk = 0.0043290 k( 218) = ( 0.5000000 0.5000000 0.2833333), wk = 0.0043290 k( 219) = ( 0.5000000 0.5000000 0.3000000), wk = 0.0043290 k( 220) = ( 0.5000000 0.5000000 0.3166667), wk = 0.0043290 k( 221) = ( 0.5000000 0.5000000 0.3333333), wk = 0.0043290 k( 222) = ( 0.5000000 0.5000000 0.3500000), wk = 0.0043290 k( 223) = ( 0.5000000 0.5000000 0.3666667), wk = 0.0043290 k( 224) = ( 0.5000000 0.5000000 0.3833333), wk = 0.0043290 k( 225) = ( 0.5000000 0.5000000 0.4000000), wk = 0.0043290 k( 226) = ( 0.5000000 0.5000000 0.4166667), wk = 0.0043290 k( 227) = ( 0.5000000 0.5000000 0.4333333), wk = 0.0043290 k( 228) = ( 0.5000000 0.5000000 0.4500000), wk = 0.0043290 k( 229) = ( 0.5000000 0.5000000 0.4666667), wk = 0.0043290 k( 230) = ( 0.5000000 0.5000000 0.4833333), wk = 0.0043290 k( 231) = ( 0.5000000 0.5000000 0.5000000), wk = 0.0043290 cryst. coord. k( 1) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0043290 k( 2) = ( 0.0000000 0.0166667 0.0000000), wk = 0.0043290 k( 3) = ( 0.0000000 0.0333333 0.0000000), wk = 0.0043290 k( 4) = ( 0.0000000 0.0500000 0.0000000), wk = 0.0043290 k( 5) = ( 0.0000000 0.0666667 0.0000000), wk = 0.0043290 k( 6) = ( 0.0000000 0.0833333 0.0000000), wk = 0.0043290 k( 7) = ( 0.0000000 0.1000000 0.0000000), wk = 0.0043290 k( 8) = ( 0.0000000 0.1166667 0.0000000), wk = 0.0043290 k( 9) = ( 0.0000000 0.1333333 0.0000000), wk = 0.0043290 k( 10) = ( 0.0000000 0.1500000 0.0000000), wk = 0.0043290 k( 11) = ( 0.0000000 0.1666667 0.0000000), wk = 0.0043290 k( 12) = ( 0.0000000 0.1833333 0.0000000), wk = 0.0043290 k( 13) = ( 0.0000000 0.2000000 0.0000000), wk = 0.0043290 k( 14) = ( 0.0000000 0.2166667 0.0000000), wk = 0.0043290 k( 15) = ( 0.0000000 0.2333333 0.0000000), wk = 0.0043290 k( 16) = ( 0.0000000 0.2500000 0.0000000), wk = 0.0043290 k( 17) = ( 0.0000000 0.2666667 0.0000000), wk = 0.0043290 k( 18) = ( 0.0000000 0.2833333 0.0000000), wk = 0.0043290 k( 19) = ( 0.0000000 0.3000000 0.0000000), wk = 0.0043290 k( 20) = ( 0.0000000 0.3166667 0.0000000), wk = 0.0043290 k( 21) = ( 0.0000000 0.3333333 0.0000000), wk = 0.0043290 k( 22) = ( 0.0000000 0.3500000 0.0000000), wk = 0.0043290 k( 23) = ( 0.0000000 0.3666667 0.0000000), wk = 0.0043290 k( 24) = ( 0.0000000 0.3833333 0.0000000), wk = 0.0043290 k( 25) = ( 0.0000000 0.4000000 0.0000000), wk = 0.0043290 k( 26) = ( 0.0000000 0.4166667 0.0000000), wk = 0.0043290 k( 27) = ( 0.0000000 0.4333333 0.0000000), wk = 0.0043290 k( 28) = ( 0.0000000 0.4500000 0.0000000), wk = 0.0043290 k( 29) = ( 0.0000000 0.4666667 0.0000000), wk = 0.0043290 k( 30) = ( 0.0000000 0.4833333 0.0000000), wk = 0.0043290 k( 31) = ( 0.0000000 0.5000000 0.0000000), wk = 0.0043290 k( 32) = ( 0.0000000 0.5000000 0.0000000), wk = 0.0043290 k( 33) = ( 0.0166667 0.5000000 0.0000000), wk = 0.0043290 k( 34) = ( 0.0333333 0.5000000 0.0000000), wk = 0.0043290 k( 35) = ( 0.0500000 0.5000000 0.0000000), wk = 0.0043290 k( 36) = ( 0.0666667 0.5000000 0.0000000), wk = 0.0043290 k( 37) = ( 0.0833333 0.5000000 0.0000000), wk = 0.0043290 k( 38) = ( 0.1000000 0.5000000 0.0000000), wk = 0.0043290 k( 39) = ( 0.1166667 0.5000000 0.0000000), wk = 0.0043290 k( 40) = ( 0.1333333 0.5000000 0.0000000), wk = 0.0043290 k( 41) = ( 0.1500000 0.5000000 0.0000000), wk = 0.0043290 k( 42) = ( 0.1666667 0.5000000 0.0000000), wk = 0.0043290 k( 43) = ( 0.1833333 0.5000000 0.0000000), wk = 0.0043290 k( 44) = ( 0.2000000 0.5000000 0.0000000), wk = 0.0043290 k( 45) = ( 0.2166667 0.5000000 0.0000000), wk = 0.0043290 k( 46) = ( 0.2333333 0.5000000 0.0000000), wk = 0.0043290 k( 47) = ( 0.2500000 0.5000000 0.0000000), wk = 0.0043290 k( 48) = ( 0.2666667 0.5000000 0.0000000), wk = 0.0043290 k( 49) = ( 0.2833333 0.5000000 -0.0000000), wk = 0.0043290 k( 50) = ( 0.3000000 0.5000000 0.0000000), wk = 0.0043290 k( 51) = ( 0.3166667 0.5000000 0.0000000), wk = 0.0043290 k( 52) = ( 0.3333333 0.5000000 0.0000000), wk = 0.0043290 k( 53) = ( 0.3500000 0.5000000 -0.0000000), wk = 0.0043290 k( 54) = ( 0.3666667 0.5000000 0.0000000), wk = 0.0043290 k( 55) = ( 0.3833333 0.5000000 0.0000000), wk = 0.0043290 k( 56) = ( 0.4000000 0.5000000 0.0000000), wk = 0.0043290 k( 57) = ( 0.4166667 0.5000000 0.0000000), wk = 0.0043290 k( 58) = ( 0.4333333 0.5000000 0.0000000), wk = 0.0043290 k( 59) = ( 0.4500000 0.5000000 0.0000000), wk = 0.0043290 k( 60) = ( 0.4666667 0.5000000 0.0000000), wk = 0.0043290 k( 61) = ( 0.4833333 0.5000000 0.0000000), wk = 0.0043290 k( 62) = ( 0.5000000 0.5000000 0.0000000), wk = 0.0043290 k( 63) = ( 0.5000000 0.5000000 0.0000000), wk = 0.0043290 k( 64) = ( 0.4880952 0.4880952 0.0000000), wk = 0.0043290 k( 65) = ( 0.4761905 0.4761905 0.0000000), wk = 0.0043290 k( 66) = ( 0.4642857 0.4642857 0.0000000), wk = 0.0043290 k( 67) = ( 0.4523810 0.4523810 0.0000000), wk = 0.0043290 k( 68) = ( 0.4404762 0.4404762 0.0000000), wk = 0.0043290 k( 69) = ( 0.4285714 0.4285714 0.0000000), wk = 0.0043290 k( 70) = ( 0.4166667 0.4166667 0.0000000), wk = 0.0043290 k( 71) = ( 0.4047619 0.4047619 0.0000000), wk = 0.0043290 k( 72) = ( 0.3928571 0.3928571 0.0000000), wk = 0.0043290 k( 73) = ( 0.3809524 0.3809524 0.0000000), wk = 0.0043290 k( 74) = ( 0.3690476 0.3690476 0.0000000), wk = 0.0043290 k( 75) = ( 0.3571429 0.3571429 0.0000000), wk = 0.0043290 k( 76) = ( 0.3452381 0.3452381 0.0000000), wk = 0.0043290 k( 77) = ( 0.3333333 0.3333333 0.0000000), wk = 0.0043290 k( 78) = ( 0.3214286 0.3214286 0.0000000), wk = 0.0043290 k( 79) = ( 0.3095238 0.3095238 0.0000000), wk = 0.0043290 k( 80) = ( 0.2976190 0.2976190 -0.0000000), wk = 0.0043290 k( 81) = ( 0.2857143 0.2857143 0.0000000), wk = 0.0043290 k( 82) = ( 0.2738095 0.2738095 0.0000000), wk = 0.0043290 k( 83) = ( 0.2619048 0.2619048 0.0000000), wk = 0.0043290 k( 84) = ( 0.2500000 0.2500000 0.0000000), wk = 0.0043290 k( 85) = ( 0.2380952 0.2380952 0.0000000), wk = 0.0043290 k( 86) = ( 0.2261905 0.2261905 0.0000000), wk = 0.0043290 k( 87) = ( 0.2142857 0.2142857 0.0000000), wk = 0.0043290 k( 88) = ( 0.2023810 0.2023810 0.0000000), wk = 0.0043290 k( 89) = ( 0.1904762 0.1904762 0.0000000), wk = 0.0043290 k( 90) = ( 0.1785714 0.1785714 0.0000000), wk = 0.0043290 k( 91) = ( 0.1666667 0.1666667 0.0000000), wk = 0.0043290 k( 92) = ( 0.1547619 0.1547619 -0.0000000), wk = 0.0043290 k( 93) = ( 0.1428571 0.1428571 0.0000000), wk = 0.0043290 k( 94) = ( 0.1309524 0.1309524 0.0000000), wk = 0.0043290 k( 95) = ( 0.1190476 0.1190476 0.0000000), wk = 0.0043290 k( 96) = ( 0.1071429 0.1071429 0.0000000), wk = 0.0043290 k( 97) = ( 0.0952381 0.0952381 0.0000000), wk = 0.0043290 k( 98) = ( 0.0833333 0.0833333 0.0000000), wk = 0.0043290 k( 99) = ( 0.0714286 0.0714286 0.0000000), wk = 0.0043290 k( 100) = ( 0.0595238 0.0595238 0.0000000), wk = 0.0043290 k( 101) = ( 0.0476191 0.0476191 0.0000000), wk = 0.0043290 k( 102) = ( 0.0357143 0.0357143 0.0000000), wk = 0.0043290 k( 103) = ( 0.0238095 0.0238095 0.0000000), wk = 0.0043290 k( 104) = ( 0.0119048 0.0119048 0.0000000), wk = 0.0043290 k( 105) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0043290 k( 106) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0043290 k( 107) = ( 0.0098039 0.0098039 0.0098039), wk = 0.0043290 k( 108) = ( 0.0196078 0.0196078 0.0196078), wk = 0.0043290 k( 109) = ( 0.0294118 0.0294118 0.0294118), wk = 0.0043290 k( 110) = ( 0.0392157 0.0392157 0.0392157), wk = 0.0043290 k( 111) = ( 0.0490196 0.0490196 0.0490196), wk = 0.0043290 k( 112) = ( 0.0588235 0.0588235 0.0588235), wk = 0.0043290 k( 113) = ( 0.0686275 0.0686275 0.0686275), wk = 0.0043290 k( 114) = ( 0.0784314 0.0784314 0.0784314), wk = 0.0043290 k( 115) = ( 0.0882353 0.0882353 0.0882353), wk = 0.0043290 k( 116) = ( 0.0980392 0.0980392 0.0980392), wk = 0.0043290 k( 117) = ( 0.1078431 0.1078431 0.1078431), wk = 0.0043290 k( 118) = ( 0.1176471 0.1176471 0.1176471), wk = 0.0043290 k( 119) = ( 0.1274510 0.1274510 0.1274510), wk = 0.0043290 k( 120) = ( 0.1372549 0.1372549 0.1372549), wk = 0.0043290 k( 121) = ( 0.1470588 0.1470588 0.1470588), wk = 0.0043290 k( 122) = ( 0.1568627 0.1568627 0.1568627), wk = 0.0043290 k( 123) = ( 0.1666667 0.1666667 0.1666667), wk = 0.0043290 k( 124) = ( 0.1764706 0.1764706 0.1764706), wk = 0.0043290 k( 125) = ( 0.1862745 0.1862745 0.1862745), wk = 0.0043290 k( 126) = ( 0.1960784 0.1960784 0.1960784), wk = 0.0043290 k( 127) = ( 0.2058823 0.2058823 0.2058823), wk = 0.0043290 k( 128) = ( 0.2156863 0.2156863 0.2156863), wk = 0.0043290 k( 129) = ( 0.2254902 0.2254902 0.2254902), wk = 0.0043290 k( 130) = ( 0.2352941 0.2352941 0.2352941), wk = 0.0043290 k( 131) = ( 0.2450980 0.2450980 0.2450980), wk = 0.0043290 k( 132) = ( 0.2549020 0.2549020 0.2549020), wk = 0.0043290 k( 133) = ( 0.2647059 0.2647059 0.2647059), wk = 0.0043290 k( 134) = ( 0.2745098 0.2745098 0.2745098), wk = 0.0043290 k( 135) = ( 0.2843137 0.2843137 0.2843137), wk = 0.0043290 k( 136) = ( 0.2941177 0.2941177 0.2941177), wk = 0.0043290 k( 137) = ( 0.3039216 0.3039216 0.3039216), wk = 0.0043290 k( 138) = ( 0.3137255 0.3137255 0.3137255), wk = 0.0043290 k( 139) = ( 0.3235294 0.3235294 0.3235294), wk = 0.0043290 k( 140) = ( 0.3333333 0.3333333 0.3333333), wk = 0.0043290 k( 141) = ( 0.3431373 0.3431373 0.3431373), wk = 0.0043290 k( 142) = ( 0.3529412 0.3529412 0.3529412), wk = 0.0043290 k( 143) = ( 0.3627451 0.3627451 0.3627451), wk = 0.0043290 k( 144) = ( 0.3725490 0.3725490 0.3725490), wk = 0.0043290 k( 145) = ( 0.3823529 0.3823529 0.3823529), wk = 0.0043290 k( 146) = ( 0.3921569 0.3921569 0.3921569), wk = 0.0043290 k( 147) = ( 0.4019608 0.4019608 0.4019608), wk = 0.0043290 k( 148) = ( 0.4117647 0.4117647 0.4117647), wk = 0.0043290 k( 149) = ( 0.4215686 0.4215686 0.4215686), wk = 0.0043290 k( 150) = ( 0.4313726 0.4313726 0.4313726), wk = 0.0043290 k( 151) = ( 0.4411765 0.4411765 0.4411765), wk = 0.0043290 k( 152) = ( 0.4509804 0.4509804 0.4509804), wk = 0.0043290 k( 153) = ( 0.4607843 0.4607843 0.4607843), wk = 0.0043290 k( 154) = ( 0.4705882 0.4705882 0.4705882), wk = 0.0043290 k( 155) = ( 0.4803922 0.4803922 0.4803922), wk = 0.0043290 k( 156) = ( 0.4901961 0.4901961 0.4901961), wk = 0.0043290 k( 157) = ( 0.5000000 0.5000000 0.5000000), wk = 0.0043290 k( 158) = ( 0.5000000 0.5000000 0.5000000), wk = 0.0043290 k( 159) = ( 0.4880952 0.5000000 0.4880952), wk = 0.0043290 k( 160) = ( 0.4761905 0.5000000 0.4761905), wk = 0.0043290 k( 161) = ( 0.4642857 0.5000000 0.4642857), wk = 0.0043290 k( 162) = ( 0.4523810 0.5000000 0.4523810), wk = 0.0043290 k( 163) = ( 0.4404762 0.5000000 0.4404762), wk = 0.0043290 k( 164) = ( 0.4285714 0.5000000 0.4285714), wk = 0.0043290 k( 165) = ( 0.4166667 0.5000000 0.4166667), wk = 0.0043290 k( 166) = ( 0.4047619 0.5000000 0.4047619), wk = 0.0043290 k( 167) = ( 0.3928571 0.5000000 0.3928571), wk = 0.0043290 k( 168) = ( 0.3809524 0.5000000 0.3809524), wk = 0.0043290 k( 169) = ( 0.3690476 0.5000000 0.3690476), wk = 0.0043290 k( 170) = ( 0.3571429 0.5000000 0.3571429), wk = 0.0043290 k( 171) = ( 0.3452381 0.5000000 0.3452381), wk = 0.0043290 k( 172) = ( 0.3333333 0.5000000 0.3333333), wk = 0.0043290 k( 173) = ( 0.3214286 0.5000000 0.3214286), wk = 0.0043290 k( 174) = ( 0.3095238 0.5000000 0.3095238), wk = 0.0043290 k( 175) = ( 0.2976190 0.5000000 0.2976190), wk = 0.0043290 k( 176) = ( 0.2857143 0.5000000 0.2857143), wk = 0.0043290 k( 177) = ( 0.2738095 0.5000000 0.2738095), wk = 0.0043290 k( 178) = ( 0.2619048 0.5000000 0.2619048), wk = 0.0043290 k( 179) = ( 0.2500000 0.5000000 0.2500000), wk = 0.0043290 k( 180) = ( 0.2380952 0.5000000 0.2380952), wk = 0.0043290 k( 181) = ( 0.2261905 0.5000000 0.2261905), wk = 0.0043290 k( 182) = ( 0.2142857 0.5000000 0.2142857), wk = 0.0043290 k( 183) = ( 0.2023810 0.5000000 0.2023810), wk = 0.0043290 k( 184) = ( 0.1904762 0.5000000 0.1904762), wk = 0.0043290 k( 185) = ( 0.1785714 0.5000000 0.1785714), wk = 0.0043290 k( 186) = ( 0.1666667 0.5000000 0.1666667), wk = 0.0043290 k( 187) = ( 0.1547619 0.5000000 0.1547619), wk = 0.0043290 k( 188) = ( 0.1428571 0.5000000 0.1428571), wk = 0.0043290 k( 189) = ( 0.1309524 0.5000000 0.1309524), wk = 0.0043290 k( 190) = ( 0.1190476 0.5000000 0.1190476), wk = 0.0043290 k( 191) = ( 0.1071429 0.5000000 0.1071429), wk = 0.0043290 k( 192) = ( 0.0952381 0.5000000 0.0952381), wk = 0.0043290 k( 193) = ( 0.0833333 0.5000000 0.0833333), wk = 0.0043290 k( 194) = ( 0.0714286 0.5000000 0.0714286), wk = 0.0043290 k( 195) = ( 0.0595238 0.5000000 0.0595238), wk = 0.0043290 k( 196) = ( 0.0476191 0.5000000 0.0476191), wk = 0.0043290 k( 197) = ( 0.0357143 0.5000000 0.0357143), wk = 0.0043290 k( 198) = ( 0.0238095 0.5000000 0.0238095), wk = 0.0043290 k( 199) = ( 0.0119048 0.5000000 0.0119048), wk = 0.0043290 k( 200) = ( 0.0000000 0.5000000 0.0000000), wk = 0.0043290 k( 201) = ( 0.5000000 0.5000000 0.0000000), wk = 0.0043290 k( 202) = ( 0.5000000 0.5000000 0.0166667), wk = 0.0043290 k( 203) = ( 0.5000000 0.5000000 0.0333333), wk = 0.0043290 k( 204) = ( 0.5000000 0.5000000 0.0500000), wk = 0.0043290 k( 205) = ( 0.5000000 0.5000000 0.0666667), wk = 0.0043290 k( 206) = ( 0.5000000 0.5000000 0.0833333), wk = 0.0043290 k( 207) = ( 0.5000000 0.5000000 0.1000000), wk = 0.0043290 k( 208) = ( 0.5000000 0.5000000 0.1166667), wk = 0.0043290 k( 209) = ( 0.5000000 0.5000000 0.1333333), wk = 0.0043290 k( 210) = ( 0.5000000 0.5000000 0.1500000), wk = 0.0043290 k( 211) = ( 0.5000000 0.5000000 0.1666667), wk = 0.0043290 k( 212) = ( 0.5000000 0.5000000 0.1833333), wk = 0.0043290 k( 213) = ( 0.5000000 0.5000000 0.2000000), wk = 0.0043290 k( 214) = ( 0.5000000 0.5000000 0.2166667), wk = 0.0043290 k( 215) = ( 0.5000000 0.5000000 0.2333333), wk = 0.0043290 k( 216) = ( 0.5000000 0.5000000 0.2500000), wk = 0.0043290 k( 217) = ( 0.5000000 0.5000000 0.2666667), wk = 0.0043290 k( 218) = ( 0.5000000 0.5000000 0.2833333), wk = 0.0043290 k( 219) = ( 0.5000000 0.5000000 0.3000000), wk = 0.0043290 k( 220) = ( 0.5000000 0.5000000 0.3166667), wk = 0.0043290 k( 221) = ( 0.5000000 0.5000000 0.3333333), wk = 0.0043290 k( 222) = ( 0.5000000 0.5000000 0.3500000), wk = 0.0043290 k( 223) = ( 0.5000000 0.5000000 0.3666667), wk = 0.0043290 k( 224) = ( 0.5000000 0.5000000 0.3833333), wk = 0.0043290 k( 225) = ( 0.5000000 0.5000000 0.4000000), wk = 0.0043290 k( 226) = ( 0.5000000 0.5000000 0.4166667), wk = 0.0043290 k( 227) = ( 0.5000000 0.5000000 0.4333333), wk = 0.0043290 k( 228) = ( 0.5000000 0.5000000 0.4500000), wk = 0.0043290 k( 229) = ( 0.5000000 0.5000000 0.4666667), wk = 0.0043290 k( 230) = ( 0.5000000 0.5000000 0.4833333), wk = 0.0043290 k( 231) = ( 0.5000000 0.5000000 0.5000000), wk = 0.0043290 Dense grid: 293291 G-vectors FFT dimensions: ( 90, 90, 90) Smooth grid: 47497 G-vectors FFT dimensions: ( 45, 45, 45) Largest allocated arrays est. size (Mb) dimensions Kohn-Sham Wavefunctions 0.31 Mb ( 240, 84) NL pseudopotentials 0.50 Mb ( 120, 272) Each V/rho on FFT grid 0.25 Mb ( 16200) Each G-vector array 0.05 Mb ( 6111) G-vector shells 0.01 Mb ( 1080) Largest temporary arrays est. size (Mb) dimensions Auxiliary wavefunctions 1.23 Mb ( 240, 336) Each subspace H/S matrix 1.72 Mb ( 336, 336) Each matrix 0.70 Mb ( 272, 2, 84) The potential is recalculated from file : ./VCu3S4.save/charge-density.dat Starting wfc are 106 randomized atomic wfcs Band Structure Calculation Davidson diagonalization with overlap Computing kpt #: 1 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 55.6 secs Computing kpt #: 2 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 65.9 secs Computing kpt #: 3 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 76.3 secs Computing kpt #: 4 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 86.5 secs Computing kpt #: 5 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 97.2 secs Computing kpt #: 6 total cpu time spent up to now is 105.5 secs Computing kpt #: 7 total cpu time spent up to now is 113.8 secs Computing kpt #: 8 total cpu time spent up to now is 119.5 secs Computing kpt #: 9 total cpu time spent up to now is 126.4 secs Computing kpt #: 10 total cpu time spent up to now is 132.7 secs Computing kpt #: 11 total cpu time spent up to now is 138.0 secs Computing kpt #: 12 total cpu time spent up to now is 143.2 secs Computing kpt #: 13 total cpu time spent up to now is 148.4 secs Computing kpt #: 14 total cpu time spent up to now is 153.6 secs Computing kpt #: 15 total cpu time spent up to now is 159.0 secs Computing kpt #: 16 total cpu time spent up to now is 164.0 secs Computing kpt #: 17 total cpu time spent up to now is 169.1 secs Computing kpt #: 18 total cpu time spent up to now is 174.1 secs Computing kpt #: 19 total cpu time spent up to now is 179.2 secs Computing kpt #: 20 total cpu time spent up to now is 184.2 secs Computing kpt #: 21 total cpu time spent up to now is 189.5 secs Computing kpt #: 22 total cpu time spent up to now is 194.8 secs Computing kpt #: 23 total cpu time spent up to now is 199.7 secs Computing kpt #: 24 total cpu time spent up to now is 204.9 secs Computing kpt #: 25 total cpu time spent up to now is 210.1 secs Computing kpt #: 26 total cpu time spent up to now is 215.1 secs Computing kpt #: 27 total cpu time spent up to now is 220.2 secs Computing kpt #: 28 total cpu time spent up to now is 225.2 secs Computing kpt #: 29 total cpu time spent up to now is 230.3 secs Computing kpt #: 30 total cpu time spent up to now is 236.5 secs Computing kpt #: 31 total cpu time spent up to now is 242.4 secs Computing kpt #: 32 total cpu time spent up to now is 247.4 secs Computing kpt #: 33 total cpu time spent up to now is 252.5 secs Computing kpt #: 34 total cpu time spent up to now is 257.6 secs Computing kpt #: 35 total cpu time spent up to now is 262.8 secs Computing kpt #: 36 total cpu time spent up to now is 268.1 secs Computing kpt #: 37 total cpu time spent up to now is 273.4 secs Computing kpt #: 38 total cpu time spent up to now is 278.7 secs Computing kpt #: 39 total cpu time spent up to now is 284.0 secs Computing kpt #: 40 total cpu time spent up to now is 289.4 secs Computing kpt #: 41 total cpu time spent up to now is 295.0 secs Computing kpt #: 42 total cpu time spent up to now is 301.0 secs Computing kpt #: 43 total cpu time spent up to now is 306.8 secs Computing kpt #: 44 total cpu time spent up to now is 312.9 secs Computing kpt #: 45 total cpu time spent up to now is 319.2 secs Computing kpt #: 46 total cpu time spent up to now is 326.1 secs Computing kpt #: 47 total cpu time spent up to now is 333.7 secs Computing kpt #: 48 total cpu time spent up to now is 341.4 secs Computing kpt #: 49 total cpu time spent up to now is 349.4 secs Computing kpt #: 50 total cpu time spent up to now is 356.2 secs Computing kpt #: 51 total cpu time spent up to now is 362.7 secs Computing kpt #: 52 total cpu time spent up to now is 369.0 secs Computing kpt #: 53 total cpu time spent up to now is 375.2 secs Computing kpt #: 54 total cpu time spent up to now is 381.0 secs Computing kpt #: 55 total cpu time spent up to now is 386.6 secs Computing kpt #: 56 total cpu time spent up to now is 392.4 secs Computing kpt #: 57 total cpu time spent up to now is 398.1 secs Computing kpt #: 58 total cpu time spent up to now is 403.6 secs Computing kpt #: 59 total cpu time spent up to now is 409.4 secs Computing kpt #: 60 total cpu time spent up to now is 415.1 secs Computing kpt #: 61 total cpu time spent up to now is 420.7 secs Computing kpt #: 62 total cpu time spent up to now is 426.0 secs Computing kpt #: 63 total cpu time spent up to now is 431.2 secs Computing kpt #: 64 total cpu time spent up to now is 436.9 secs Computing kpt #: 65 total cpu time spent up to now is 442.7 secs Computing kpt #: 66 total cpu time spent up to now is 448.3 secs Computing kpt #: 67 total cpu time spent up to now is 454.1 secs Computing kpt #: 68 total cpu time spent up to now is 459.6 secs Computing kpt #: 69 total cpu time spent up to now is 465.4 secs Computing kpt #: 70 total cpu time spent up to now is 471.1 secs Computing kpt #: 71 total cpu time spent up to now is 477.5 secs Computing kpt #: 72 total cpu time spent up to now is 483.6 secs Computing kpt #: 73 total cpu time spent up to now is 490.6 secs Computing kpt #: 74 total cpu time spent up to now is 499.7 secs Computing kpt #: 75 total cpu time spent up to now is 510.3 secs Computing kpt #: 76 total cpu time spent up to now is 518.6 secs Computing kpt #: 77 total cpu time spent up to now is 526.9 secs Computing kpt #: 78 total cpu time spent up to now is 535.3 secs Computing kpt #: 79 total cpu time spent up to now is 544.6 secs Computing kpt #: 80 total cpu time spent up to now is 553.0 secs Computing kpt #: 81 total cpu time spent up to now is 561.8 secs Computing kpt #: 82 total cpu time spent up to now is 569.4 secs Computing kpt #: 83 total cpu time spent up to now is 577.0 secs Computing kpt #: 84 total cpu time spent up to now is 584.4 secs Computing kpt #: 85 total cpu time spent up to now is 591.5 secs Computing kpt #: 86 total cpu time spent up to now is 599.8 secs Computing kpt #: 87 total cpu time spent up to now is 607.4 secs Computing kpt #: 88 total cpu time spent up to now is 615.7 secs Computing kpt #: 89 total cpu time spent up to now is 624.4 secs Computing kpt #: 90 total cpu time spent up to now is 633.6 secs Computing kpt #: 91 total cpu time spent up to now is 642.5 secs Computing kpt #: 92 total cpu time spent up to now is 651.5 secs Computing kpt #: 93 total cpu time spent up to now is 660.6 secs Computing kpt #: 94 total cpu time spent up to now is 669.6 secs Computing kpt #: 95 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 680.6 secs Computing kpt #: 96 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 691.7 secs Computing kpt #: 97 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 702.7 secs Computing kpt #: 98 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 713.6 secs Computing kpt #: 99 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 724.5 secs Computing kpt #: 100 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 735.6 secs Computing kpt #: 101 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 746.4 secs Computing kpt #: 102 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 757.4 secs Computing kpt #: 103 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 768.2 secs Computing kpt #: 104 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 778.9 secs Computing kpt #: 105 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 789.1 secs Computing kpt #: 106 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 799.2 secs Computing kpt #: 107 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 809.7 secs Computing kpt #: 108 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 820.1 secs Computing kpt #: 109 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 830.6 secs Computing kpt #: 110 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 842.8 secs Computing kpt #: 111 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 853.3 secs Computing kpt #: 112 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 863.9 secs Computing kpt #: 113 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 874.4 secs Computing kpt #: 114 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 884.9 secs Computing kpt #: 115 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 895.5 secs Computing kpt #: 116 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 906.1 secs Computing kpt #: 117 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 916.7 secs Computing kpt #: 118 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 927.4 secs Computing kpt #: 119 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 938.1 secs Computing kpt #: 120 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 948.8 secs Computing kpt #: 121 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 959.5 secs Computing kpt #: 122 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 970.2 secs Computing kpt #: 123 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 981.0 secs Computing kpt #: 124 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 991.8 secs Computing kpt #: 125 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 1002.8 secs Computing kpt #: 126 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 1013.7 secs Computing kpt #: 127 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 1024.5 secs Computing kpt #: 128 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 1035.4 secs Computing kpt #: 129 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 1046.2 secs Computing kpt #: 130 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 1057.2 secs Computing kpt #: 131 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 1068.1 secs Computing kpt #: 132 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 1078.9 secs Computing kpt #: 133 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 1089.7 secs Computing kpt #: 134 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 1100.5 secs Computing kpt #: 135 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 1111.4 secs Computing kpt #: 136 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 1122.3 secs Computing kpt #: 137 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 1133.3 secs Computing kpt #: 138 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 1146.2 secs Computing kpt #: 139 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 1157.1 secs Computing kpt #: 140 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 1168.0 secs Computing kpt #: 141 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 1179.0 secs Computing kpt #: 142 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 1189.9 secs Computing kpt #: 143 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 1200.8 secs Computing kpt #: 144 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 1211.7 secs Computing kpt #: 145 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 1222.7 secs Computing kpt #: 146 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 1233.6 secs Computing kpt #: 147 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 1244.6 secs Computing kpt #: 148 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 1255.6 secs Computing kpt #: 149 total cpu time spent up to now is 1266.2 secs Computing kpt #: 150 total cpu time spent up to now is 1276.7 secs Computing kpt #: 151 total cpu time spent up to now is 1284.6 secs Computing kpt #: 152 total cpu time spent up to now is 1291.5 secs Computing kpt #: 153 total cpu time spent up to now is 1298.2 secs Computing kpt #: 154 total cpu time spent up to now is 1305.2 secs Computing kpt #: 155 total cpu time spent up to now is 1312.1 secs Computing kpt #: 156 total cpu time spent up to now is 1318.6 secs Computing kpt #: 157 total cpu time spent up to now is 1328.2 secs Computing kpt #: 158 total cpu time spent up to now is 1334.5 secs Computing kpt #: 159 total cpu time spent up to now is 1341.3 secs Computing kpt #: 160 total cpu time spent up to now is 1348.0 secs Computing kpt #: 161 total cpu time spent up to now is 1354.6 secs Computing kpt #: 162 total cpu time spent up to now is 1361.0 secs Computing kpt #: 163 total cpu time spent up to now is 1367.5 secs Computing kpt #: 164 total cpu time spent up to now is 1373.9 secs Computing kpt #: 165 total cpu time spent up to now is 1380.2 secs Computing kpt #: 166 total cpu time spent up to now is 1386.1 secs Computing kpt #: 167 total cpu time spent up to now is 1391.5 secs Computing kpt #: 168 total cpu time spent up to now is 1396.9 secs Computing kpt #: 169 total cpu time spent up to now is 1402.2 secs Computing kpt #: 170 total cpu time spent up to now is 1407.5 secs Computing kpt #: 171 total cpu time spent up to now is 1412.8 secs Computing kpt #: 172 total cpu time spent up to now is 1418.1 secs Computing kpt #: 173 total cpu time spent up to now is 1423.3 secs Computing kpt #: 174 total cpu time spent up to now is 1428.6 secs Computing kpt #: 175 total cpu time spent up to now is 1434.5 secs Computing kpt #: 176 total cpu time spent up to now is 1439.9 secs Computing kpt #: 177 total cpu time spent up to now is 1445.2 secs Computing kpt #: 178 total cpu time spent up to now is 1450.8 secs Computing kpt #: 179 total cpu time spent up to now is 1456.5 secs Computing kpt #: 180 total cpu time spent up to now is 1462.3 secs Computing kpt #: 181 total cpu time spent up to now is 1468.3 secs Computing kpt #: 182 total cpu time spent up to now is 1474.4 secs Computing kpt #: 183 total cpu time spent up to now is 1481.3 secs Computing kpt #: 184 total cpu time spent up to now is 1490.1 secs Computing kpt #: 185 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 1501.2 secs Computing kpt #: 186 total cpu time spent up to now is 1510.1 secs Computing kpt #: 187 total cpu time spent up to now is 1517.6 secs Computing kpt #: 188 total cpu time spent up to now is 1524.5 secs Computing kpt #: 189 total cpu time spent up to now is 1530.8 secs Computing kpt #: 190 total cpu time spent up to now is 1537.1 secs Computing kpt #: 191 total cpu time spent up to now is 1543.1 secs Computing kpt #: 192 total cpu time spent up to now is 1548.8 secs Computing kpt #: 193 total cpu time spent up to now is 1554.3 secs Computing kpt #: 194 total cpu time spent up to now is 1559.7 secs Computing kpt #: 195 total cpu time spent up to now is 1565.0 secs Computing kpt #: 196 total cpu time spent up to now is 1570.2 secs Computing kpt #: 197 total cpu time spent up to now is 1577.1 secs Computing kpt #: 198 total cpu time spent up to now is 1582.2 secs Computing kpt #: 199 total cpu time spent up to now is 1587.4 secs Computing kpt #: 200 total cpu time spent up to now is 1592.5 secs Computing kpt #: 201 total cpu time spent up to now is 1597.7 secs Computing kpt #: 202 total cpu time spent up to now is 1603.0 secs Computing kpt #: 203 total cpu time spent up to now is 1608.2 secs Computing kpt #: 204 total cpu time spent up to now is 1613.6 secs Computing kpt #: 205 total cpu time spent up to now is 1618.9 secs Computing kpt #: 206 total cpu time spent up to now is 1624.3 secs Computing kpt #: 207 total cpu time spent up to now is 1629.7 secs Computing kpt #: 208 total cpu time spent up to now is 1635.8 secs Computing kpt #: 209 total cpu time spent up to now is 1641.6 secs Computing kpt #: 210 total cpu time spent up to now is 1647.3 secs Computing kpt #: 211 total cpu time spent up to now is 1653.0 secs Computing kpt #: 212 total cpu time spent up to now is 1658.8 secs Computing kpt #: 213 total cpu time spent up to now is 1664.6 secs Computing kpt #: 214 total cpu time spent up to now is 1670.9 secs Computing kpt #: 215 total cpu time spent up to now is 1677.1 secs Computing kpt #: 216 total cpu time spent up to now is 1683.3 secs Computing kpt #: 217 total cpu time spent up to now is 1689.5 secs Computing kpt #: 218 total cpu time spent up to now is 1695.8 secs Computing kpt #: 219 total cpu time spent up to now is 1702.2 secs Computing kpt #: 220 total cpu time spent up to now is 1708.5 secs Computing kpt #: 221 total cpu time spent up to now is 1714.8 secs Computing kpt #: 222 total cpu time spent up to now is 1721.3 secs Computing kpt #: 223 total cpu time spent up to now is 1727.8 secs Computing kpt #: 224 total cpu time spent up to now is 1735.3 secs Computing kpt #: 225 total cpu time spent up to now is 1743.2 secs Computing kpt #: 226 total cpu time spent up to now is 1749.8 secs Computing kpt #: 227 total cpu time spent up to now is 1756.4 secs Computing kpt #: 228 total cpu time spent up to now is 1763.0 secs Computing kpt #: 229 total cpu time spent up to now is 1769.7 secs Computing kpt #: 230 total cpu time spent up to now is 1776.4 secs Computing kpt #: 231 total cpu time spent up to now is 1782.6 secs ethr = 1.43E-11, avg # of iterations = 66.6 total cpu time spent up to now is 1782.8 secs End of band structure calculation k = 0.0000 0.0000 0.0000 ( 6031 PWs) bands (ev): -58.2230 -58.2230 -32.6658 -32.6658 -31.8424 -31.8424 -31.8424 -31.8424 -7.5904 -7.5904 -6.3613 -6.3613 -6.3557 -6.3557 -6.3557 -6.3557 0.3492 0.3492 0.3492 0.3492 1.1688 1.1688 1.9110 1.9110 1.9110 1.9110 1.9442 1.9442 2.5369 2.5369 2.5779 2.5779 2.5779 2.5779 3.2857 3.2857 3.2857 3.2857 3.2888 3.2888 3.3757 3.3757 3.3757 3.3757 3.8252 3.8252 3.9420 3.9420 3.9420 3.9420 4.0886 4.0886 4.0886 4.0886 4.1611 4.1611 4.7360 4.7360 4.8306 4.8306 4.8306 4.8306 4.9804 4.9804 5.6634 5.6634 5.6634 5.6634 5.7456 5.7456 7.5131 7.5131 7.5131 7.5131 8.2076 8.2076 8.2419 8.2419 8.2419 8.2419 9.0108 9.0108 11.4063 11.4069 k = 0.0000 0.0167-0.0000 ( 6007 PWs) bands (ev): -58.2230 -58.2230 -32.6658 -32.6658 -31.8424 -31.8424 -31.8424 -31.8424 -7.5898 -7.5898 -6.3616 -6.3616 -6.3562 -6.3562 -6.3556 -6.3556 0.3498 0.3498 0.3503 0.3503 1.1696 1.1696 1.9101 1.9101 1.9116 1.9116 1.9440 1.9440 2.5363 2.5363 2.5769 2.5769 2.5777 2.5777 3.2760 3.2760 3.2857 3.2857 3.2878 3.2878 3.3752 3.3752 3.3862 3.3862 3.8253 3.8253 3.9380 3.9380 3.9460 3.9460 4.0862 4.0862 4.0914 4.0914 4.1610 4.1610 4.7358 4.7358 4.8273 4.8273 4.8332 4.8332 4.9802 4.9802 5.6622 5.6622 5.6638 5.6638 5.7452 5.7452 7.5132 7.5132 7.5136 7.5136 8.2065 8.2065 8.2394 8.2394 8.2420 8.2420 9.0180 9.0180 11.4053 11.4057 k = 0.0000 0.0333-0.0000 ( 5991 PWs) bands (ev): -58.2230 -58.2230 -32.6658 -32.6658 -31.8424 -31.8424 -31.8424 -31.8424 -7.5880 -7.5880 -6.3629 -6.3629 -6.3574 -6.3574 -6.3556 -6.3556 0.3517 0.3517 0.3535 0.3535 1.1719 1.1719 1.9081 1.9081 1.9125 1.9125 1.9437 1.9437 2.5346 2.5346 2.5740 2.5740 2.5770 2.5770 3.2527 3.2527 3.2849 3.2849 3.2868 3.2868 3.3763 3.3763 3.4077 3.4077 3.8252 3.8252 3.9337 3.9337 3.9500 3.9500 4.0835 4.0835 4.0950 4.0950 4.1605 4.1605 4.7352 4.7352 4.8230 4.8230 4.8354 4.8354 4.9797 4.9797 5.6588 5.6588 5.6651 5.6651 5.7440 5.7440 7.5137 7.5137 7.5150 7.5150 8.2022 8.2022 8.2335 8.2335 8.2422 8.2422 9.0391 9.0391 11.3986 11.3987 k = 0.0000 0.0500-0.0000 ( 5983 PWs) bands (ev): -58.2230 -58.2230 -32.6658 -32.6658 -31.8424 -31.8424 -31.8424 -31.8424 -7.5849 -7.5849 -6.3660 -6.3660 -6.3583 -6.3583 -6.3556 -6.3556 0.3549 0.3549 0.3588 0.3588 1.1757 1.1757 1.9044 1.9044 1.9139 1.9139 1.9434 1.9434 2.5313 2.5313 2.5696 2.5696 2.5758 2.5758 3.2238 3.2238 3.2837 3.2837 3.2854 3.2854 3.3780 3.3780 3.4333 3.4333 3.8250 3.8250 3.9294 3.9294 3.9539 3.9539 4.0799 4.0799 4.0997 4.0997 4.1598 4.1598 4.7341 4.7341 4.8175 4.8175 4.8373 4.8373 4.9787 4.9787 5.6528 5.6528 5.6671 5.6671 5.7424 5.7424 7.5145 7.5145 7.5174 7.5174 8.1920 8.1920 8.2280 8.2280 8.2425 8.2425 9.0729 9.0729 11.3879 11.3879 k = 0.0000 0.0667-0.0000 ( 5967 PWs) bands (ev): -58.2230 -58.2230 -32.6658 -32.6658 -31.8425 -31.8425 -31.8424 -31.8424 -7.5807 -7.5807 -6.3713 -6.3713 -6.3586 -6.3586 -6.3555 -6.3555 0.3593 0.3593 0.3663 0.3663 1.1810 1.1810 1.8988 1.8988 1.9158 1.9158 1.9436 1.9436 2.5263 2.5263 2.5639 2.5639 2.5741 2.5741 3.1922 3.1922 3.2819 3.2819 3.2835 3.2835 3.3805 3.3805 3.4603 3.4603 3.8247 3.8247 3.9251 3.9251 3.9579 3.9579 4.0753 4.0753 4.1055 4.1055 4.1593 4.1593 4.7321 4.7321 4.8109 4.8109 4.8393 4.8393 4.9773 4.9773 5.6439 5.6439 5.6698 5.6698 5.7408 5.7408 7.5154 7.5154 7.5206 7.5206 8.1753 8.1753 8.2251 8.2251 8.2428 8.2428 9.1176 9.1176 11.3742 11.3742 k = 0.0000 0.0833-0.0000 ( 5951 PWs) bands (ev): -58.2230 -58.2230 -32.6658 -32.6658 -31.8425 -31.8425 -31.8424 -31.8424 -7.5753 -7.5753 -6.3783 -6.3783 -6.3587 -6.3587 -6.3554 -6.3554 0.3649 0.3649 0.3758 0.3758 1.1879 1.1879 1.8909 1.8909 1.9182 1.9182 1.9446 1.9446 2.5189 2.5189 2.5578 2.5578 2.5720 2.5720 3.1588 3.1588 3.2796 3.2796 3.2811 3.2811 3.3836 3.3836 3.4876 3.4876 3.8241 3.8241 3.9210 3.9210 3.9621 3.9621 4.0694 4.0694 4.1120 4.1120 4.1592 4.1592 4.7292 4.7292 4.8031 4.8031 4.8416 4.8416 4.9756 4.9756 5.6318 5.6318 5.6731 5.6731 5.7396 5.7396 7.5163 7.5163 7.5246 7.5246 8.1544 8.1544 8.2240 8.2240 8.2433 8.2433 9.1716 9.1716 11.3586 11.3586 k = 0.0000 0.1000-0.0000 ( 5951 PWs) bands (ev): -58.2230 -58.2230 -32.6658 -32.6658 -31.8425 -31.8425 -31.8424 -31.8424 -7.5687 -7.5687 -6.3870 -6.3870 -6.3587 -6.3587 -6.3553 -6.3553 0.3717 0.3717 0.3873 0.3873 1.1962 1.1962 1.8807 1.8807 1.9211 1.9211 1.9464 1.9464 2.5088 2.5088 2.5516 2.5516 2.5694 2.5694 3.1242 3.1242 3.2769 3.2769 3.2782 3.2782 3.3872 3.3872 3.5149 3.5149 3.8232 3.8232 3.9172 3.9172 3.9664 3.9664 4.0623 4.0623 4.1186 4.1186 4.1598 4.1598 4.7252 4.7252 4.7941 4.7941 4.8445 4.8445 4.9735 4.9735 5.6167 5.6167 5.6771 5.6771 5.7391 5.7391 7.5170 7.5170 7.5294 7.5294 8.1316 8.1316 8.2239 8.2239 8.2437 8.2437 9.2332 9.2332 11.3419 11.3419 k = 0.0000 0.1167-0.0000 ( 5947 PWs) bands (ev): -58.2230 -58.2230 -32.6659 -32.6659 -31.8425 -31.8425 -31.8424 -31.8424 -7.5609 -7.5609 -6.3972 -6.3972 -6.3585 -6.3585 -6.3552 -6.3552 0.3797 0.3797 0.4008 0.4008 1.2060 1.2060 1.8683 1.8683 1.9245 1.9245 1.9489 1.9489 2.4957 2.4957 2.5458 2.5458 2.5664 2.5664 3.0883 3.0883 3.2738 3.2738 3.2749 3.2749 3.3913 3.3913 3.5421 3.5421 3.8221 3.8221 3.9139 3.9139 3.9710 3.9710 4.0541 4.0541 4.1249 4.1249 4.1618 4.1618 4.7200 4.7200 4.7841 4.7841 4.8480 4.8480 4.9712 4.9712 5.5986 5.5986 5.6815 5.6815 5.7392 5.7392 7.5173 7.5173 7.5349 7.5349 8.1085 8.1085 8.2242 8.2242 8.2440 8.2440 9.3012 9.3012 11.3250 11.3250 k = 0.0000 0.1333-0.0000 ( 5923 PWs) bands (ev): -58.2230 -58.2230 -32.6659 -32.6659 -31.8425 -31.8425 -31.8424 -31.8424 -7.5521 -7.5521 -6.4089 -6.4089 -6.3584 -6.3584 -6.3550 -6.3550 0.3887 0.3887 0.4164 0.4164 1.2174 1.2174 1.8537 1.8537 1.9284 1.9284 1.9521 1.9521 2.4799 2.4799 2.5403 2.5403 2.5630 2.5630 3.0515 3.0515 3.2703 3.2703 3.2712 3.2712 3.3958 3.3958 3.5690 3.5690 3.8206 3.8206 3.9113 3.9113 3.9757 3.9757 4.0450 4.0450 4.1302 4.1302 4.1658 4.1658 4.7135 4.7135 4.7733 4.7733 4.8522 4.8522 4.9687 4.9687 5.5779 5.5779 5.6863 5.6863 5.7399 5.7399 7.5170 7.5170 7.5411 7.5411 8.0863 8.0863 8.2247 8.2247 8.2443 8.2443 9.3745 9.3745 11.3084 11.3084 k = 0.0000 0.1500-0.0000 ( 5927 PWs) bands (ev): -58.2230 -58.2230 -32.6659 -32.6659 -31.8425 -31.8425 -31.8424 -31.8424 -7.5421 -7.5421 -6.4220 -6.4220 -6.3582 -6.3582 -6.3549 -6.3549 0.3989 0.3989 0.4338 0.4338 1.2301 1.2301 1.8372 1.8372 1.9327 1.9327 1.9558 1.9558 2.4616 2.4616 2.5350 2.5350 2.5592 2.5592 3.0136 3.0136 3.2665 3.2665 3.2672 3.2672 3.4007 3.4007 3.5955 3.5955 3.8187 3.8187 3.9092 3.9092 3.9804 3.9804 4.0352 4.0352 4.1341 4.1341 4.1717 4.1717 4.7059 4.7059 4.7616 4.7616 4.8570 4.8570 4.9659 4.9659 5.5550 5.5550 5.6915 5.6915 5.7412 5.7412 7.5159 7.5159 7.5477 7.5477 8.0655 8.0655 8.2252 8.2252 8.2444 8.2444 9.4521 9.4521 11.2928 11.2928 k = 0.0000 0.1667-0.0000 ( 5919 PWs) bands (ev): -58.2230 -58.2230 -32.6659 -32.6659 -31.8426 -31.8426 -31.8424 -31.8424 -7.5311 -7.5311 -6.4363 -6.4363 -6.3580 -6.3580 -6.3547 -6.3547 0.4099 0.4099 0.4530 0.4530 1.2444 1.2444 1.8187 1.8187 1.9374 1.9374 1.9601 1.9601 2.4413 2.4413 2.5297 2.5297 2.5550 2.5550 2.9749 2.9749 3.2623 3.2623 3.2629 3.2629 3.4060 3.4060 3.6216 3.6216 3.8165 3.8165 3.9079 3.9079 3.9848 3.9848 4.0253 4.0253 4.1367 4.1367 4.1793 4.1793 4.6972 4.6972 4.7494 4.7494 4.8623 4.8623 4.9630 4.9630 5.5302 5.5302 5.6968 5.6968 5.7430 5.7430 7.5140 7.5140 7.5547 7.5547 8.0468 8.0468 8.2257 8.2257 8.2443 8.2443 9.5332 9.5332 11.2783 11.2783 k = 0.0000 0.1833-0.0000 ( 5939 PWs) bands (ev): -58.2230 -58.2230 -32.6659 -32.6659 -31.8426 -31.8426 -31.8424 -31.8424 -7.5192 -7.5192 -6.4519 -6.4519 -6.3577 -6.3577 -6.3546 -6.3546 0.4219 0.4219 0.4740 0.4740 1.2600 1.2600 1.7985 1.7985 1.9424 1.9424 1.9648 1.9648 2.4192 2.4192 2.5242 2.5242 2.5505 2.5505 2.9352 2.9352 3.2578 3.2578 3.2584 3.2584 3.4114 3.4114 3.6471 3.6471 3.8141 3.8141 3.9071 3.9071 3.9878 3.9878 4.0164 4.0164 4.1384 4.1384 4.1878 4.1878 4.6876 4.6876 4.7368 4.7368 4.8680 4.8680 4.9600 4.9600 5.5039 5.5039 5.7023 5.7023 5.7451 5.7451 7.5111 7.5111 7.5621 7.5621 8.0304 8.0304 8.2260 8.2260 8.2440 8.2440 9.6172 9.6172 11.2652 11.2652 k = 0.0000 0.2000-0.0000 ( 5943 PWs) bands (ev): -58.2230 -58.2230 -32.6659 -32.6659 -31.8426 -31.8426 -31.8424 -31.8424 -7.5062 -7.5062 -6.4686 -6.4686 -6.3575 -6.3575 -6.3544 -6.3544 0.4348 0.4348 0.4968 0.4968 1.2770 1.2770 1.7766 1.7766 1.9478 1.9478 1.9699 1.9699 2.3958 2.3958 2.5186 2.5186 2.5456 2.5456 2.8948 2.8948 3.2530 3.2530 3.2538 3.2538 3.4171 3.4171 3.6720 3.6720 3.8119 3.8119 3.9070 3.9070 3.9869 3.9869 4.0113 4.0113 4.1399 4.1399 4.1967 4.1967 4.6774 4.6774 4.7239 4.7239 4.8740 4.8740 4.9571 4.9571 5.4764 5.4764 5.7078 5.7078 5.7474 5.7474 7.5072 7.5072 7.5697 7.5697 8.0164 8.0164 8.2261 8.2261 8.2434 8.2434 9.7034 9.7034 11.2538 11.2538 k = 0.0000 0.2167-0.0000 ( 5947 PWs) bands (ev): -58.2230 -58.2230 -32.6659 -32.6659 -31.8427 -31.8427 -31.8424 -31.8424 -7.4924 -7.4924 -6.4862 -6.4862 -6.3572 -6.3572 -6.3543 -6.3543 0.4483 0.4483 0.5210 0.5210 1.2953 1.2953 1.7531 1.7531 1.9535 1.9535 1.9754 1.9754 2.3711 2.3711 2.5130 2.5130 2.5406 2.5406 2.8536 2.8536 3.2481 3.2481 3.2491 3.2491 3.4230 3.4230 3.6958 3.6958 3.8100 3.8100 3.9074 3.9074 3.9802 3.9802 4.0120 4.0120 4.1411 4.1411 4.2056 4.2056 4.6666 4.6666 4.7109 4.7109 4.8801 4.8801 4.9541 4.9541 5.4482 5.4482 5.7132 5.7132 5.7499 5.7499 7.5023 7.5023 7.5775 7.5775 8.0048 8.0048 8.2260 8.2260 8.2426 8.2426 9.7913 9.7913 11.2441 11.2441 k = 0.0000 0.2333-0.0000 ( 5939 PWs) bands (ev): -58.2230 -58.2230 -32.6659 -32.6659 -31.8427 -31.8427 -31.8424 -31.8424 -7.4778 -7.4778 -6.5048 -6.5048 -6.3569 -6.3569 -6.3541 -6.3541 0.4625 0.4625 0.5469 0.5469 1.3149 1.3149 1.7281 1.7281 1.9595 1.9595 1.9811 1.9811 2.3456 2.3456 2.5072 2.5072 2.5354 2.5354 2.8119 2.8119 3.2431 3.2431 3.2442 3.2442 3.4290 3.4290 3.7179 3.7179 3.8094 3.8094 3.9083 3.9083 3.9705 3.9705 4.0160 4.0160 4.1422 4.1422 4.2141 4.2141 4.6556 4.6556 4.6979 4.6979 4.8863 4.8863 4.9514 4.9514 5.4195 5.4195 5.7187 5.7187 5.7527 5.7527 7.4966 7.4966 7.5853 7.5853 7.9956 7.9956 8.2257 8.2257 8.2415 8.2415 9.8804 9.8804 11.2360 11.2360 k = 0.0000 0.2500-0.0000 ( 5930 PWs) bands (ev): -58.2230 -58.2230 -32.6660 -32.6660 -31.8427 -31.8427 -31.8424 -31.8424 -7.4625 -7.4625 -6.5241 -6.5241 -6.3566 -6.3566 -6.3539 -6.3539 0.4772 0.4772 0.5741 0.5741 1.3357 1.3357 1.7018 1.7018 1.9656 1.9656 1.9870 1.9870 2.3195 2.3195 2.5012 2.5012 2.5300 2.5300 2.7697 2.7697 3.2381 3.2381 3.2394 3.2394 3.4350 3.4350 3.7371 3.7371 3.8112 3.8112 3.9095 3.9095 3.9599 3.9599 4.0212 4.0212 4.1433 4.1433 4.2220 4.2220 4.6445 4.6445 4.6850 4.6850 4.8924 4.8924 4.9488 4.9488 5.3906 5.3906 5.7239 5.7239 5.7554 5.7554 7.4901 7.4901 7.5930 7.5930 7.9884 7.9884 8.2251 8.2251 8.2400 8.2400 9.9699 9.9699 11.2297 11.2297 k = 0.0000 0.2667-0.0000 ( 5934 PWs) bands (ev): -58.2230 -58.2230 -32.6660 -32.6660 -31.8427 -31.8427 -31.8424 -31.8424 -7.4465 -7.4465 -6.5441 -6.5441 -6.3563 -6.3563 -6.3537 -6.3537 0.4922 0.4922 0.6026 0.6026 1.3575 1.3575 1.6743 1.6743 1.9719 1.9719 1.9930 1.9930 2.2930 2.2930 2.4952 2.4952 2.5245 2.5245 2.7273 2.7273 3.2331 3.2331 3.2345 3.2345 3.4410 3.4410 3.7513 3.7513 3.8174 3.8174 3.9110 3.9110 3.9495 3.9495 4.0267 4.0267 4.1443 4.1443 4.2289 4.2289 4.6334 4.6334 4.6725 4.6725 4.8984 4.8984 4.9467 4.9467 5.3617 5.3617 5.7289 5.7289 5.7582 5.7582 7.4831 7.4831 7.6006 7.6006 7.9831 7.9831 8.2243 8.2243 8.2384 8.2384 10.0595 10.0595 11.2250 11.2250 k = 0.0000 0.2833-0.0000 ( 5946 PWs) bands (ev): -58.2230 -58.2230 -32.6660 -32.6660 -31.8428 -31.8428 -31.8424 -31.8424 -7.4300 -7.4300 -6.5645 -6.5645 -6.3560 -6.3560 -6.3536 -6.3536 0.5075 0.5075 0.6323 0.6323 1.3803 1.3803 1.6458 1.6458 1.9782 1.9782 1.9992 1.9992 2.2664 2.2664 2.4890 2.4890 2.5189 2.5189 2.6848 2.6848 3.2281 3.2281 3.2297 3.2297 3.4469 3.4469 3.7591 3.7591 3.8294 3.8294 3.9126 3.9126 3.9395 3.9395 4.0323 4.0323 4.1454 4.1454 4.2348 4.2348 4.6225 4.6225 4.6602 4.6602 4.9043 4.9043 4.9450 4.9450 5.3330 5.3330 5.7336 5.7336 5.7609 5.7609 7.4757 7.4757 7.6080 7.6080 7.9795 7.9795 8.2233 8.2233 8.2365 8.2365 10.1485 10.1485 11.2216 11.2216 k = 0.0000 0.3000-0.0000 ( 5930 PWs) bands (ev): -58.2230 -58.2230 -32.6660 -32.6660 -31.8428 -31.8428 -31.8424 -31.8424 -7.4131 -7.4131 -6.5853 -6.5853 -6.3557 -6.3557 -6.3534 -6.3534 0.5229 0.5229 0.6631 0.6631 1.4038 1.4038 1.6165 1.6165 1.9845 1.9845 2.0053 2.0053 2.2401 2.2401 2.4827 2.4827 2.5133 2.5133 2.6424 2.6424 3.2233 3.2233 3.2250 3.2250 3.4527 3.4527 3.7618 3.7618 3.8454 3.8454 3.9145 3.9145 3.9306 3.9306 4.0379 4.0379 4.1465 4.1465 4.2394 4.2394 4.6120 4.6120 4.6486 4.6486 4.9100 4.9100 4.9440 4.9440 5.3048 5.3048 5.7381 5.7381 5.7637 5.7637 7.4682 7.4682 7.6152 7.6152 7.9772 7.9772 8.2221 8.2221 8.2344 8.2344 10.2362 10.2362 11.2195 11.2195 k = 0.0000 0.3167-0.0000 ( 5922 PWs) bands (ev): -58.2230 -58.2230 -32.6660 -32.6660 -31.8428 -31.8428 -31.8424 -31.8424 -7.3959 -7.3959 -6.6062 -6.6062 -6.3554 -6.3554 -6.3533 -6.3533 0.5382 0.5382 0.6947 0.6947 1.4276 1.4276 1.5868 1.5868 1.9908 1.9908 2.0115 2.0115 2.2143 2.2143 2.4763 2.4763 2.5078 2.5078 2.6007 2.6007 3.2187 3.2187 3.2204 3.2204 3.4584 3.4584 3.7615 3.7615 3.8625 3.8625 3.9167 3.9167 3.9235 3.9235 4.0433 4.0433 4.1477 4.1477 4.2426 4.2426 4.6020 4.6020 4.6374 4.6374 4.9154 4.9154 4.9437 4.9437 5.2772 5.2772 5.7422 5.7422 5.7665 5.7665 7.4607 7.4607 7.6219 7.6219 7.9760 7.9760 8.2207 8.2207 8.2321 8.2321 10.3222 10.3222 11.2185 11.2185 k = 0.0000 0.3333-0.0000 ( 5918 PWs) bands (ev): -58.2230 -58.2230 -32.6660 -32.6660 -31.8428 -31.8428 -31.8424 -31.8424 -7.3787 -7.3787 -6.6269 -6.6269 -6.3551 -6.3551 -6.3531 -6.3531 0.5531 0.5531 0.7270 0.7270 1.4506 1.4506 1.5577 1.5577 1.9970 1.9970 2.0174 2.0174 2.1893 2.1893 2.4693 2.4693 2.5024 2.5024 2.5601 2.5601 3.2143 3.2143 3.2161 3.2161 3.4638 3.4638 3.7598 3.7598 3.8764 3.8764 3.9184 3.9184 3.9218 3.9218 4.0485 4.0485 4.1488 4.1488 4.2442 4.2442 4.5926 4.5926 4.6269 4.6269 4.9203 4.9203 4.9445 4.9445 5.2503 5.2503 5.7460 5.7460 5.7691 5.7691 7.4533 7.4533 7.6283 7.6283 7.9756 7.9756 8.2192 8.2192 8.2298 8.2298 10.4056 10.4056 11.2181 11.2181 k = 0.0000 0.3500-0.0000 ( 5926 PWs) bands (ev): -58.2230 -58.2230 -32.6660 -32.6660 -31.8429 -31.8429 -31.8424 -31.8424 -7.3616 -7.3616 -6.6474 -6.6474 -6.3549 -6.3549 -6.3530 -6.3530 0.5676 0.5676 0.7598 0.7598 1.4692 1.4692 1.5327 1.5327 2.0029 2.0029 2.0231 2.0231 2.1654 2.1654 2.4610 2.4610 2.4972 2.4972 2.5219 2.5219 3.2102 3.2102 3.2119 3.2119 3.4690 3.4690 3.7574 3.7574 3.8824 3.8824 3.9184 3.9184 3.9305 3.9305 4.0534 4.0534 4.1498 4.1498 4.2443 4.2443 4.5838 4.5838 4.6171 4.6171 4.9247 4.9247 4.9466 4.9466 5.2242 5.2242 5.7494 5.7494 5.7716 5.7716 7.4464 7.4464 7.6342 7.6342 7.9758 7.9758 8.2177 8.2177 8.2274 8.2274 10.4857 10.4857 11.2182 11.2182 k = 0.0000 0.3667-0.0000 ( 5950 PWs) bands (ev): -58.2230 -58.2230 -32.6660 -32.6660 -31.8429 -31.8429 -31.8424 -31.8424 -7.3448 -7.3448 -6.6672 -6.6672 -6.3546 -6.3546 -6.3529 -6.3529 0.5813 0.5813 0.7929 0.7929 1.4689 1.4689 1.5265 1.5265 2.0085 2.0085 2.0285 2.0285 2.1430 2.1430 2.4481 2.4481 2.4900 2.4900 2.4922 2.4922 3.2064 3.2064 3.2081 3.2081 3.4737 3.4737 3.7547 3.7547 3.8812 3.8812 3.9196 3.9196 3.9456 3.9456 4.0580 4.0580 4.1508 4.1508 4.2427 4.2427 4.5758 4.5758 4.6081 4.6081 4.9283 4.9283 4.9503 4.9503 5.1991 5.1991 5.7524 5.7524 5.7740 5.7740 7.4398 7.4398 7.6396 7.6396 7.9765 7.9765 8.2161 8.2161 8.2250 8.2250 10.5617 10.5617 11.2184 11.2184 k = 0.0000 0.3833-0.0000 ( 5954 PWs) bands (ev): -58.2230 -58.2230 -32.6660 -32.6660 -31.8429 -31.8429 -31.8424 -31.8424 -7.3286 -7.3286 -6.6861 -6.6861 -6.3544 -6.3544 -6.3528 -6.3528 0.5942 0.5942 0.8258 0.8258 1.4460 1.4460 1.5424 1.5424 2.0137 2.0137 2.0335 2.0335 2.1223 2.1223 2.4245 2.4245 2.4709 2.4709 2.4876 2.4876 3.2030 3.2030 3.2046 3.2046 3.4782 3.4782 3.7519 3.7519 3.8773 3.8773 3.9209 3.9209 3.9635 3.9635 4.0622 4.0622 4.1518 4.1518 4.2397 4.2397 4.5686 4.5686 4.6000 4.6000 4.9312 4.9312 4.9557 4.9557 5.1749 5.1749 5.7551 5.7551 5.7762 5.7762 7.4339 7.4339 7.6445 7.6445 7.9774 7.9774 8.2146 8.2146 8.2227 8.2227 10.6329 10.6329 11.2185 11.2185 k = 0.0000 0.4000-0.0000 ( 5962 PWs) bands (ev): -58.2230 -58.2230 -32.6661 -32.6661 -31.8429 -31.8429 -31.8424 -31.8424 -7.3134 -7.3134 -6.7038 -6.7038 -6.3542 -6.3542 -6.3527 -6.3527 0.6059 0.6059 0.8582 0.8582 1.4171 1.4171 1.5639 1.5639 2.0185 2.0185 2.0381 2.0381 2.1036 2.1036 2.3941 2.3941 2.4615 2.4615 2.4835 2.4835 3.2000 3.2000 3.2014 3.2014 3.4822 3.4822 3.7493 3.7493 3.8728 3.8728 3.9221 3.9221 3.9817 3.9817 4.0661 4.0661 4.1527 4.1527 4.2354 4.2354 4.5622 4.5622 4.5928 4.5928 4.9334 4.9334 4.9626 4.9626 5.1518 5.1518 5.7574 5.7574 5.7782 5.7782 7.4286 7.4286 7.6488 7.6488 7.9785 7.9785 8.2132 8.2132 8.2205 8.2205 10.6982 10.6982 11.2181 11.2181 k = 0.0000 0.4167-0.0000 ( 5950 PWs) bands (ev): -58.2230 -58.2230 -32.6661 -32.6661 -31.8429 -31.8429 -31.8424 -31.8424 -7.2996 -7.2996 -6.7199 -6.7199 -6.3540 -6.3540 -6.3527 -6.3527 0.6162 0.6162 0.8896 0.8896 1.3876 1.3876 1.5856 1.5856 2.0227 2.0227 2.0421 2.0421 2.0873 2.0873 2.3636 2.3636 2.4557 2.4557 2.4798 2.4798 3.1974 3.1974 3.1986 3.1986 3.4858 3.4858 3.7469 3.7469 3.8687 3.8687 3.9232 3.9232 3.9992 3.9992 4.0696 4.0696 4.1536 4.1536 4.2301 4.2301 4.5568 4.5568 4.5866 4.5866 4.9353 4.9353 4.9710 4.9710 5.1298 5.1298 5.7593 5.7593 5.7800 5.7800 7.4240 7.4240 7.6524 7.6524 7.9796 7.9796 8.2120 8.2120 8.2186 8.2186 10.7567 10.7567 11.2171 11.2171 k = 0.0000 0.4333-0.0000 ( 5934 PWs) bands (ev): -58.2230 -58.2230 -32.6661 -32.6661 -31.8430 -31.8430 -31.8424 -31.8424 -7.2874 -7.2874 -6.7338 -6.7338 -6.3538 -6.3538 -6.3526 -6.3526 0.6250 0.6250 0.9189 0.9189 1.3594 1.3594 1.6055 1.6055 2.0263 2.0263 2.0456 2.0456 2.0736 2.0736 2.3361 2.3361 2.4516 2.4516 2.4767 2.4767 3.1953 3.1953 3.1963 3.1963 3.4888 3.4888 3.7448 3.7448 3.8652 3.8652 3.9242 3.9242 4.0152 4.0152 4.0726 4.0726 4.1544 4.1544 4.2241 4.2241 4.5524 4.5524 4.5815 4.5815 4.9367 4.9367 4.9807 4.9807 5.1090 5.1090 5.7609 5.7609 5.7815 5.7815 7.4202 7.4202 7.6555 7.6555 7.9806 7.9806 8.2109 8.2109 8.2169 8.2169 10.8073 10.8073 11.2154 11.2154 k = 0.0000 0.4500-0.0000 ( 5934 PWs) bands (ev): -58.2230 -58.2230 -32.6661 -32.6661 -31.8430 -31.8430 -31.8424 -31.8424 -7.2773 -7.2773 -6.7453 -6.7453 -6.3536 -6.3536 -6.3526 -6.3526 0.6321 0.6321 0.9451 0.9451 1.3340 1.3340 1.6225 1.6225 2.0291 2.0291 2.0483 2.0483 2.0627 2.0627 2.3129 2.3129 2.4485 2.4485 2.4742 2.4742 3.1936 3.1936 3.1944 3.1944 3.4912 3.4912 3.7431 3.7431 3.8624 3.8624 3.9248 3.9248 4.0288 4.0288 4.0753 4.0753 4.1551 4.1551 4.2180 4.2180 4.5489 4.5489 4.5774 4.5774 4.9379 4.9379 4.9915 4.9915 5.0895 5.0895 5.7621 5.7621 5.7827 5.7827 7.4172 7.4172 7.6578 7.6578 7.9814 7.9814 8.2100 8.2100 8.2155 8.2155 10.8488 10.8488 11.2132 11.2132 k = 0.0000 0.4667-0.0000 ( 5926 PWs) bands (ev): -58.2230 -58.2230 -32.6661 -32.6661 -31.8430 -31.8430 -31.8424 -31.8424 -7.2698 -7.2698 -6.7538 -6.7538 -6.3535 -6.3535 -6.3526 -6.3526 0.6372 0.6372 0.9665 0.9665 1.3132 1.3132 1.6357 1.6357 2.0312 2.0312 2.0503 2.0503 2.0548 2.0548 2.2954 2.2954 2.4464 2.4464 2.4724 2.4724 3.1925 3.1925 3.1930 3.1930 3.4930 3.4930 3.7418 3.7418 3.8604 3.8604 3.9254 3.9254 4.0392 4.0392 4.0774 4.0774 4.1557 4.1557 4.2127 4.2127 4.5464 4.5464 4.5744 4.5744 4.9387 4.9387 5.0032 5.0032 5.0716 5.0716 5.7630 5.7630 5.7836 5.7836 7.4150 7.4150 7.6595 7.6595 7.9821 7.9821 8.2094 8.2094 8.2145 8.2145 10.8799 10.8799 11.2109 11.2109 k = 0.0000 0.4833-0.0000 ( 5926 PWs) bands (ev): -58.2230 -58.2230 -32.6661 -32.6661 -31.8430 -31.8430 -31.8424 -31.8424 -7.2651 -7.2651 -6.7591 -6.7591 -6.3535 -6.3535 -6.3526 -6.3526 0.6404 0.6404 0.9807 0.9807 1.2993 1.2993 1.6440 1.6440 2.0325 2.0325 2.0499 2.0499 2.0516 2.0516 2.2844 2.2844 2.4451 2.4451 2.4713 2.4713 3.1919 3.1919 3.1922 3.1922 3.4940 3.4940 3.7410 3.7410 3.8591 3.8591 3.9257 3.9257 4.0458 4.0458 4.0790 4.0790 4.1560 4.1560 4.2089 4.2089 4.5449 4.5449 4.5726 4.5726 4.9392 4.9392 5.0150 5.0150 5.0561 5.0561 5.7635 5.7635 5.7841 5.7841 7.4137 7.4137 7.6606 7.6606 7.9825 7.9825 8.2090 8.2090 8.2139 8.2139 10.8993 10.8993 11.2091 11.2091 k = 0.0000 0.5000-0.0000 ( 5942 PWs) bands (ev): -58.2230 -58.2230 -32.6661 -32.6661 -31.8430 -31.8430 -31.8424 -31.8424 -7.2635 -7.2635 -6.7609 -6.7609 -6.3534 -6.3534 -6.3526 -6.3526 0.6414 0.6414 0.9857 0.9857 1.2943 1.2943 1.6468 1.6468 2.0328 2.0328 2.0484 2.0484 2.0519 2.0519 2.2806 2.2806 2.4446 2.4446 2.4709 2.4709 3.1917 3.1917 3.1918 3.1918 3.4943 3.4943 3.7407 3.7407 3.8587 3.8587 3.9258 3.9258 4.0480 4.0480 4.0795 4.0795 4.1562 4.1562 4.2075 4.2075 4.5444 4.5444 4.5720 4.5720 4.9394 4.9394 5.0216 5.0216 5.0481 5.0481 5.7636 5.7636 5.7843 5.7843 7.4133 7.4133 7.6609 7.6609 7.9826 7.9826 8.2089 8.2089 8.2137 8.2137 10.9059 10.9059 11.2084 11.2084 k = 0.0000 0.5000-0.0000 ( 5942 PWs) bands (ev): -58.2230 -58.2230 -32.6661 -32.6661 -31.8430 -31.8430 -31.8424 -31.8424 -7.2635 -7.2635 -6.7609 -6.7609 -6.3534 -6.3534 -6.3526 -6.3526 0.6414 0.6414 0.9857 0.9857 1.2943 1.2943 1.6468 1.6468 2.0328 2.0328 2.0484 2.0484 2.0519 2.0519 2.2806 2.2806 2.4446 2.4446 2.4709 2.4709 3.1917 3.1917 3.1918 3.1918 3.4943 3.4943 3.7407 3.7407 3.8587 3.8587 3.9258 3.9258 4.0480 4.0480 4.0795 4.0795 4.1562 4.1562 4.2075 4.2075 4.5444 4.5444 4.5720 4.5720 4.9394 4.9394 5.0216 5.0216 5.0481 5.0481 5.7636 5.7636 5.7843 5.7843 7.4133 7.4133 7.6609 7.6609 7.9826 7.9826 8.2089 8.2089 8.2137 8.2137 10.9059 10.9059 11.2084 11.2084 k = 0.0167 0.5000-0.0000 ( 5930 PWs) bands (ev): -58.2230 -58.2230 -32.6661 -32.6661 -31.8430 -31.8430 -31.8424 -31.8424 -7.2630 -7.2629 -6.7607 -6.7607 -6.3539 -6.3538 -6.3530 -6.3529 0.6417 0.6423 0.9857 0.9859 1.2939 1.2944 1.6468 1.6473 2.0311 2.0340 2.0469 2.0487 2.0520 2.0522 2.2809 2.2812 2.4441 2.4444 2.4704 2.4708 3.1891 3.1893 3.1906 3.1910 3.4956 3.4957 3.7390 3.7424 3.8556 3.8618 3.9131 3.9394 4.0455 4.0486 4.0759 4.0846 4.1488 4.1667 4.2045 4.2114 4.5375 4.5470 4.5658 4.5770 4.9376 4.9478 5.0173 5.0265 5.0458 5.0494 5.7602 5.7658 5.7833 5.7838 7.4136 7.4150 7.6607 7.6613 7.9829 7.9841 8.2083 8.2091 8.2133 8.2142 10.9073 10.9076 11.2102 11.2123 k = 0.0333 0.5000-0.0000 ( 5930 PWs) bands (ev): -58.2230 -58.2230 -32.6661 -32.6661 -31.8430 -31.8430 -31.8424 -31.8424 -7.2614 -7.2614 -6.7601 -6.7601 -6.3555 -6.3553 -6.3537 -6.3536 0.6432 0.6443 0.9857 0.9861 1.2932 1.2942 1.6473 1.6484 2.0289 2.0345 2.0449 2.0476 2.0519 2.0531 2.2821 2.2826 2.4427 2.4432 2.4690 2.4700 3.1833 3.1834 3.1859 3.1869 3.4992 3.4994 3.7374 3.7440 3.8526 3.8646 3.9019 3.9538 4.0418 4.0472 4.0723 4.0921 4.1452 4.1797 4.2021 4.2166 4.5241 4.5475 4.5619 4.5781 4.9433 4.9608 5.0134 5.0318 5.0424 5.0505 5.7553 5.7666 5.7812 5.7820 7.4160 7.4187 7.6607 7.6620 7.9850 7.9872 8.2066 8.2075 8.2140 8.2163 10.9118 10.9123 11.2176 11.2218 k = 0.0500 0.5000-0.0000 ( 5936 PWs) bands (ev): -58.2230 -58.2230 -32.6661 -32.6661 -31.8430 -31.8430 -31.8425 -31.8425 -7.2588 -7.2587 -6.7590 -6.7590 -6.3583 -6.3580 -6.3547 -6.3546 0.6458 0.6475 0.9858 0.9865 1.2922 1.2936 1.6483 1.6500 2.0261 2.0343 2.0426 2.0456 2.0516 2.0541 2.2842 2.2850 2.4407 2.4411 2.4668 2.4686 3.1742 3.1743 3.1777 3.1797 3.5049 3.5052 3.7360 3.7454 3.8501 3.8664 3.8927 3.9685 4.0377 4.0448 4.0678 4.1019 4.1448 4.1919 4.2025 4.2233 4.5056 4.5461 4.5604 4.5753 4.9551 4.9750 5.0111 5.0360 5.0379 5.0547 5.7490 5.7660 5.7780 5.7790 7.4202 7.4244 7.6611 7.6630 7.9886 7.9919 8.2028 8.2039 8.2167 8.2204 10.9193 10.9202 11.2307 11.2369 k = 0.0667 0.5000-0.0000 ( 5936 PWs) bands (ev): -58.2230 -58.2230 -32.6661 -32.6661 -31.8430 -31.8430 -31.8425 -31.8425 -7.2552 -7.2551 -6.7575 -6.7575 -6.3623 -6.3620 -6.3561 -6.3560 0.6495 0.6518 0.9860 0.9869 1.2909 1.2928 1.6499 1.6521 2.0228 2.0332 2.0401 2.0429 2.0512 2.0551 2.2871 2.2882 2.4378 2.4379 2.4638 2.4668 3.1622 3.1625 3.1665 3.1697 3.5124 3.5128 3.7349 3.7466 3.8481 3.8660 3.8869 3.9832 4.0336 4.0422 4.0627 4.1134 4.1466 4.1939 4.2148 4.2322 4.4840 4.5416 4.5603 4.5704 4.9682 4.9869 5.0139 5.0322 5.0358 5.0679 5.7413 5.7635 5.7742 5.7757 7.4264 7.4319 7.6619 7.6643 7.9937 7.9980 8.1974 8.1987 8.2210 8.2261 10.9299 10.9309 11.2494 11.2576 k = 0.0833 0.5000-0.0000 ( 5940 PWs) bands (ev): -58.2230 -58.2230 -32.6661 -32.6661 -31.8430 -31.8430 -31.8425 -31.8425 -7.2506 -7.2504 -6.7556 -6.7556 -6.3674 -6.3670 -6.3578 -6.3577 0.6544 0.6572 0.9863 0.9874 1.2891 1.2915 1.6522 1.6549 2.0192 2.0308 2.0377 2.0395 2.0506 2.0560 2.2908 2.2922 2.4335 2.4343 2.4601 2.4647 3.1478 3.1481 3.1527 3.1571 3.5210 3.5216 3.7342 3.7476 3.8466 3.8627 3.8852 3.9971 4.0300 4.0399 4.0576 4.1263 4.1497 4.1918 4.2322 4.2433 4.4609 4.5324 4.5610 4.5665 4.9736 4.9942 5.0248 5.0300 5.0321 5.0899 5.7321 5.7582 5.7702 5.7731 7.4343 7.4412 7.6632 7.6661 7.9999 8.0052 8.1908 8.1924 8.2268 8.2331 10.9433 10.9446 11.2736 11.2837 k = 0.1000 0.5000-0.0000 ( 5948 PWs) bands (ev): -58.2230 -58.2230 -32.6661 -32.6661 -31.8430 -31.8430 -31.8425 -31.8425 -7.2449 -7.2447 -6.7534 -6.7533 -6.3735 -6.3731 -6.3599 -6.3598 0.6604 0.6637 0.9866 0.9880 1.2870 1.2898 1.6550 1.6582 2.0151 2.0272 2.0356 2.0356 2.0501 2.0568 2.2952 2.2970 2.4279 2.4300 2.4558 2.4623 3.1312 3.1312 3.1368 3.1423 3.5304 3.5312 3.7340 3.7484 3.8458 3.8581 3.8861 4.0084 4.0284 4.0382 4.0531 4.1399 4.1537 4.1895 4.2508 4.2567 4.4371 4.5187 4.5624 4.5646 4.9707 4.9973 5.0174 5.0263 5.0568 5.1179 5.7213 5.7503 5.7666 5.7715 7.4437 7.4519 7.6651 7.6685 8.0067 8.0131 8.1835 8.1855 8.2338 8.2412 10.9595 10.9610 11.3031 11.3151 k = 0.1167 0.5000-0.0000 ( 5936 PWs) bands (ev): -58.2230 -58.2230 -32.6661 -32.6661 -31.8430 -31.8430 -31.8425 -31.8425 -7.2383 -7.2380 -6.7507 -6.7507 -6.3808 -6.3803 -6.3623 -6.3622 0.6674 0.6713 0.9871 0.9886 1.2844 1.2877 1.6586 1.6623 2.0107 2.0227 2.0313 2.0335 2.0497 2.0576 2.3004 2.3025 2.4213 2.4249 2.4510 2.4598 3.1122 3.1128 3.1193 3.1258 3.5402 3.5412 3.7343 3.7493 3.8456 3.8536 3.8881 4.0125 4.0327 4.0373 4.0496 4.1529 4.1585 4.1882 4.2701 4.2721 4.4134 4.5021 4.5639 4.5644 4.9639 4.9971 5.0086 5.0191 5.0899 5.1495 5.7092 5.7402 5.7639 5.7712 7.4545 7.4640 7.6678 7.6716 8.0137 8.0209 8.1764 8.1787 8.2418 8.2502 10.9784 10.9801 11.3379 11.3516 k = 0.1333 0.5000-0.0000 ( 5944 PWs) bands (ev): -58.2230 -58.2230 -32.6661 -32.6661 -31.8430 -31.8430 -31.8425 -31.8425 -7.2307 -7.2304 -6.7476 -6.7476 -6.3890 -6.3885 -6.3651 -6.3650 0.6755 0.6798 0.9876 0.9892 1.2813 1.2850 1.6630 1.6672 2.0060 2.0174 2.0265 2.0312 2.0494 2.0584 2.3062 2.3086 2.4135 2.4187 2.4459 2.4572 3.0913 3.0930 3.1005 3.1077 3.5500 3.5510 3.7351 3.7502 3.8461 3.8499 3.8906 4.0108 4.0371 4.0388 4.0496 4.1621 4.1643 4.1908 4.2891 4.2896 4.3900 4.4839 4.5639 4.5669 4.9549 4.9942 4.9989 5.0108 5.1259 5.1827 5.6958 5.7284 5.7628 5.7721 7.4664 7.4772 7.6716 7.6756 8.0198 8.0276 8.1703 8.1729 8.2507 8.2600 10.9997 11.0015 11.3776 11.3929 k = 0.1500 0.5000-0.0000 ( 5950 PWs) bands (ev): -58.2230 -58.2230 -32.6661 -32.6661 -31.8430 -31.8430 -31.8425 -31.8425 -7.2222 -7.2218 -6.7442 -6.7442 -6.3983 -6.3977 -6.3682 -6.3681 0.6845 0.6893 0.9881 0.9900 1.2776 1.2817 1.6682 1.6728 2.0011 2.0115 2.0215 2.0289 2.0491 2.0590 2.3125 2.3152 2.4048 2.4115 2.4407 2.4544 3.0691 3.0720 3.0806 3.0884 3.5595 3.5606 3.7364 3.7515 3.8471 3.8473 3.8933 4.0077 4.0376 4.0383 4.0569 4.1642 4.1716 4.2006 4.3075 4.3091 4.3675 4.4649 4.5643 4.5700 4.9445 4.9884 4.9885 5.0021 5.1630 5.2161 5.6812 5.7152 5.7640 5.7747 7.4791 7.4910 7.6765 7.6808 8.0239 8.0321 8.1667 8.1692 8.2603 8.2703 11.0233 11.0252 11.4222 11.4388 k = 0.1667 0.5000-0.0000 ( 5958 PWs) bands (ev): -58.2230 -58.2230 -32.6661 -32.6661 -31.8430 -31.8430 -31.8425 -31.8425 -7.2127 -7.2123 -6.7405 -6.7404 -6.4085 -6.4078 -6.3716 -6.3715 0.6945 0.6997 0.9887 0.9907 1.2733 1.2778 1.6743 1.6794 1.9959 2.0052 2.0164 2.0265 2.0490 2.0597 2.3193 2.3221 2.3951 2.4033 2.4355 2.4516 3.0458 3.0502 3.0598 3.0681 3.5685 3.5695 3.7381 3.7533 3.8452 3.8491 3.8964 4.0047 4.0354 4.0388 4.0657 4.1614 4.1804 4.2149 4.3268 4.3268 4.3475 4.4456 4.5648 4.5737 4.9329 4.9770 4.9799 4.9933 5.1999 5.2485 5.6656 5.7008 5.7682 5.7795 7.4923 7.5052 7.6828 7.6874 8.0251 8.0330 8.1668 8.1688 8.2704 8.2811 11.0488 11.0509 11.4711 11.4890 k = 0.1833 0.5000-0.0000 ( 5940 PWs) bands (ev): -58.2230 -58.2230 -32.6662 -32.6661 -31.8430 -31.8430 -31.8426 -31.8426 -7.2025 -7.2020 -6.7364 -6.7364 -6.4196 -6.4189 -6.3753 -6.3752 0.7054 0.7109 0.9894 0.9915 1.2683 1.2731 1.6814 1.6869 1.9905 1.9985 2.0114 2.0243 2.0491 2.0603 2.3264 2.3291 2.3850 2.3940 2.4305 2.4489 3.0219 3.0278 3.0381 3.0469 3.5768 3.5775 3.7403 3.7558 3.8441 3.8514 3.8999 4.0018 4.0325 4.0406 4.0738 4.1567 4.1909 4.2310 4.3220 4.3467 4.3509 4.4266 4.5656 4.5779 4.9203 4.9649 4.9688 4.9843 5.2357 5.2791 5.6492 5.6854 5.7761 5.7872 7.5055 7.5193 7.6907 7.6956 8.0224 8.0297 8.1714 8.1726 8.2808 8.2921 11.0762 11.0783 11.5241 11.5429 k = 0.2000 0.5000-0.0000 ( 5936 PWs) bands (ev): -58.2230 -58.2230 -32.6662 -32.6662 -31.8430 -31.8430 -31.8426 -31.8426 -7.1913 -7.1909 -6.7321 -6.7320 -6.4316 -6.4308 -6.3793 -6.3792 0.7171 0.7230 0.9901 0.9923 1.2626 1.2676 1.6895 1.6954 1.9849 1.9915 2.0066 2.0221 2.0492 2.0608 2.3335 2.3353 2.3750 2.3841 2.4258 2.4461 2.9975 3.0050 3.0159 3.0250 3.5844 3.5847 3.7428 3.7589 3.8435 3.8541 3.9039 3.9991 4.0299 4.0429 4.0809 4.1509 4.2028 4.2475 4.3036 4.3669 4.3687 4.4080 4.5664 4.5828 4.9068 4.9521 4.9558 4.9744 5.2693 5.3067 5.6323 5.6691 5.7883 5.7983 7.5185 7.5329 7.7005 7.7058 8.0159 8.0222 8.1802 8.1804 8.2913 8.3031 11.1050 11.1070 11.5805 11.5997 k = 0.2167 0.5000-0.0000 ( 5938 PWs) bands (ev): -58.2230 -58.2230 -32.6662 -32.6662 -31.8431 -31.8431 -31.8426 -31.8426 -7.1795 -7.1790 -6.7274 -6.7274 -6.4443 -6.4435 -6.3835 -6.3834 0.7296 0.7358 0.9908 0.9931 1.2560 1.2613 1.6987 1.7050 1.9790 1.9843 2.0023 2.0202 2.0494 2.0614 2.3382 2.3395 2.3677 2.3745 2.4213 2.4435 2.9730 2.9820 2.9930 3.0026 3.5908 3.5912 3.7457 3.7628 3.8433 3.8568 3.9083 3.9960 4.0283 4.0456 4.0872 4.1442 4.2157 4.2637 4.2864 4.3845 4.3866 4.3927 4.5673 4.5882 4.8924 4.9385 4.9416 4.9634 5.2998 5.3309 5.6150 5.6523 5.8051 5.8132 7.5309 7.5457 7.7122 7.7179 8.0064 8.0116 8.1917 8.1925 8.3019 8.3140 11.1350 11.1369 11.6394 11.6584 k = 0.2333 0.5000-0.0000 ( 5944 PWs) bands (ev): -58.2230 -58.2230 -32.6662 -32.6662 -31.8431 -31.8431 -31.8426 -31.8426 -7.1669 -7.1664 -6.7226 -6.7226 -6.4578 -6.4570 -6.3880 -6.3879 0.7429 0.7493 0.9915 0.9939 1.2486 1.2540 1.7090 1.7156 1.9728 1.9769 1.9987 2.0187 2.0497 2.0618 2.3335 2.3412 2.3671 2.3685 2.4171 2.4412 2.9484 2.9590 2.9699 2.9798 3.5960 3.5973 3.7488 3.7673 3.8433 3.8596 3.9132 3.9924 4.0281 4.0485 4.0929 4.1370 4.2294 4.2674 4.2832 4.3715 4.4038 4.4087 4.5683 4.5940 4.8772 4.9242 4.9262 4.9510 5.3268 5.3514 5.5976 5.6350 5.8265 5.8321 7.5425 7.5574 7.7259 7.7322 7.9946 7.9988 8.2055 8.2072 8.3123 8.3247 11.1657 11.1675 11.6992 11.7168 k = 0.2500 0.5000-0.0000 ( 5916 PWs) bands (ev): -58.2230 -58.2230 -32.6662 -32.6662 -31.8431 -31.8431 -31.8426 -31.8426 -7.1537 -7.1531 -6.7176 -6.7176 -6.4719 -6.4711 -6.3926 -6.3925 0.7569 0.7634 0.9923 0.9947 1.2404 1.2458 1.7205 1.7275 1.9663 1.9694 1.9960 2.0176 2.0501 2.0623 2.3224 2.3343 2.3704 2.3721 2.4134 2.4394 2.9241 2.9362 2.9465 2.9567 3.6005 3.6027 3.7523 3.7723 3.8437 3.8621 3.9187 3.9880 4.0297 4.0515 4.0983 4.1292 4.2434 4.2542 4.2989 4.3556 4.4202 4.4287 4.5694 4.6003 4.8615 4.9096 4.9100 4.9375 5.3500 5.3682 5.5803 5.6175 5.8521 5.8550 7.5531 7.5678 7.7415 7.7485 7.9816 7.9849 8.2211 8.2234 8.3225 8.3349 11.1969 11.1985 11.7568 11.7709 k = 0.2667 0.5000-0.0000 ( 5948 PWs) bands (ev): -58.2230 -58.2230 -32.6662 -32.6662 -31.8431 -31.8431 -31.8426 -31.8426 -7.1399 -7.1393 -6.7124 -6.7124 -6.4867 -6.4858 -6.3974 -6.3973 0.7715 0.7781 0.9930 0.9954 1.2312 1.2366 1.7332 1.7404 1.9597 1.9620 1.9940 2.0169 2.0506 2.0627 2.3083 2.3217 2.3768 2.3787 2.4102 2.4383 2.9001 2.9137 2.9231 2.9334 3.6041 3.6074 3.7559 3.7776 3.8439 3.8642 3.9245 3.9828 4.0325 4.0541 4.1033 4.1210 4.2420 4.2567 4.3152 4.3413 4.4356 4.4483 4.5706 4.6067 4.8450 4.8930 4.8943 4.9228 5.3693 5.3814 5.5633 5.6000 5.8812 5.8814 7.5626 7.5769 7.7588 7.7666 7.9679 7.9703 8.2378 8.2405 8.3322 8.3447 11.2282 11.2295 11.8049 11.8122 k = 0.2833 0.5000-0.0000 ( 5948 PWs) bands (ev): -58.2230 -58.2230 -32.6662 -32.6662 -31.8431 -31.8431 -31.8426 -31.8426 -7.1256 -7.1249 -6.7071 -6.7071 -6.5019 -6.5010 -6.4023 -6.4022 0.7867 0.7934 0.9937 0.9961 1.2211 1.2264 1.7471 1.7546 1.9529 1.9547 1.9929 2.0166 2.0511 2.0630 2.2928 2.3067 2.3841 2.3850 2.4084 2.4386 2.8765 2.8916 2.8998 2.9103 3.6073 3.6116 3.7598 3.7831 3.8443 3.8658 3.9307 3.9773 4.0363 4.0561 4.1084 4.1132 4.2319 4.2678 4.3305 4.3315 4.4502 4.4673 4.5720 4.6132 4.8282 4.8753 4.8789 4.9071 5.3850 5.3919 5.5469 5.5826 5.9108 5.9130 7.5711 7.5848 7.7774 7.7861 7.9540 7.9557 8.2550 8.2580 8.3414 8.3538 11.2591 11.2602 11.8283 11.8299 k = 0.3000 0.5000-0.0000 ( 5958 PWs) bands (ev): -58.2230 -58.2230 -32.6662 -32.6662 -31.8431 -31.8431 -31.8427 -31.8427 -7.1109 -7.1102 -6.7018 -6.7018 -6.5174 -6.5165 -6.4072 -6.4071 0.8024 0.8091 0.9944 0.9967 1.2100 1.2151 1.7623 1.7699 1.9462 1.9475 1.9927 2.0169 2.0517 2.0633 2.2762 2.2903 2.3896 2.3901 2.4094 2.4406 2.8535 2.8699 2.8770 2.8873 3.6100 3.6152 3.7640 3.7887 3.8445 3.8669 3.9372 3.9716 4.0407 4.0564 4.1065 4.1137 4.2238 4.2732 4.3268 4.3477 4.4639 4.4856 4.5734 4.6193 4.8109 4.8571 4.8634 4.8908 5.3975 5.3999 5.5312 5.5655 5.9423 5.9463 7.5786 7.5916 7.7970 7.8065 7.9406 7.9414 8.2723 8.2754 8.3500 8.3622 11.2894 11.2901 11.8159 11.8224 k = 0.3167 0.5000-0.0000 ( 5954 PWs) bands (ev): -58.2230 -58.2230 -32.6663 -32.6663 -31.8432 -31.8432 -31.8427 -31.8427 -7.0959 -7.0952 -6.6964 -6.6964 -6.5333 -6.5323 -6.4122 -6.4121 0.8186 0.8252 0.9950 0.9973 1.1981 1.2030 1.7786 1.7863 1.9396 1.9406 1.9933 2.0176 2.0524 2.0636 2.2588 2.2730 2.3913 2.3934 2.4150 2.4448 2.8311 2.8488 2.8547 2.8648 3.6125 3.6184 3.7684 3.7943 3.8447 3.8674 3.9438 3.9660 4.0449 4.0539 4.1025 4.1194 4.2176 4.2701 4.3327 4.3638 4.4769 4.5030 4.5750 4.6249 4.7933 4.8385 4.8480 4.8740 5.4060 5.4074 5.5164 5.5490 5.9749 5.9803 7.5853 7.5974 7.8171 7.8274 7.9279 7.9279 8.2894 8.2926 8.3579 8.3698 11.3185 11.3188 11.7855 11.7925 k = 0.3333 0.5000-0.0000 ( 5952 PWs) bands (ev): -58.2230 -58.2230 -32.6663 -32.6663 -31.8432 -31.8432 -31.8427 -31.8427 -7.0807 -7.0801 -6.6912 -6.6912 -6.5492 -6.5483 -6.4171 -6.4170 0.8353 0.8417 0.9957 0.9979 1.1854 1.1898 1.7961 1.8039 1.9333 1.9340 1.9947 2.0187 2.0532 2.0638 2.2406 2.2547 2.3905 2.3949 2.4236 2.4511 2.8094 2.8284 2.8333 2.8429 3.6148 3.6212 3.7731 3.7996 3.8448 3.8673 3.9505 3.9608 4.0481 4.0484 4.1019 4.1256 4.2130 4.2618 4.3453 4.3797 4.4892 4.5194 4.5767 4.6295 4.7757 4.8197 4.8329 4.8571 5.4107 5.4151 5.5028 5.5332 6.0079 6.0141 7.5912 7.6024 7.8368 7.8482 7.9153 7.9166 8.3059 8.3090 8.3651 8.3766 11.3462 11.3463 11.7472 11.7533 k = 0.3500 0.5000-0.0000 ( 5972 PWs) bands (ev): -58.2230 -58.2230 -32.6663 -32.6663 -31.8432 -31.8432 -31.8427 -31.8427 -7.0656 -7.0650 -6.6860 -6.6860 -6.5651 -6.5642 -6.4220 -6.4219 0.8523 0.8585 0.9963 0.9983 1.1718 1.1758 1.8146 1.8224 1.9272 1.9277 1.9967 2.0201 2.0540 2.0639 2.2217 2.2356 2.3890 2.3950 2.4335 2.4589 2.7887 2.8087 2.8129 2.8218 3.6168 3.6236 3.7779 3.8048 3.8447 3.8666 3.9561 3.9571 4.0395 4.0507 4.1042 4.1324 4.2098 4.2516 4.3608 4.3954 4.5011 4.5346 4.5783 4.6326 4.7579 4.8008 4.8183 4.8403 5.4143 5.4209 5.4904 5.5182 6.0401 6.0468 7.5964 7.6066 7.8549 7.8677 7.9047 7.9075 8.3217 8.3246 8.3716 8.3824 11.3718 11.3723 11.7067 11.7116 k = 0.3667 0.5000-0.0000 ( 5966 PWs) bands (ev): -58.2230 -58.2230 -32.6663 -32.6663 -31.8432 -31.8432 -31.8427 -31.8427 -7.0507 -7.0500 -6.6811 -6.6811 -6.5807 -6.5798 -6.4266 -6.4265 0.8697 0.8756 0.9968 0.9988 1.1575 1.1610 1.8341 1.8419 1.9216 1.9220 1.9992 2.0217 2.0549 2.0640 2.2022 2.2159 2.3874 2.3942 2.4439 2.4676 2.7692 2.7900 2.7937 2.8017 3.6188 3.6257 3.7830 3.8096 3.8445 3.8655 3.9520 3.9636 4.0295 4.0518 4.1085 4.1397 4.2078 4.2412 4.3780 4.4112 4.5126 4.5487 4.5797 4.6339 4.7405 4.7823 4.8044 4.8241 5.4169 5.4254 5.4795 5.5041 6.0711 6.0778 7.6010 7.6102 7.8680 7.8809 7.9006 7.9041 8.3364 8.3391 8.3773 8.3874 11.3954 11.3962 11.6667 11.6705 k = 0.3833 0.5000-0.0000 ( 5960 PWs) bands (ev): -58.2230 -58.2230 -32.6663 -32.6663 -31.8432 -31.8432 -31.8427 -31.8427 -7.0361 -7.0355 -6.6765 -6.6764 -6.5958 -6.5949 -6.4310 -6.4309 0.8874 0.8929 0.9974 0.9992 1.1425 1.1455 1.8545 1.8621 1.9165 1.9169 2.0022 2.0234 2.0559 2.0640 2.1822 2.1956 2.3859 2.3929 2.4544 2.4766 2.7511 2.7724 2.7760 2.7828 3.6207 3.6274 3.7882 3.8140 3.8440 3.8639 3.9488 3.9700 4.0191 4.0514 4.1140 4.1472 4.2065 4.2312 4.3961 4.4268 4.5239 4.5612 4.5812 4.6326 4.7235 4.7644 4.7915 4.8087 5.4188 5.4288 5.4703 5.4912 6.0999 6.1064 7.6051 7.6132 7.8708 7.8781 7.9111 7.9126 8.3500 8.3522 8.3823 8.3914 11.4168 11.4179 11.6289 11.6318 k = 0.4000 0.5000-0.0000 ( 5952 PWs) bands (ev): -58.2230 -58.2230 -32.6663 -32.6663 -31.8432 -31.8432 -31.8427 -31.8427 -7.0223 -7.0217 -6.6722 -6.6721 -6.6101 -6.6093 -6.4350 -6.4350 0.9052 0.9104 0.9978 0.9995 1.1270 1.1294 1.8755 1.8827 1.9121 1.9126 2.0054 2.0250 2.0569 2.0640 2.1616 2.1748 2.3847 2.3914 2.4649 2.4855 2.7348 2.7562 2.7598 2.7653 3.6225 3.6288 3.7936 3.8180 3.8435 3.8620 3.9465 3.9760 4.0089 4.0496 4.1203 4.1545 4.2057 4.2219 4.4148 4.4423 4.5349 4.5702 4.5841 4.6285 4.7074 4.7475 4.7799 4.7945 5.4201 5.4312 5.4627 5.4796 6.1261 6.1321 7.6087 7.6157 7.8669 7.8710 7.9245 7.9284 8.3621 8.3638 8.3867 8.3946 11.4358 11.4370 11.5944 11.5966 k = 0.4167 0.5000-0.0000 ( 5960 PWs) bands (ev): -58.2230 -58.2230 -32.6663 -32.6663 -31.8432 -31.8432 -31.8427 -31.8427 -7.0095 -7.0090 -6.6684 -6.6683 -6.6233 -6.6225 -6.4387 -6.4386 0.9232 0.9279 0.9983 0.9997 1.1110 1.1127 1.8965 1.9016 1.9087 1.9111 2.0087 2.0263 2.0580 2.0637 2.1407 2.1536 2.3837 2.3898 2.4750 2.4938 2.7206 2.7416 2.7455 2.7492 3.6242 3.6299 3.7989 3.8215 3.8429 3.8597 3.9451 3.9807 4.0003 4.0465 4.1271 4.1613 4.2051 4.2134 4.4340 4.4577 4.5456 4.5723 4.5914 4.6213 4.6922 4.7318 4.7699 4.7820 5.4209 5.4327 5.4568 5.4694 6.1492 6.1544 7.6117 7.6176 7.8618 7.8644 7.9387 7.9432 8.3726 8.3737 8.3905 8.3970 11.4521 11.4534 11.5640 11.5655 k = 0.4333 0.5000-0.0000 ( 5952 PWs) bands (ev): -58.2230 -58.2230 -32.6663 -32.6663 -31.8432 -31.8432 -31.8427 -31.8427 -6.9981 -6.9976 -6.6653 -6.6652 -6.6349 -6.6341 -6.4418 -6.4418 0.9413 0.9453 0.9987 1.0000 1.0948 1.0958 1.9036 1.9037 1.9202 1.9272 2.0120 2.0274 2.0591 2.0634 2.1197 2.1324 2.3831 2.3882 2.4845 2.5010 2.7090 2.7288 2.7332 2.7351 3.6258 3.6306 3.8042 3.8242 3.8423 3.8572 3.9449 3.9808 3.9971 4.0424 4.1342 4.1670 4.2046 4.2061 4.4536 4.4730 4.5555 4.5693 4.6008 4.6114 4.6787 4.7173 4.7618 4.7714 5.4215 5.4333 5.4526 5.4609 6.1687 6.1731 7.6144 7.6191 7.8571 7.8588 7.9516 7.9558 8.3813 8.3816 8.3939 8.3988 11.4657 11.4670 11.5384 11.5394 k = 0.4500 0.5000-0.0000 ( 5956 PWs) bands (ev): -58.2230 -58.2230 -32.6663 -32.6663 -31.8433 -31.8433 -31.8427 -31.8427 -6.9885 -6.9881 -6.6630 -6.6628 -6.6444 -6.6437 -6.4443 -6.4443 0.9590 0.9623 0.9991 1.0002 1.0784 1.0787 1.9014 1.9015 1.9415 1.9479 2.0151 2.0281 2.0600 2.0627 2.0990 2.1114 2.3827 2.3867 2.4932 2.5066 2.7003 2.7177 2.7231 2.7236 3.6273 3.6310 3.8092 3.8257 3.8422 3.8545 3.9458 3.9748 4.0007 4.0375 4.1414 4.1705 4.2006 4.2038 4.4733 4.4879 4.5630 4.5633 4.6009 4.6093 4.6678 4.7037 4.7558 4.7631 5.4220 5.4328 5.4497 5.4544 6.1844 6.1877 7.6165 7.6201 7.8533 7.8544 7.9624 7.9658 8.3875 8.3881 8.3971 8.4000 11.4765 11.4776 11.5180 11.5186 k = 0.4667 0.5000-0.0000 ( 5952 PWs) bands (ev): -58.2230 -58.2230 -32.6663 -32.6663 -31.8433 -31.8433 -31.8427 -31.8427 -6.9812 -6.9809 -6.6617 -6.6615 -6.6511 -6.6505 -6.4462 -6.4462 0.9760 0.9784 0.9996 1.0007 1.0622 1.0625 1.8996 1.8996 1.9621 1.9673 2.0179 2.0284 2.0606 2.0615 2.0801 2.0919 2.3827 2.3854 2.5007 2.5103 2.6950 2.7079 2.7154 2.7156 3.6285 3.6311 3.8139 3.8258 3.8429 3.8518 3.9479 3.9677 4.0066 4.0318 4.1485 4.1707 4.1979 4.2027 4.4930 4.5025 4.5549 4.5626 4.5960 4.6144 4.6613 4.6909 4.7520 4.7569 5.4229 5.4313 5.4480 5.4501 6.1959 6.1982 7.6182 7.6206 7.8506 7.8513 7.9705 7.9730 8.3914 8.3926 8.3998 8.4010 11.4842 11.4851 11.5033 11.5036 k = 0.4833 0.5000-0.0000 ( 5932 PWs) bands (ev): -58.2229 -58.2229 -32.6663 -32.6663 -31.8433 -31.8433 -31.8427 -31.8427 -6.9766 -6.9765 -6.6618 -6.6617 -6.6542 -6.6539 -6.4473 -6.4473 0.9901 0.9910 1.0009 1.0022 1.0477 1.0483 1.8985 1.8985 1.9795 1.9826 2.0207 2.0278 2.0581 2.0589 2.0685 2.0763 2.3829 2.3844 2.5065 2.5116 2.6933 2.7002 2.7107 2.7109 3.6296 3.6309 3.8182 3.8245 3.8445 3.8492 3.9512 3.9612 4.0129 4.0258 4.1555 4.1675 4.1980 4.2013 4.5120 4.5161 4.5451 4.5514 4.6004 4.6137 4.6619 4.6790 4.7503 4.7529 5.4243 5.4289 5.4472 5.4479 6.2032 6.2043 7.6195 7.6207 7.8490 7.8493 7.9758 7.9771 8.3937 8.3947 8.4017 8.4019 11.4884 11.4891 11.4948 11.4948 k = 0.5000 0.5000-0.0000 ( 5912 PWs) bands (ev): -58.2229 -58.2229 -32.6663 -32.6663 -31.8433 -31.8433 -31.8427 -31.8427 -6.9750 -6.9750 -6.6622 -6.6622 -6.6548 -6.6548 -6.4477 -6.4477 0.9952 0.9952 1.0041 1.0041 1.0410 1.0410 1.8982 1.8982 1.9881 1.9881 2.0245 2.0245 2.0553 2.0553 2.0687 2.0687 2.3836 2.3836 2.5103 2.5103 2.6952 2.6952 2.7093 2.7093 3.6304 3.6304 3.8218 3.8218 3.8467 3.8467 3.9556 3.9556 4.0194 4.0194 4.1620 4.1620 4.1996 4.1996 4.5246 4.5246 4.5392 4.5392 4.6079 4.6079 4.6688 4.6688 4.7507 4.7507 5.4264 5.4264 5.4471 5.4471 6.2060 6.2060 7.6204 7.6204 7.8486 7.8486 7.9781 7.9781 8.3949 8.3949 8.4023 8.4023 11.4891 11.4891 11.4930 11.4930 k = 0.5000 0.5000-0.0000 ( 5912 PWs) bands (ev): -58.2229 -58.2229 -32.6663 -32.6663 -31.8433 -31.8433 -31.8427 -31.8427 -6.9750 -6.9750 -6.6622 -6.6622 -6.6548 -6.6548 -6.4477 -6.4477 0.9952 0.9952 1.0041 1.0041 1.0410 1.0410 1.8982 1.8982 1.9881 1.9881 2.0245 2.0245 2.0553 2.0553 2.0687 2.0687 2.3836 2.3836 2.5103 2.5103 2.6952 2.6952 2.7093 2.7093 3.6304 3.6304 3.8218 3.8218 3.8467 3.8467 3.9556 3.9556 4.0194 4.0194 4.1620 4.1620 4.1996 4.1996 4.5246 4.5246 4.5392 4.5392 4.6079 4.6079 4.6688 4.6688 4.7507 4.7507 5.4264 5.4264 5.4471 5.4471 6.2060 6.2060 7.6204 7.6204 7.8486 7.8486 7.9781 7.9781 8.3949 8.3949 8.4023 8.4023 11.4891 11.4891 11.4930 11.4930 k = 0.4881 0.4881-0.0000 ( 5940 PWs) bands (ev): -58.2230 -58.2230 -32.6663 -32.6663 -31.8433 -31.8433 -31.8427 -31.8427 -6.9766 -6.9765 -6.6617 -6.6616 -6.6543 -6.6540 -6.4473 -6.4473 0.9906 0.9910 1.0003 1.0017 1.0479 1.0486 1.8985 1.8985 1.9795 1.9823 2.0198 2.0285 2.0584 2.0590 2.0698 2.0750 2.3829 2.3844 2.5065 2.5115 2.6933 2.7000 2.7106 2.7112 3.6296 3.6309 3.8181 3.8245 3.8444 3.8492 3.9511 3.9613 4.0129 4.0258 4.1553 4.1676 4.1977 4.2015 4.5130 4.5145 4.5459 4.5510 4.6003 4.6137 4.6618 4.6791 4.7503 4.7529 5.4243 5.4290 5.4472 5.4478 6.2031 6.2043 7.6195 7.6207 7.8490 7.8493 7.9758 7.9771 8.3935 8.3948 8.4017 8.4020 11.4863 11.4867 11.4970 11.4973 k = 0.4762 0.4762-0.0000 ( 5960 PWs) bands (ev): -58.2230 -58.2230 -32.6663 -32.6663 -31.8433 -31.8433 -31.8427 -31.8427 -6.9814 -6.9811 -6.6600 -6.6598 -6.6527 -6.6520 -6.4462 -6.4461 0.9779 0.9797 0.9967 0.9977 1.0634 1.0638 1.8995 1.8997 1.9619 1.9666 2.0143 2.0299 2.0626 2.0671 2.0816 2.0856 2.3826 2.3855 2.5011 2.5103 2.6947 2.7051 2.7154 2.7187 3.6285 3.6311 3.8136 3.8263 3.8425 3.8519 3.9476 3.9679 4.0067 4.0317 4.1480 4.1716 4.1957 4.2044 4.4943 4.4998 4.5575 4.5618 4.5954 4.6143 4.6615 4.6914 4.7519 4.7569 5.4227 5.4319 5.4483 5.4494 6.1957 6.1980 7.6182 7.6206 7.8506 7.8513 7.9704 7.9729 8.3893 8.3927 8.4005 8.4020 11.4740 11.4746 11.5136 11.5143 k = 0.4643 0.4643-0.0000 ( 5952 PWs) bands (ev): -58.2230 -58.2230 -32.6663 -32.6663 -31.8433 -31.8433 -31.8427 -31.8427 -6.9891 -6.9887 -6.6574 -6.6571 -6.6496 -6.6487 -6.4443 -6.4442 0.9628 0.9654 0.9923 0.9930 1.0820 1.0821 1.9004 1.9016 1.9405 1.9472 2.0085 2.0283 2.0685 2.0765 2.0972 2.0994 2.3826 2.3870 2.4951 2.5073 2.6980 2.7094 2.7244 2.7320 3.6273 3.6310 3.8086 3.8276 3.8410 3.8545 3.9453 3.9751 4.0016 4.0368 4.1400 4.1733 4.1934 4.2093 4.4746 4.4842 4.5623 4.5678 4.5990 4.6088 4.6686 4.7050 4.7554 4.7628 5.4217 5.4351 5.4505 5.4518 6.1841 6.1875 7.6165 7.6201 7.8533 7.8545 7.9622 7.9657 8.3818 8.3871 8.4006 8.4028 11.4538 11.4546 11.5414 11.5424 k = 0.4524 0.4524-0.0000 ( 5960 PWs) bands (ev): -58.2230 -58.2230 -32.6663 -32.6663 -31.8432 -31.8432 -31.8427 -31.8427 -6.9994 -6.9989 -6.6542 -6.6538 -6.6452 -6.6440 -6.4417 -6.4416 0.9470 0.9502 0.9865 0.9871 1.1019 1.1025 1.8985 1.9029 1.9186 1.9293 2.0028 2.0249 2.0767 2.0854 2.1128 2.1142 2.3828 2.3888 2.4896 2.5036 2.7021 2.7138 2.7375 2.7489 3.6258 3.6307 3.8033 3.8282 3.8395 3.8567 3.9437 3.9808 3.9996 4.0409 4.1315 4.1725 4.1907 4.2165 4.4546 4.4682 4.5547 4.5755 4.6005 4.6085 4.6806 4.7199 4.7607 4.7703 5.4213 5.4386 5.4535 5.4548 6.1683 6.1727 7.6144 7.6192 7.8571 7.8588 7.9514 7.9556 8.3714 8.3782 8.4016 8.4043 11.4266 11.4276 11.5795 11.5806 k = 0.4405 0.4405-0.0000 ( 5960 PWs) bands (ev): -58.2230 -58.2230 -32.6663 -32.6663 -31.8432 -31.8432 -31.8427 -31.8427 -7.0121 -7.0116 -6.6503 -6.6498 -6.6395 -6.6381 -6.4384 -6.4383 0.9311 0.9348 0.9792 0.9797 1.1230 1.1242 1.8862 1.8890 1.9119 1.9215 1.9975 2.0209 2.0864 2.0942 2.1274 2.1283 2.3833 2.3911 2.4856 2.5002 2.7067 2.7190 2.7542 2.7682 3.6243 3.6300 3.7978 3.8286 3.8381 3.8586 3.9429 3.9814 4.0039 4.0438 4.1226 4.1694 4.1878 4.2260 4.4348 4.4521 4.5445 4.5769 4.5953 4.6183 4.6954 4.7362 4.7677 4.7791 5.4213 5.4423 5.4574 5.4585 6.1489 6.1543 7.6118 7.6178 7.8616 7.8642 7.9387 7.9432 8.3584 8.3667 8.4030 8.4061 11.3931 11.3943 11.6270 11.6278 k = 0.4286 0.4286-0.0000 ( 5962 PWs) bands (ev): -58.2230 -58.2230 -32.6663 -32.6663 -31.8432 -31.8432 -31.8427 -31.8427 -7.0268 -7.0263 -6.6459 -6.6453 -6.6328 -6.6312 -6.4346 -6.4345 0.9150 0.9192 0.9702 0.9707 1.1453 1.1471 1.8643 1.8643 1.9163 1.9233 1.9927 2.0168 2.0970 2.1032 2.1402 2.1408 2.3842 2.3938 2.4840 2.4983 2.7120 2.7250 2.7735 2.7891 3.6228 3.6290 3.7923 3.8287 3.8367 3.8601 3.9426 3.9787 4.0124 4.0454 4.1133 4.1645 4.1850 4.2372 4.4153 4.4359 4.5336 4.5688 4.5971 4.6264 4.7120 4.7535 4.7764 4.7890 5.4218 5.4465 5.4616 5.4627 6.1263 6.1324 7.6090 7.6161 7.8664 7.8705 7.9248 7.9289 8.3432 8.3528 8.4046 8.4081 11.3543 11.3555 11.6826 11.6829 k = 0.4167 0.4167-0.0000 ( 5958 PWs) bands (ev): -58.2230 -58.2230 -32.6663 -32.6663 -31.8432 -31.8432 -31.8427 -31.8427 -7.0433 -7.0427 -6.6409 -6.6401 -6.6253 -6.6235 -6.4304 -6.4303 0.8988 0.9033 0.9597 0.9602 1.1686 1.1710 1.8383 1.8394 1.9224 1.9285 1.9884 2.0128 2.1084 2.1125 2.1510 2.1512 2.3855 2.3970 2.4853 2.4986 2.7180 2.7318 2.7946 2.8111 3.6213 3.6279 3.7868 3.8287 3.8352 3.8610 3.9429 3.9755 4.0218 4.0458 4.1037 4.1580 4.1827 4.2496 4.3966 4.4198 4.5224 4.5569 4.6009 4.6325 4.7299 4.7714 4.7872 4.8000 5.4224 5.4513 5.4659 5.4674 6.1010 6.1077 7.6058 7.6140 7.8700 7.8771 7.9117 7.9135 8.3262 8.3371 8.4062 8.4100 11.3107 11.3120 11.7439 11.7446 k = 0.4048 0.4048-0.0000 ( 5962 PWs) bands (ev): -58.2230 -58.2230 -32.6663 -32.6663 -31.8432 -31.8432 -31.8427 -31.8427 -7.0612 -7.0606 -6.6352 -6.6343 -6.6171 -6.6153 -6.4258 -6.4256 0.8823 0.8871 0.9477 0.9483 1.1930 1.1959 1.8117 1.8134 1.9298 1.9353 1.9846 2.0090 2.1205 2.1220 2.1594 2.1595 2.3871 2.4006 2.4900 2.5017 2.7248 2.7393 2.8170 2.8339 3.6198 3.6264 3.7813 3.8285 3.8335 3.8616 3.9435 3.9725 4.0303 4.0451 4.0941 4.1502 4.1817 4.2624 4.3793 4.4039 4.5113 4.5440 4.6042 4.6366 4.7487 4.7878 4.8013 4.8118 5.4229 5.4566 5.4699 5.4726 6.0735 6.0808 7.6024 7.6116 7.8681 7.8810 7.9005 7.9039 8.3078 8.3198 8.4077 8.4116 11.2630 11.2643 11.8089 11.8109 k = 0.3929 0.3929-0.0000 ( 5970 PWs) bands (ev): -58.2230 -58.2230 -32.6663 -32.6663 -31.8432 -31.8432 -31.8427 -31.8427 -7.0804 -7.0798 -6.6289 -6.6279 -6.6086 -6.6067 -6.4210 -6.4208 0.8654 0.8705 0.9342 0.9348 1.2183 1.2217 1.7849 1.7867 1.9382 1.9431 1.9813 2.0054 2.1319 2.1330 2.1654 2.1659 2.3893 2.4048 2.4983 2.5080 2.7322 2.7475 2.8402 2.8572 3.6185 3.6248 3.7759 3.8284 3.8317 3.8619 3.9444 3.9699 4.0364 4.0437 4.0846 4.1410 4.1826 4.2742 4.3646 4.3883 4.5003 4.5305 4.6069 4.6390 4.7680 4.8014 4.8199 4.8244 5.4231 5.4625 5.4733 5.4782 6.0448 6.0523 7.5988 7.6090 7.8567 7.8709 7.9014 7.9054 8.2883 8.3014 8.4088 8.4130 11.2117 11.2129 11.8750 11.8788 k = 0.3810 0.3810-0.0000 ( 5974 PWs) bands (ev): -58.2230 -58.2230 -32.6663 -32.6663 -31.8432 -31.8432 -31.8427 -31.8427 -7.1005 -7.0999 -6.6220 -6.6209 -6.5997 -6.5977 -6.4160 -6.4158 0.8481 0.8534 0.9193 0.9200 1.2446 1.2485 1.7578 1.7596 1.9476 1.9516 1.9786 2.0020 2.1419 2.1460 2.1696 2.1705 2.3919 2.4095 2.5100 2.5175 2.7403 2.7563 2.8640 2.8809 3.6174 3.6229 3.7704 3.8282 3.8298 3.8619 3.9456 3.9679 4.0393 4.0417 4.0754 4.1307 4.1861 4.2822 4.3553 4.3730 4.4895 4.5168 4.6090 4.6399 4.7871 4.8136 4.8382 4.8410 5.4223 5.4681 5.4765 5.4843 6.0154 6.0230 7.5951 7.6062 7.8402 7.8531 7.9100 7.9123 8.2681 8.2821 8.4096 8.4139 11.1571 11.1582 11.9388 11.9446 k = 0.3690 0.3690-0.0000 ( 5970 PWs) bands (ev): -58.2230 -58.2230 -32.6662 -32.6662 -31.8431 -31.8431 -31.8427 -31.8427 -7.1214 -7.1209 -6.6145 -6.6133 -6.5904 -6.5884 -6.4110 -6.4107 0.8304 0.8358 0.9031 0.9039 1.2716 1.2760 1.7306 1.7324 1.9578 1.9597 1.9772 1.9988 2.1519 2.1586 2.1732 2.1743 2.3951 2.4146 2.5249 2.5301 2.7491 2.7658 2.8882 2.9047 3.6165 3.6208 3.7650 3.8277 3.8280 3.8618 3.9470 3.9663 4.0383 4.0393 4.0667 4.1194 4.1924 4.2822 4.3551 4.3585 4.4789 4.5029 4.6107 4.6395 4.8053 4.8253 4.8536 4.8635 5.4200 5.4706 5.4819 5.4911 5.9863 5.9938 7.5913 7.6033 7.8218 7.8339 7.9202 7.9213 8.2478 8.2625 8.4098 8.4142 11.0996 11.1006 11.9955 12.0033 k = 0.3571 0.3571-0.0000 ( 5974 PWs) bands (ev): -58.2230 -58.2230 -32.6662 -32.6662 -31.8431 -31.8431 -31.8427 -31.8427 -7.1430 -7.1424 -6.6065 -6.6051 -6.5810 -6.5790 -6.4059 -6.4056 0.8121 0.8176 0.8856 0.8864 1.2994 1.3042 1.7035 1.7051 1.9647 1.9685 1.9795 1.9958 2.1606 2.1682 2.1777 2.1809 2.3987 2.4202 2.5426 2.5455 2.7586 2.7759 2.9125 2.9284 3.6157 3.6186 3.7595 3.8255 3.8278 3.8616 3.9483 3.9651 4.0335 4.0368 4.0585 4.1071 4.2011 4.2741 4.3450 4.3640 4.4684 4.4890 4.6121 4.6384 4.8218 4.8367 4.8712 4.8869 5.4155 5.4686 5.4902 5.4986 5.9581 5.9653 7.5876 7.6003 7.8027 7.8143 7.9311 7.9312 8.2277 8.2428 8.4095 8.4139 11.0395 11.0402 12.0094 12.0191 k = 0.3452 0.3452-0.0000 ( 5966 PWs) bands (ev): -58.2230 -58.2230 -32.6662 -32.6662 -31.8431 -31.8431 -31.8427 -31.8427 -7.1649 -7.1645 -6.5979 -6.5964 -6.5714 -6.5693 -6.4010 -6.4006 0.7933 0.7987 0.8669 0.8678 1.3278 1.3330 1.6764 1.6778 1.9650 1.9793 1.9866 1.9929 2.1666 2.1722 2.1855 2.1933 2.4029 2.4263 2.5629 2.5636 2.7686 2.7864 2.9368 2.9521 3.6152 3.6162 3.7540 3.8232 3.8274 3.8616 3.9496 3.9641 4.0256 4.0343 4.0510 4.0943 4.2110 4.2615 4.3333 4.3781 4.4580 4.4751 4.6135 4.6367 4.8361 4.8476 4.8914 4.9110 5.4083 5.4629 5.5000 5.5069 5.9318 5.9385 7.5840 7.5973 7.7835 7.7946 7.9413 7.9422 8.2083 8.2236 8.4084 8.4129 10.9769 10.9773 11.9619 11.9719 k = 0.3333 0.3333-0.0000 ( 5960 PWs) bands (ev): -58.2230 -58.2230 -32.6662 -32.6662 -31.8431 -31.8431 -31.8427 -31.8426 -7.1872 -7.1868 -6.5888 -6.5872 -6.5616 -6.5595 -6.3962 -6.3958 0.7739 0.7793 0.8471 0.8481 1.3567 1.3622 1.6494 1.6506 1.9634 1.9895 1.9902 1.9952 2.1707 2.1747 2.1966 2.2082 2.4076 2.4327 2.5839 2.5852 2.7793 2.7975 2.9608 2.9754 3.6135 3.6147 3.7487 3.8209 3.8270 3.8618 3.9505 3.9633 4.0150 4.0316 4.0443 4.0811 4.2200 4.2472 4.3247 4.3939 4.4474 4.4616 4.6150 4.6347 4.8482 4.8580 4.9141 4.9359 5.3977 5.4535 5.5110 5.5162 5.9079 5.9141 7.5805 7.5944 7.7646 7.7751 7.9512 7.9531 8.1902 8.2052 8.4066 8.4111 10.9120 10.9121 11.9147 11.9247 k = 0.3214 0.3214-0.0000 ( 5964 PWs) bands (ev): -58.2230 -58.2230 -32.6662 -32.6662 -31.8430 -31.8430 -31.8426 -31.8426 -7.2097 -7.2093 -6.5792 -6.5776 -6.5516 -6.5495 -6.3916 -6.3912 0.7540 0.7593 0.8263 0.8274 1.3860 1.3917 1.6228 1.6236 1.9613 1.9871 1.9991 2.0032 2.1753 2.1781 2.2095 2.2241 2.4127 2.4395 2.6061 2.6094 2.7904 2.8091 2.9846 2.9984 3.6106 3.6142 3.7435 3.8186 3.8264 3.8623 3.9507 3.9624 4.0022 4.0288 4.0387 4.0684 4.2256 4.2323 4.3211 4.4083 4.4366 4.4504 4.6168 4.6329 4.8585 4.8678 4.9387 4.9614 5.3835 5.4401 5.5228 5.5265 5.8869 5.8926 7.5773 7.5916 7.7459 7.7560 7.9602 7.9635 8.1739 8.1883 8.4039 8.4085 10.8448 10.8451 11.8684 11.8781 k = 0.3095 0.3095-0.0000 ( 5970 PWs) bands (ev): -58.2230 -58.2230 -32.6662 -32.6662 -31.8430 -31.8430 -31.8426 -31.8426 -7.2322 -7.2319 -6.5693 -6.5676 -6.5416 -6.5395 -6.3873 -6.3868 0.7336 0.7388 0.8046 0.8058 1.4154 1.4212 1.5965 1.5969 1.9590 1.9843 2.0069 2.0097 2.1817 2.1835 2.2235 2.2407 2.4182 2.4465 2.6301 2.6350 2.8021 2.8210 3.0079 3.0209 3.6074 3.6133 3.7387 3.8162 3.8255 3.8633 3.9498 3.9614 3.9877 4.0252 4.0345 4.0571 4.2175 4.2257 4.3241 4.4133 4.4254 4.4488 4.6190 4.6314 4.8674 4.8768 4.9650 4.9876 5.3656 5.4227 5.5353 5.5376 5.8690 5.8744 7.5745 7.5890 7.7278 7.7374 7.9678 7.9726 8.1602 8.1735 8.4005 8.4051 10.7755 10.7761 11.8234 11.8327 k = 0.2976 0.2976-0.0000 ( 5952 PWs) bands (ev): -58.2230 -58.2230 -32.6661 -32.6661 -31.8430 -31.8430 -31.8426 -31.8426 -7.2547 -7.2544 -6.5590 -6.5572 -6.5315 -6.5294 -6.3833 -6.3828 0.7129 0.7179 0.7821 0.7834 1.4448 1.4504 1.5708 1.5710 1.9566 1.9815 2.0126 2.0143 2.1907 2.1917 2.2385 2.2578 2.4243 2.4538 2.6555 2.6619 2.8144 2.8335 3.0307 3.0429 3.6039 3.6120 3.7349 3.8138 3.8244 3.8649 3.9471 3.9603 3.9717 4.0206 4.0318 4.0486 4.2030 4.2204 4.3333 4.4045 4.4139 4.4608 4.6218 4.6304 4.8752 4.8852 4.9927 5.0147 5.3443 5.4015 5.5485 5.5495 5.8542 5.8594 7.5719 7.5866 7.7103 7.7194 7.9732 7.9800 8.1498 8.1614 8.3962 8.4008 10.7043 10.7053 11.7801 11.7888 k = 0.2857 0.2857-0.0000 ( 5944 PWs) bands (ev): -58.2230 -58.2230 -32.6661 -32.6661 -31.8429 -31.8429 -31.8426 -31.8426 -7.2770 -7.2767 -6.5484 -6.5466 -6.5213 -6.5192 -6.3796 -6.3790 0.6918 0.6966 0.7590 0.7603 1.4734 1.4781 1.5457 1.5474 1.9541 1.9786 2.0159 2.0166 2.2025 2.2028 2.2542 2.2755 2.4306 2.4612 2.6822 2.6900 2.8271 2.8464 3.0528 3.0642 3.6000 3.6098 3.7321 3.8112 3.8230 3.8672 3.9417 3.9539 3.9594 4.0153 4.0305 4.0434 4.1891 4.2114 4.3463 4.3905 4.4024 4.4774 4.6253 4.6303 4.8822 4.8929 5.0214 5.0424 5.3200 5.3770 5.5618 5.5620 5.8422 5.8473 7.5698 7.5844 7.6935 7.7021 7.9760 7.9850 8.1434 8.1527 8.3912 8.3956 10.6314 10.6328 11.7387 11.7467 k = 0.2738 0.2738-0.0000 ( 5942 PWs) bands (ev): -58.2230 -58.2230 -32.6661 -32.6661 -31.8429 -31.8429 -31.8426 -31.8426 -7.2991 -7.2988 -6.5375 -6.5357 -6.5111 -6.5091 -6.3761 -6.3756 0.6704 0.6751 0.7353 0.7367 1.4960 1.4965 1.5265 1.5338 1.9516 1.9756 2.0168 2.0168 2.2168 2.2169 2.2705 2.2935 2.4373 2.4688 2.7099 2.7189 2.8404 2.8597 3.0741 3.0847 3.5957 3.6065 3.7308 3.8082 3.8213 3.8702 3.9330 3.9360 3.9578 4.0108 4.0306 4.0407 4.1759 4.2004 4.3591 4.3750 4.3931 4.4949 4.6297 4.6312 4.8885 4.8999 5.0512 5.0708 5.2933 5.3496 5.5746 5.5758 5.8327 5.8377 7.5681 7.5824 7.6773 7.6854 7.9760 7.9870 8.1411 8.1481 8.3853 8.3897 10.5570 10.5586 11.6994 11.7067 k = 0.2619 0.2619-0.0000 ( 5942 PWs) bands (ev): -58.2230 -58.2230 -32.6661 -32.6661 -31.8429 -31.8429 -31.8426 -31.8426 -7.3209 -7.3206 -6.5265 -6.5246 -6.5009 -6.4989 -6.3731 -6.3725 0.6490 0.6534 0.7112 0.7127 1.4847 1.4875 1.5397 1.5495 1.9490 1.9726 2.0152 2.0156 2.2334 2.2337 2.2874 2.3118 2.4442 2.4763 2.7386 2.7486 2.8542 2.8735 3.0946 3.1043 3.5908 3.6018 3.7313 3.8048 3.8192 3.8739 3.9173 3.9213 3.9563 4.0080 4.0318 4.0395 4.1637 4.1883 4.3588 4.3617 4.3947 4.5124 4.6331 4.6349 4.8942 4.9062 5.0819 5.0999 5.2648 5.3201 5.5875 5.5897 5.8250 5.8300 7.5668 7.5807 7.6619 7.6696 7.9735 7.9862 8.1426 8.1474 8.3786 8.3829 10.4811 10.4830 11.6624 11.6688 k = 0.2500 0.2500-0.0000 ( 5942 PWs) bands (ev): -58.2230 -58.2230 -32.6661 -32.6661 -31.8428 -31.8428 -31.8426 -31.8426 -7.3422 -7.3420 -6.5153 -6.5134 -6.4908 -6.4888 -6.3703 -6.3697 0.6275 0.6316 0.6869 0.6884 1.4628 1.4647 1.5667 1.5760 1.9463 1.9696 2.0122 2.0127 2.2520 2.2522 2.3048 2.3304 2.4514 2.4839 2.7680 2.7789 2.8686 2.8878 3.1141 3.1230 3.5854 3.5957 3.7335 3.8004 3.8166 3.8780 3.8987 3.9076 3.9548 4.0068 4.0341 4.0389 4.1527 4.1759 4.3422 4.3514 4.4095 4.5293 4.6361 4.6411 4.8994 4.9119 5.1135 5.1293 5.2356 5.2892 5.6003 5.6033 5.8187 5.8237 7.5658 7.5791 7.6474 7.6545 7.9693 7.9832 8.1472 8.1502 8.3713 8.3755 10.4039 10.4061 11.6277 11.6333 k = 0.2381 0.2381-0.0000 ( 5926 PWs) bands (ev): -58.2230 -58.2230 -32.6661 -32.6661 -31.8428 -31.8428 -31.8426 -31.8426 -7.3630 -7.3628 -6.5041 -6.5022 -6.4807 -6.4788 -6.3679 -6.3673 0.6061 0.6100 0.6624 0.6640 1.4396 1.4410 1.5948 1.6038 1.9437 1.9665 2.0081 2.0087 2.2721 2.2722 2.3226 2.3490 2.4588 2.4913 2.7981 2.8096 2.8836 2.9025 3.1326 3.1408 3.5794 3.5883 3.7376 3.7946 3.8130 3.8762 3.8872 3.8935 3.9537 4.0066 4.0373 4.0388 4.1432 4.1635 4.3255 4.3374 4.4282 4.5458 4.6402 4.6484 4.9043 4.9171 5.1459 5.1573 5.2080 5.2576 5.6129 5.6167 5.8134 5.8183 7.5651 7.5776 7.6336 7.6402 7.9646 7.9788 8.1540 8.1557 8.3634 8.3674 10.3255 10.3279 11.5956 11.6003 k = 0.2262 0.2262-0.0000 ( 5932 PWs) bands (ev): -58.2230 -58.2230 -32.6660 -32.6660 -31.8428 -31.8428 -31.8426 -31.8426 -7.3832 -7.3830 -6.4928 -6.4909 -6.4707 -6.4688 -6.3658 -6.3651 0.5849 0.5885 0.6379 0.6395 1.4166 1.4177 1.6226 1.6314 1.9410 1.9634 2.0033 2.0037 2.2928 2.2933 2.3407 2.3676 2.4662 2.4987 2.8286 2.8406 2.8993 2.9177 3.1500 3.1574 3.5727 3.5796 3.7431 3.7867 3.8072 3.8607 3.8801 3.8914 3.9527 4.0067 4.0388 4.0410 4.1353 4.1512 4.3087 4.3220 4.4482 4.5615 4.6454 4.6567 4.9088 4.9216 5.1635 5.1778 5.2028 5.2267 5.6250 5.6295 5.8087 5.8133 7.5645 7.5760 7.6206 7.6267 7.9602 7.9741 8.1622 8.1630 8.3550 8.3588 10.2462 10.2487 11.5660 11.5698 k = 0.2143 0.2143-0.0000 ( 5938 PWs) bands (ev): -58.2230 -58.2230 -32.6660 -32.6660 -31.8428 -31.8428 -31.8425 -31.8425 -7.4028 -7.4027 -6.4816 -6.4798 -6.4609 -6.4591 -6.3639 -6.3633 0.5640 0.5674 0.6136 0.6152 1.3940 1.3948 1.6497 1.6585 1.9383 1.9602 1.9981 1.9982 2.3139 2.3150 2.3589 2.3860 2.4738 2.5058 2.8593 2.8718 2.9157 2.9335 3.1662 3.1729 3.5655 3.5700 3.7496 3.7760 3.7974 3.8472 3.8689 3.8978 3.9521 4.0063 4.0391 4.0453 4.1294 4.1394 4.2921 4.3060 4.4688 4.5764 4.6516 4.6660 4.9131 4.9256 5.1381 5.1872 5.2192 5.2302 5.6365 5.6416 5.8041 5.8085 7.5639 7.5742 7.6084 7.6141 7.9569 7.9701 8.1710 8.1712 8.3461 8.3498 10.1660 10.1686 11.5389 11.5419 k = 0.2024 0.2024-0.0000 ( 5936 PWs) bands (ev): -58.2230 -58.2230 -32.6660 -32.6660 -31.8427 -31.8427 -31.8425 -31.8425 -7.4217 -7.4216 -6.4705 -6.4687 -6.4513 -6.4495 -6.3624 -6.3618 0.5435 0.5467 0.5895 0.5912 1.3720 1.3727 1.6761 1.6848 1.9357 1.9571 1.9923 1.9925 2.3351 2.3369 2.3772 2.4041 2.4814 2.5127 2.8900 2.9029 2.9329 2.9498 3.1813 3.1873 3.5576 3.5595 3.7536 3.7655 3.7823 3.8384 3.8606 3.9049 3.9519 4.0047 4.0401 4.0498 4.1256 4.1280 4.2756 4.2899 4.4899 4.5908 4.6588 4.6763 4.9172 4.9291 5.1092 5.1583 5.2508 5.2623 5.6470 5.6527 5.7996 5.8035 7.5632 7.5722 7.5971 7.6023 7.9554 7.9676 8.1797 8.1799 8.3370 8.3404 10.0851 10.0877 11.5145 11.5167 k = 0.1905 0.1905-0.0000 ( 5940 PWs) bands (ev): -58.2230 -58.2230 -32.6660 -32.6660 -31.8427 -31.8427 -31.8425 -31.8425 -7.4398 -7.4397 -6.4597 -6.4579 -6.4419 -6.4402 -6.3611 -6.3605 0.5237 0.5266 0.5659 0.5676 1.3508 1.3514 1.7016 1.7101 1.9331 1.9539 1.9863 1.9869 2.3560 2.3586 2.3954 2.4218 2.4890 2.5194 2.9205 2.9338 2.9511 2.9668 3.1952 3.2006 3.5484 3.5492 3.7409 3.7629 3.7692 3.8334 3.8552 3.9122 3.9522 4.0014 4.0421 4.0546 4.1174 4.1237 4.2595 4.2738 4.5114 4.6046 4.6667 4.6875 4.9210 4.9319 5.0808 5.1276 5.2855 5.2956 5.6566 5.6628 5.7948 5.7983 7.5622 7.5697 7.5867 7.5913 7.9562 7.9670 8.1881 8.1886 8.3276 8.3309 10.0037 10.0063 11.4927 11.4941 k = 0.1786 0.1786-0.0000 ( 5938 PWs) bands (ev): -58.2230 -58.2230 -32.6660 -32.6660 -31.8427 -31.8427 -31.8425 -31.8425 -7.4571 -7.4570 -6.4490 -6.4473 -6.4328 -6.4312 -6.3600 -6.3594 0.5044 0.5071 0.5429 0.5445 1.3305 1.3309 1.7260 1.7343 1.9305 1.9507 1.9803 1.9813 2.3766 2.3799 2.4135 2.4389 2.4966 2.5257 2.9501 2.9643 2.9708 2.9843 3.2080 3.2127 3.5368 3.5401 3.7211 3.7409 3.7775 3.8305 3.8525 3.9195 3.9531 3.9967 4.0451 4.0593 4.1078 4.1236 4.2437 4.2579 4.5333 4.6180 4.6754 4.6994 4.9244 4.9339 5.0537 5.0976 5.3208 5.3294 5.6650 5.6717 5.7898 5.7927 7.5607 7.5667 7.5770 7.5812 7.9598 7.9691 8.1961 8.1967 8.3182 8.3213 9.9221 9.9245 11.4736 11.4742 k = 0.1667 0.1667-0.0000 ( 5928 PWs) bands (ev): -58.2230 -58.2230 -32.6660 -32.6660 -31.8426 -31.8426 -31.8425 -31.8425 -7.4735 -7.4734 -6.4387 -6.4371 -6.4241 -6.4225 -6.3592 -6.3586 0.4860 0.4884 0.5206 0.5222 1.3110 1.3114 1.7494 1.7574 1.9280 1.9476 1.9744 1.9758 2.3964 2.4006 2.4313 2.4552 2.5041 2.5317 2.9776 2.9931 2.9943 3.0026 3.2196 3.2237 3.5249 3.5307 3.6990 3.7174 3.7861 3.8289 3.8520 3.9263 3.9547 3.9908 4.0490 4.0638 4.0993 4.1248 4.2285 4.2425 4.5555 4.6310 4.6847 4.7118 4.9274 4.9346 5.0288 5.0690 5.3564 5.3635 5.6721 5.6792 5.7845 5.7868 7.5586 7.5629 7.5685 7.5719 7.9663 7.9741 8.2034 8.2041 8.3089 8.3118 9.8404 9.8427 11.4570 11.4570 k = 0.1548 0.1548-0.0000 ( 5936 PWs) bands (ev): -58.2230 -58.2230 -32.6659 -32.6659 -31.8426 -31.8426 -31.8425 -31.8425 -7.4890 -7.4889 -6.4288 -6.4272 -6.4157 -6.4142 -6.3585 -6.3580 0.4683 0.4706 0.4992 0.5007 1.2926 1.2929 1.7714 1.7792 1.9256 1.9444 1.9688 1.9705 2.4153 2.4203 2.4486 2.4707 2.5117 2.5373 3.0018 3.0190 3.0211 3.0241 3.2300 3.2336 3.5128 3.5206 3.6754 3.6928 3.7942 3.8278 3.8534 3.9321 3.9571 3.9843 4.0533 4.0674 4.0925 4.1271 4.2136 4.2277 4.5778 4.6437 4.6945 4.7247 4.9295 4.9330 5.0071 5.0422 5.3917 5.3975 5.6777 5.6852 5.7789 5.7805 7.5558 7.5578 7.5614 7.5634 7.9760 7.9822 8.2098 8.2105 8.2998 8.3024 9.7590 9.7611 11.4423 11.4429 k = 0.1429 0.1429-0.0000 ( 5928 PWs) bands (ev): -58.2230 -58.2230 -32.6659 -32.6659 -31.8426 -31.8426 -31.8425 -31.8425 -7.5035 -7.5035 -6.4193 -6.4178 -6.4077 -6.4062 -6.3580 -6.3575 0.4517 0.4537 0.4787 0.4802 1.2752 1.2755 1.7921 1.7996 1.9234 1.9413 1.9635 1.9655 2.4332 2.4389 2.4654 2.4852 2.5192 2.5426 3.0244 3.0408 3.0467 3.0525 3.2394 3.2425 3.5005 3.5102 3.6508 3.6676 3.8013 3.8271 3.8567 3.9368 3.9602 3.9774 4.0580 4.0694 4.0884 4.1301 4.1995 4.2139 4.6003 4.6562 4.7047 4.7379 4.9278 4.9303 4.9904 5.0180 5.4266 5.4312 5.6819 5.6896 5.7731 5.7741 7.5514 7.5523 7.5559 7.5560 7.9888 7.9936 8.2153 8.2160 8.2910 8.2934 9.6781 9.6800 11.4302 11.4313 k = 0.1310 0.1310-0.0000 ( 5938 PWs) bands (ev): -58.2230 -58.2230 -32.6659 -32.6659 -31.8426 -31.8426 -31.8425 -31.8425 -7.5170 -7.5170 -6.4103 -6.4089 -6.4001 -6.3988 -6.3577 -6.3571 0.4360 0.4379 0.4593 0.4607 1.2590 1.2591 1.8114 1.8184 1.9212 1.9381 1.9586 1.9609 2.4499 2.4562 2.4815 2.4986 2.5267 2.5475 3.0467 3.0609 3.0747 3.0802 3.2478 3.2504 3.4880 3.4993 3.6255 3.6418 3.8073 3.8266 3.8616 3.9403 3.9635 3.9706 4.0628 4.0693 4.0874 4.1336 4.1859 4.2011 4.6226 4.6683 4.7151 4.7510 4.9177 4.9283 4.9801 4.9979 5.4606 5.4641 5.6845 5.6923 5.7673 5.7677 7.5449 7.5474 7.5500 7.5510 8.0047 8.0083 8.2197 8.2203 8.2827 8.2849 9.5983 9.5998 11.4205 11.4221 k = 0.1190 0.1190-0.0000 ( 5944 PWs) bands (ev): -58.2230 -58.2230 -32.6659 -32.6659 -31.8425 -31.8425 -31.8425 -31.8425 -7.5295 -7.5295 -6.4019 -6.4007 -6.3930 -6.3918 -6.3574 -6.3569 0.4215 0.4231 0.4412 0.4425 1.2439 1.2440 1.8292 1.8358 1.9192 1.9349 1.9543 1.9567 2.4653 2.4719 2.4968 2.5110 2.5342 2.5520 3.0695 3.0817 3.1021 3.1069 3.2552 3.2574 3.4755 3.4879 3.5997 3.6156 3.8120 3.8262 3.8679 3.9429 3.9641 3.9663 4.0676 4.0681 4.0884 4.1374 4.1729 4.1897 4.6444 4.6800 4.7256 4.7641 4.9038 4.9220 4.9753 4.9837 5.4934 5.4961 5.6857 5.6932 5.7615 5.7617 7.5391 7.5416 7.5452 7.5458 8.0236 8.0261 8.2230 8.2236 8.2749 8.2769 9.5198 9.5211 11.4131 11.4150 k = 0.1071 0.1071-0.0000 ( 5932 PWs) bands (ev): -58.2230 -58.2230 -32.6659 -32.6659 -31.8425 -31.8425 -31.8425 -31.8425 -7.5408 -7.5408 -6.3941 -6.3930 -6.3865 -6.3853 -6.3573 -6.3568 0.4081 0.4096 0.4245 0.4257 1.2300 1.2301 1.8454 1.8515 1.9173 1.9317 1.9506 1.9529 2.4793 2.4859 2.5112 2.5224 2.5415 2.5562 3.0928 3.1031 3.1287 3.1325 3.2617 3.2635 3.4629 3.4763 3.5737 3.5891 3.8156 3.8260 3.8753 3.9450 3.9582 3.9682 4.0674 4.0722 4.0899 4.1413 4.1607 4.1801 4.6652 4.6912 4.7363 4.7768 4.8887 4.9108 4.9736 4.9762 5.5247 5.5265 5.6854 5.6925 5.7559 5.7564 7.5338 7.5362 7.5406 7.5407 8.0451 8.0467 8.2254 8.2258 8.2678 8.2697 9.4433 9.4443 11.4078 11.4100 k = 0.0952 0.0952-0.0000 ( 5932 PWs) bands (ev): -58.2230 -58.2230 -32.6659 -32.6659 -31.8425 -31.8425 -31.8425 -31.8425 -7.5511 -7.5511 -6.3870 -6.3861 -6.3805 -6.3794 -6.3572 -6.3567 0.3960 0.3973 0.4092 0.4103 1.2175 1.2176 1.8600 1.8655 1.9156 1.9285 1.9476 1.9497 2.4919 2.4979 2.5244 2.5329 2.5487 2.5600 3.1167 3.1251 3.1543 3.1569 3.2674 3.2687 3.4504 3.4643 3.5475 3.5624 3.8184 3.8258 3.8833 3.9465 3.9529 3.9688 4.0678 4.0764 4.0909 4.1449 4.1494 4.1723 4.6844 4.7016 4.7473 4.7890 4.8741 4.8966 4.9736 4.9736 5.5538 5.5549 5.6838 5.6903 5.7511 5.7516 7.5292 7.5313 7.5356 7.5360 8.0688 8.0698 8.2267 8.2270 8.2616 8.2633 9.3694 9.3702 11.4043 11.4067 k = 0.0833 0.0833-0.0000 ( 5930 PWs) bands (ev): -58.2230 -58.2230 -32.6659 -32.6659 -31.8425 -31.8425 -31.8425 -31.8425 -7.5602 -7.5602 -6.3807 -6.3800 -6.3751 -6.3741 -6.3571 -6.3566 0.3852 0.3863 0.3954 0.3964 1.2063 1.2064 1.8727 1.8777 1.9141 1.9254 1.9453 1.9471 2.5029 2.5080 2.5364 2.5426 2.5554 2.5636 3.1411 3.1475 3.1787 3.1800 3.2722 3.2733 3.4379 3.4520 3.5212 3.5355 3.8206 3.8256 3.8915 3.9476 3.9485 3.9680 4.0694 4.0801 4.0909 4.1384 4.1488 4.1667 4.7010 4.7109 4.7588 4.8003 4.8610 4.8819 4.9735 4.9743 5.5803 5.5809 5.6812 5.6868 5.7472 5.7477 7.5252 7.5270 7.5308 7.5315 8.0942 8.0946 8.2272 8.2274 8.2562 8.2578 9.2988 9.2994 11.4025 11.4049 k = 0.0714 0.0714-0.0000 ( 5930 PWs) bands (ev): -58.2230 -58.2230 -32.6659 -32.6659 -31.8425 -31.8425 -31.8424 -31.8424 -7.5682 -7.5682 -6.3752 -6.3747 -6.3702 -6.3693 -6.3570 -6.3566 0.3757 0.3766 0.3834 0.3842 1.1965 1.1966 1.8836 1.8879 1.9128 1.9225 1.9437 1.9452 2.5124 2.5163 2.5470 2.5514 2.5615 2.5668 3.1659 3.1704 3.2018 3.2018 3.2763 3.2771 3.4255 3.4395 3.4951 3.5087 3.8222 3.8255 3.8997 3.9450 3.9483 3.9662 4.0719 4.0833 4.0902 4.1285 4.1521 4.1630 4.7143 4.7189 4.7709 4.8104 4.8502 4.8684 4.9745 4.9754 5.6037 5.6038 5.6778 5.6826 5.7444 5.7448 7.5218 7.5233 7.5264 7.5272 8.1203 8.1205 8.2270 8.2271 8.2519 8.2532 9.2327 9.2331 11.4020 11.4043 k = 0.0595 0.0595-0.0000 ( 5936 PWs) bands (ev): -58.2230 -58.2230 -32.6658 -32.6658 -31.8425 -31.8425 -31.8424 -31.8424 -7.5749 -7.5749 -6.3706 -6.3702 -6.3660 -6.3652 -6.3569 -6.3565 0.3676 0.3684 0.3730 0.3738 1.1881 1.1882 1.8926 1.8961 1.9117 1.9197 1.9429 1.9439 2.5203 2.5229 2.5562 2.5592 2.5667 2.5697 3.1909 3.1934 3.2221 3.2234 3.2796 3.2803 3.4133 3.4268 3.4693 3.4819 3.8235 3.8254 3.9078 3.9424 3.9483 3.9635 4.0748 4.0859 4.0888 4.1194 4.1549 4.1610 4.7239 4.7254 4.7835 4.8191 4.8419 4.8568 4.9759 4.9766 5.6232 5.6234 5.6742 5.6780 5.7427 5.7430 7.5190 7.5202 7.5224 7.5233 8.1461 8.1462 8.2266 8.2267 8.2484 8.2496 9.1721 9.1723 11.4025 11.4048 k = 0.0476 0.0476-0.0000 ( 5953 PWs) bands (ev): -58.2230 -58.2230 -32.6658 -32.6658 -31.8425 -31.8425 -31.8424 -31.8424 -7.5805 -7.5805 -6.3670 -6.3667 -6.3625 -6.3618 -6.3568 -6.3564 0.3610 0.3616 0.3645 0.3651 1.1812 1.1812 1.8996 1.9023 1.9109 1.9173 1.9427 1.9433 2.5265 2.5280 2.5638 2.5658 2.5709 2.5722 3.2158 3.2165 3.2407 3.2432 3.2823 3.2828 3.4015 3.4140 3.4440 3.4555 3.8243 3.8253 3.9155 3.9407 3.9478 3.9602 4.0778 4.0875 4.0878 4.1111 4.1573 4.1603 4.7300 4.7301 4.7960 4.8260 4.8361 4.8474 4.9773 4.9778 5.6387 5.6390 5.6707 5.6735 5.7423 5.7425 7.5168 7.5177 7.5191 7.5199 8.1699 8.1701 8.2266 8.2267 8.2458 8.2468 9.1185 9.1186 11.4051 11.4069 k = 0.0357 0.0357-0.0000 ( 5975 PWs) bands (ev): -58.2230 -58.2230 -32.6658 -32.6658 -31.8424 -31.8424 -31.8424 -31.8424 -7.5848 -7.5848 -6.3643 -6.3642 -6.3596 -6.3591 -6.3566 -6.3562 0.3558 0.3562 0.3578 0.3582 1.1758 1.1758 1.9047 1.9067 1.9104 1.9152 1.9430 1.9433 2.5312 2.5319 2.5698 2.5711 2.5742 2.5744 3.2391 3.2400 3.2574 3.2607 3.2844 3.2848 3.3906 3.4016 3.4198 3.4299 3.8248 3.8252 3.9229 3.9399 3.9468 3.9563 4.0807 4.0867 4.0890 4.1039 4.1591 4.1603 4.7333 4.7334 4.8076 4.8307 4.8324 4.8404 4.9786 4.9789 5.6501 5.6505 5.6675 5.6695 5.7429 5.7430 7.5150 7.5158 7.5165 7.5171 8.1894 8.1895 8.2283 8.2284 8.2440 8.2447 9.0737 9.0738 11.4055 11.4071 k = 0.0238 0.0238-0.0000 ( 5983 PWs) bands (ev): -58.2230 -58.2230 -32.6658 -32.6658 -31.8424 -31.8424 -31.8424 -31.8424 -7.5879 -7.5879 -6.3625 -6.3625 -6.3575 -6.3572 -6.3562 -6.3559 0.3521 0.3524 0.3530 0.3533 1.1719 1.1719 1.9081 1.9094 1.9103 1.9134 1.9435 1.9436 2.5345 2.5347 2.5742 2.5750 2.5762 2.5764 3.2603 3.2624 3.2716 3.2749 3.2858 3.2862 3.3815 3.3901 3.3980 3.4061 3.8251 3.8253 3.9298 3.9400 3.9453 3.9521 4.0832 4.0868 4.0895 4.0977 4.1604 4.1607 4.7350 4.7351 4.8175 4.8306 4.8331 4.8357 4.9796 4.9797 5.6577 5.6580 5.6651 5.6664 5.7441 5.7441 7.5139 7.5143 7.5145 7.5150 8.2015 8.2015 8.2331 8.2332 8.2427 8.2432 9.0396 9.0396 11.4061 11.4081 k = 0.0119 0.0119-0.0000 ( 6011 PWs) bands (ev): -58.2230 -58.2230 -32.6658 -32.6658 -31.8424 -31.8424 -31.8424 -31.8424 -7.5898 -7.5898 -6.3616 -6.3616 -6.3562 -6.3560 -6.3559 -6.3557 0.3499 0.3500 0.3501 0.3503 1.1696 1.1696 1.9101 1.9105 1.9108 1.9120 1.9440 1.9440 2.5363 2.5363 2.5768 2.5772 2.5774 2.5776 3.2776 3.2799 3.2818 3.2841 3.2870 3.2874 3.3757 3.3806 3.3813 3.3863 3.8252 3.8253 3.9362 3.9408 3.9437 3.9473 4.0857 4.0876 4.0894 4.0926 4.1610 4.1610 4.7358 4.7358 4.8253 4.8300 4.8322 4.8334 4.9802 4.9802 5.6620 5.6621 5.6637 5.6643 5.7452 5.7452 7.5132 7.5134 7.5134 7.5136 8.2065 8.2065 8.2392 8.2393 8.2420 8.2423 9.0182 9.0182 11.4065 11.4071 k = 0.0000 0.0000 0.0000 ( 6031 PWs) bands (ev): -58.2230 -58.2230 -32.6658 -32.6658 -31.8424 -31.8424 -31.8424 -31.8424 -7.5904 -7.5904 -6.3613 -6.3613 -6.3557 -6.3557 -6.3557 -6.3557 0.3492 0.3492 0.3492 0.3492 1.1688 1.1688 1.9110 1.9110 1.9110 1.9110 1.9442 1.9442 2.5369 2.5369 2.5779 2.5779 2.5779 2.5779 3.2857 3.2857 3.2857 3.2857 3.2888 3.2888 3.3757 3.3757 3.3757 3.3757 3.8252 3.8252 3.9420 3.9420 3.9420 3.9420 4.0886 4.0886 4.0886 4.0886 4.1611 4.1611 4.7360 4.7360 4.8306 4.8306 4.8306 4.8306 4.9804 4.9804 5.6634 5.6634 5.6634 5.6634 5.7456 5.7456 7.5131 7.5131 7.5131 7.5131 8.2076 8.2076 8.2419 8.2419 8.2419 8.2419 9.0108 9.0108 11.4061 11.4061 k = 0.0000 0.0000 0.0000 ( 6031 PWs) bands (ev): -58.2230 -58.2230 -32.6658 -32.6658 -31.8424 -31.8424 -31.8424 -31.8424 -7.5904 -7.5904 -6.3613 -6.3613 -6.3557 -6.3557 -6.3557 -6.3557 0.3492 0.3492 0.3492 0.3492 1.1688 1.1688 1.9110 1.9110 1.9110 1.9110 1.9442 1.9442 2.5369 2.5369 2.5779 2.5779 2.5779 2.5779 3.2857 3.2857 3.2857 3.2857 3.2888 3.2888 3.3757 3.3757 3.3757 3.3757 3.8252 3.8252 3.9420 3.9420 3.9420 3.9420 4.0886 4.0886 4.0886 4.0886 4.1611 4.1611 4.7360 4.7360 4.8306 4.8306 4.8306 4.8306 4.9804 4.9804 5.6634 5.6634 5.6634 5.6634 5.7456 5.7456 7.5131 7.5131 7.5131 7.5131 8.2076 8.2076 8.2419 8.2419 8.2419 8.2419 9.0108 9.0108 11.4061 11.4061 k = 0.0098 0.0098 0.0098 ( 6019 PWs) bands (ev): -58.2230 -58.2230 -32.6658 -32.6658 -31.8424 -31.8424 -31.8424 -31.8424 -7.5898 -7.5898 -6.3616 -6.3616 -6.3561 -6.3559 -6.3559 -6.3558 0.3500 0.3501 0.3501 0.3502 1.1696 1.1696 1.9103 1.9105 1.9105 1.9121 1.9440 1.9440 2.5363 2.5363 2.5769 2.5773 2.5773 2.5774 3.2787 3.2817 3.2817 3.2820 3.2865 3.2865 3.3772 3.3809 3.3809 3.3854 3.8252 3.8252 3.9359 3.9422 3.9422 3.9475 4.0857 4.0884 4.0884 4.0928 4.1609 4.1609 4.7358 4.7358 4.8249 4.8313 4.8313 4.8334 4.9802 4.9802 5.6620 5.6620 5.6637 5.6644 5.7452 5.7452 7.5132 7.5134 7.5134 7.5136 8.2064 8.2064 8.2391 8.2391 8.2421 8.2424 9.0183 9.0183 11.4068 11.4070 k = 0.0196 0.0196 0.0196 ( 5983 PWs) bands (ev): -58.2230 -58.2230 -32.6658 -32.6658 -31.8424 -31.8424 -31.8424 -31.8424 -7.5879 -7.5879 -6.3624 -6.3624 -6.3572 -6.3567 -6.3567 -6.3566 0.3525 0.3527 0.3527 0.3530 1.1720 1.1720 1.9089 1.9089 1.9099 1.9134 1.9436 1.9436 2.5345 2.5345 2.5745 2.5755 2.5758 2.5758 3.2650 3.2691 3.2693 3.2693 3.2825 3.2825 3.3887 3.3941 3.3941 3.4024 3.8252 3.8252 3.9293 3.9428 3.9428 3.9523 4.0839 4.0877 4.0877 4.0980 4.1606 4.1606 4.7350 4.7350 4.8165 4.8333 4.8335 4.8335 4.9797 4.9797 5.6575 5.6575 5.6653 5.6667 5.7441 5.7441 7.5141 7.5145 7.5145 7.5148 8.2012 8.2012 8.2330 8.2330 8.2430 8.2435 9.0401 9.0401 11.4086 11.4088 k = 0.0294 0.0294 0.0294 ( 5971 PWs) bands (ev): -58.2230 -58.2230 -32.6658 -32.6658 -31.8424 -31.8424 -31.8424 -31.8424 -7.5847 -7.5847 -6.3638 -6.3638 -6.3588 -6.3580 -6.3579 -6.3579 0.3568 0.3571 0.3571 0.3575 1.1759 1.1759 1.9060 1.9060 1.9099 1.9152 1.9430 1.9430 2.5316 2.5316 2.5705 2.5720 2.5732 2.5732 3.2483 3.2512 3.2527 3.2527 3.2764 3.2764 3.4055 3.4112 3.4112 3.4226 3.8250 3.8250 3.9221 3.9437 3.9437 3.9561 4.0835 4.0866 4.0866 4.1040 4.1597 4.1597 4.7331 4.7331 4.8054 4.8305 4.8378 4.8378 4.9787 4.9787 5.6492 5.6492 5.6681 5.6702 5.7431 5.7431 7.5155 7.5162 7.5162 7.5167 8.1882 8.1882 8.2287 8.2287 8.2444 8.2452 9.0746 9.0746 11.4115 11.4136 k = 0.0392 0.0392 0.0392 ( 5953 PWs) bands (ev): -58.2230 -58.2230 -32.6658 -32.6658 -31.8424 -31.8424 -31.8424 -31.8424 -7.5803 -7.5803 -6.3658 -6.3658 -6.3611 -6.3600 -6.3595 -6.3595 0.3628 0.3632 0.3632 0.3638 1.1814 1.1814 1.9015 1.9015 1.9102 1.9172 1.9427 1.9427 2.5274 2.5274 2.5652 2.5671 2.5695 2.5695 3.2304 3.2312 3.2343 3.2343 3.2681 3.2681 3.4249 3.4301 3.4301 3.4445 3.8248 3.8248 3.9145 3.9450 3.9450 3.9591 4.0845 4.0850 4.0850 4.1109 4.1585 4.1585 4.7296 4.7296 4.7920 4.8252 4.8445 4.8445 4.9776 4.9776 5.6365 5.6365 5.6718 5.6749 5.7429 5.7429 7.5177 7.5186 7.5186 7.5192 8.1674 8.1674 8.2281 8.2281 8.2465 8.2475 9.1199 9.1199 11.4153 11.4154 k = 0.0490 0.0490 0.0490 ( 5941 PWs) bands (ev): -58.2230 -58.2230 -32.6658 -32.6658 -31.8425 -31.8425 -31.8425 -31.8425 -7.5747 -7.5747 -6.3683 -6.3683 -6.3639 -6.3626 -6.3616 -6.3616 0.3705 0.3710 0.3710 0.3717 1.1884 1.1884 1.8952 1.8952 1.9108 1.9195 1.9428 1.9428 2.5220 2.5220 2.5583 2.5607 2.5649 2.5649 3.2104 3.2121 3.2151 3.2151 3.2573 3.2573 3.4458 3.4500 3.4500 3.4672 3.8245 3.8245 3.9064 3.9464 3.9464 3.9610 4.0830 4.0830 4.0870 4.1185 4.1573 4.1573 4.7241 4.7241 4.7766 4.8177 4.8542 4.8542 4.9765 4.9765 5.6190 5.6190 5.6763 5.6803 5.7438 5.7438 7.5206 7.5217 7.5217 7.5225 8.1420 8.1420 8.2296 8.2296 8.2492 8.2504 9.1737 9.1737 11.4204 11.4204 k = 0.0588 0.0588 0.0588 ( 5938 PWs) bands (ev): -58.2230 -58.2230 -32.6659 -32.6659 -31.8425 -31.8425 -31.8425 -31.8425 -7.5678 -7.5678 -6.3714 -6.3714 -6.3673 -6.3657 -6.3642 -6.3642 0.3798 0.3804 0.3804 0.3813 1.1969 1.1969 1.8870 1.8870 1.9118 1.9222 1.9435 1.9435 2.5153 2.5153 2.5501 2.5528 2.5593 2.5593 3.1894 3.1937 3.1957 3.1957 3.2442 3.2442 3.4675 3.4702 3.4702 3.4902 3.8240 3.8240 3.8980 3.9481 3.9481 3.9620 4.0806 4.0806 4.0909 4.1267 4.1561 4.1561 4.7166 4.7166 4.7596 4.8082 4.8668 4.8668 4.9755 4.9755 5.5968 5.5968 5.6813 5.6865 5.7460 5.7460 7.5241 7.5255 7.5255 7.5263 8.1144 8.1144 8.2324 8.2324 8.2523 8.2537 9.2343 9.2343 11.4270 11.4270 k = 0.0686 0.0686 0.0686 ( 5938 PWs) bands (ev): -58.2230 -58.2230 -32.6659 -32.6659 -31.8425 -31.8425 -31.8425 -31.8425 -7.5597 -7.5597 -6.3751 -6.3751 -6.3712 -6.3694 -6.3671 -6.3671 0.3907 0.3913 0.3913 0.3925 1.2068 1.2068 1.8769 1.8769 1.9131 1.9251 1.9447 1.9447 2.5074 2.5074 2.5404 2.5435 2.5530 2.5530 3.1685 3.1755 3.1763 3.1763 3.2289 3.2289 3.4897 3.4905 3.4905 3.5133 3.8234 3.8234 3.8892 3.9498 3.9498 3.9621 4.0778 4.0778 4.0960 4.1355 4.1551 4.1551 4.7073 4.7073 4.7413 4.7974 4.8816 4.8816 4.9752 4.9752 5.5702 5.5702 5.6866 5.6930 5.7490 5.7490 7.5284 7.5300 7.5300 7.5309 8.0862 8.0862 8.2360 8.2360 8.2559 8.2575 9.2999 9.2999 11.4355 11.4355 k = 0.0784 0.0784 0.0784 ( 5926 PWs) bands (ev): -58.2230 -58.2230 -32.6659 -32.6659 -31.8425 -31.8425 -31.8425 -31.8425 -7.5504 -7.5504 -6.3793 -6.3793 -6.3757 -6.3736 -6.3703 -6.3703 0.4031 0.4037 0.4037 0.4051 1.2180 1.2180 1.8649 1.8649 1.9147 1.9284 1.9464 1.9464 2.4982 2.4982 2.5293 2.5327 2.5458 2.5458 3.1479 3.1572 3.1572 3.1576 3.2113 3.2113 3.5108 3.5108 3.5123 3.5364 3.8227 3.8227 3.8801 3.9515 3.9515 3.9614 4.0749 4.0749 4.1024 4.1449 4.1545 4.1545 4.6966 4.6966 4.7224 4.7855 4.8978 4.8978 4.9765 4.9765 5.5397 5.5397 5.6920 5.6997 5.7528 5.7528 7.5333 7.5351 7.5351 7.5361 8.0585 8.0585 8.2402 8.2402 8.2599 8.2616 9.3691 9.3691 11.4461 11.4462 k = 0.0882 0.0882 0.0882 ( 5932 PWs) bands (ev): -58.2230 -58.2230 -32.6659 -32.6659 -31.8425 -31.8425 -31.8425 -31.8425 -7.5399 -7.5399 -6.3841 -6.3841 -6.3807 -6.3784 -6.3740 -6.3740 0.4168 0.4176 0.4176 0.4192 1.2305 1.2305 1.8513 1.8513 1.9166 1.9319 1.9485 1.9485 2.4877 2.4877 2.5170 2.5205 2.5380 2.5380 3.1278 3.1383 3.1383 3.1400 3.1915 3.1915 3.5307 3.5307 3.5350 3.5591 3.8218 3.8218 3.8708 3.9529 3.9529 3.9601 4.0718 4.0718 4.1097 4.1544 4.1544 4.1546 4.6850 4.6850 4.7032 4.7730 4.9130 4.9130 4.9812 4.9812 5.5058 5.5058 5.6972 5.7063 5.7568 5.7568 7.5389 7.5409 7.5409 7.5419 8.0321 8.0321 8.2448 8.2448 8.2642 8.2659 9.4407 9.4407 11.4593 11.4593 k = 0.0980 0.0980 0.0980 ( 5932 PWs) bands (ev): -58.2230 -58.2230 -32.6659 -32.6659 -31.8425 -31.8425 -31.8425 -31.8425 -7.5283 -7.5283 -6.3894 -6.3894 -6.3861 -6.3837 -6.3779 -6.3779 0.4319 0.4327 0.4327 0.4346 1.2442 1.2442 1.8359 1.8359 1.9188 1.9356 1.9511 1.9511 2.4760 2.4760 2.5033 2.5070 2.5295 2.5295 3.1081 3.1199 3.1199 3.1229 3.1697 3.1697 3.5503 3.5503 3.5579 3.5816 3.8209 3.8209 3.8612 3.9541 3.9541 3.9583 4.0687 4.0687 4.1178 4.1549 4.1549 4.1646 4.6729 4.6729 4.6841 4.7602 4.9241 4.9241 4.9922 4.9922 5.4690 5.4690 5.7022 5.7127 5.7609 5.7609 7.5452 7.5474 7.5474 7.5485 8.0074 8.0074 8.2498 8.2498 8.2687 8.2705 9.5137 9.5137 11.4752 11.4752 k = 0.1078 0.1078 0.1078 ( 5938 PWs) bands (ev): -58.2230 -58.2230 -32.6659 -32.6659 -31.8425 -31.8425 -31.8425 -31.8425 -7.5155 -7.5155 -6.3951 -6.3951 -6.3921 -6.3894 -6.3822 -6.3822 0.4483 0.4490 0.4490 0.4512 1.2590 1.2590 1.8190 1.8190 1.9212 1.9396 1.9540 1.9540 2.4631 2.4631 2.4886 2.4923 2.5205 2.5205 3.0891 3.1020 3.1020 3.1063 3.1460 3.1460 3.5693 3.5693 3.5807 3.6035 3.8198 3.8198 3.8514 3.9547 3.9547 3.9562 4.0658 4.0658 4.1265 4.1561 4.1561 4.1749 4.6608 4.6608 4.6655 4.7477 4.9295 4.9295 5.0110 5.0110 5.4297 5.4297 5.7068 5.7188 5.7649 5.7649 7.5522 7.5545 7.5545 7.5556 7.9849 7.9849 8.2552 8.2552 8.2734 8.2753 9.5871 9.5871 11.4938 11.4938 k = 0.1176 0.1176 0.1176 ( 5944 PWs) bands (ev): -58.2230 -58.2230 -32.6659 -32.6659 -31.8425 -31.8425 -31.8425 -31.8425 -7.5017 -7.5017 -6.4013 -6.4013 -6.3984 -6.3955 -6.3868 -6.3868 0.4657 0.4665 0.4665 0.4689 1.2747 1.2747 1.8005 1.8005 1.9240 1.9438 1.9572 1.9572 2.4491 2.4491 2.4728 2.4764 2.5111 2.5111 3.0707 3.0846 3.0846 3.0901 3.1204 3.1204 3.5878 3.5878 3.6036 3.6248 3.8186 3.8186 3.8415 3.9539 3.9548 3.9548 4.0630 4.0630 4.1356 4.1583 4.1583 4.1852 4.6479 4.6490 4.6490 4.7356 4.9302 4.9302 5.0361 5.0361 5.3883 5.3883 5.7110 5.7243 5.7687 5.7687 7.5598 7.5622 7.5622 7.5635 7.9647 7.9647 8.2607 8.2607 8.2783 8.2801 9.6600 9.6600 11.5122 11.5123 k = 0.1275 0.1275 0.1275 ( 5938 PWs) bands (ev): -58.2230 -58.2230 -32.6659 -32.6659 -31.8426 -31.8426 -31.8426 -31.8426 -7.4868 -7.4868 -6.4079 -6.4079 -6.4052 -6.4021 -6.3917 -6.3917 0.4840 0.4848 0.4848 0.4876 1.2913 1.2913 1.7807 1.7807 1.9270 1.9481 1.9607 1.9607 2.4341 2.4341 2.4561 2.4595 2.5012 2.5012 3.0530 3.0676 3.0676 3.0744 3.0933 3.0933 3.6055 3.6055 3.6263 3.6454 3.8173 3.8173 3.8316 3.9517 3.9543 3.9543 4.0606 4.0606 4.1449 4.1613 4.1613 4.1957 4.6316 4.6379 4.6379 4.7243 4.9282 4.9282 5.0655 5.0655 5.3453 5.3453 5.7147 5.7293 5.7722 5.7722 7.5681 7.5706 7.5706 7.5719 7.9472 7.9472 8.2664 8.2664 8.2834 8.2851 9.7316 9.7316 11.5292 11.5293 k = 0.1373 0.1373 0.1373 ( 5944 PWs) bands (ev): -58.2230 -58.2230 -32.6660 -32.6660 -31.8426 -31.8426 -31.8426 -31.8426 -7.4709 -7.4709 -6.4149 -6.4149 -6.4123 -6.4090 -6.3969 -6.3969 0.5032 0.5040 0.5040 0.5071 1.3084 1.3084 1.7596 1.7596 1.9302 1.9527 1.9644 1.9644 2.4181 2.4181 2.4386 2.4417 2.4910 2.4910 3.0359 3.0509 3.0509 3.0591 3.0651 3.0651 3.6224 3.6224 3.6487 3.6651 3.8160 3.8160 3.8217 3.9496 3.9531 3.9531 4.0584 4.0584 4.1542 4.1653 4.1653 4.2060 4.6168 4.6276 4.6276 4.7140 4.9245 4.9245 5.0977 5.0977 5.3011 5.3011 5.7179 5.7338 5.7753 5.7753 7.5770 7.5795 7.5795 7.5809 7.9323 7.9323 8.2724 8.2724 8.2885 8.2901 9.8012 9.8012 11.5465 11.5468 k = 0.1471 0.1471 0.1471 ( 5941 PWs) bands (ev): -58.2230 -58.2230 -32.6660 -32.6660 -31.8426 -31.8426 -31.8426 -31.8426 -7.4540 -7.4540 -6.4223 -6.4223 -6.4197 -6.4163 -6.4023 -6.4023 0.5231 0.5239 0.5239 0.5273 1.3260 1.3260 1.7374 1.7374 1.9336 1.9573 1.9682 1.9682 2.4015 2.4015 2.4205 2.4232 2.4806 2.4806 3.0194 3.0312 3.0312 3.0392 3.0392 3.0443 3.6383 3.6383 3.6708 3.6838 3.8120 3.8147 3.8147 3.9479 3.9515 3.9515 4.0566 4.0566 4.1632 4.1703 4.1703 4.2162 4.6040 4.6184 4.6184 4.7050 4.9195 4.9195 5.1320 5.1320 5.2561 5.2561 5.7207 5.7378 5.7781 5.7781 7.5865 7.5890 7.5890 7.5904 7.9203 7.9203 8.2784 8.2784 8.2938 8.2952 9.8680 9.8680 11.5642 11.5650 k = 0.1569 0.1569 0.1569 ( 5935 PWs) bands (ev): -58.2230 -58.2230 -32.6660 -32.6660 -31.8426 -31.8426 -31.8426 -31.8426 -7.4362 -7.4362 -6.4299 -6.4299 -6.4274 -6.4239 -6.4080 -6.4080 0.5434 0.5442 0.5442 0.5480 1.3437 1.3437 1.7143 1.7143 1.9372 1.9621 1.9723 1.9723 2.3844 2.3844 2.4019 2.4041 2.4699 2.4699 3.0021 3.0021 3.0037 3.0223 3.0223 3.0299 3.6530 3.6530 3.6925 3.7014 3.8026 3.8133 3.8133 3.9466 3.9496 3.9496 4.0550 4.0550 4.1718 4.1761 4.1761 4.2260 4.5932 4.6105 4.6105 4.6975 4.9135 4.9135 5.1667 5.1667 5.2122 5.2122 5.7232 5.7412 5.7806 5.7806 7.5966 7.5989 7.5989 7.6005 7.9111 7.9111 8.2847 8.2847 8.2992 8.3004 9.9317 9.9317 11.5823 11.5829 k = 0.1667 0.1667 0.1667 ( 5953 PWs) bands (ev): -58.2230 -58.2230 -32.6660 -32.6660 -31.8426 -31.8426 -31.8426 -31.8426 -7.4175 -7.4175 -6.4378 -6.4378 -6.4354 -6.4317 -6.4139 -6.4139 0.5641 0.5649 0.5649 0.5690 1.3611 1.3611 1.6906 1.6906 1.9409 1.9669 1.9764 1.9764 2.3669 2.3669 2.3832 2.3848 2.4589 2.4589 2.9705 2.9705 2.9885 3.0075 3.0075 3.0159 3.6664 3.6664 3.7135 3.7176 3.7935 3.8120 3.8120 3.9460 3.9474 3.9474 4.0535 4.0535 4.1797 4.1826 4.1826 4.2354 4.5847 4.6038 4.6038 4.6914 4.9064 4.9064 5.1603 5.1603 5.2107 5.2107 5.7254 5.7443 5.7829 5.7829 7.6071 7.6093 7.6093 7.6110 7.9048 7.9048 8.2911 8.2911 8.3047 8.3057 9.9916 9.9916 11.6007 11.6039 k = 0.1765 0.1765 0.1765 ( 5941 PWs) bands (ev): -58.2230 -58.2230 -32.6660 -32.6660 -31.8427 -31.8427 -31.8427 -31.8427 -7.3980 -7.3980 -6.4460 -6.4460 -6.4436 -6.4398 -6.4200 -6.4200 0.5850 0.5858 0.5858 0.5903 1.3777 1.3777 1.6669 1.6669 1.9448 1.9717 1.9806 1.9806 2.3494 2.3494 2.3644 2.3654 2.4479 2.4479 2.9381 2.9381 2.9740 2.9935 2.9935 3.0024 3.6785 3.6785 3.7324 3.7334 3.7854 3.8109 3.8109 3.9453 3.9453 3.9462 4.0523 4.0523 4.1869 4.1899 4.1899 4.2444 4.5785 4.5985 4.5985 4.6870 4.8982 4.8982 5.1162 5.1162 5.2486 5.2486 5.7275 5.7472 5.7852 5.7852 7.6181 7.6201 7.6201 7.6219 7.9014 7.9014 8.2978 8.2978 8.3104 8.3111 10.0474 10.0474 11.6191 11.6203 k = 0.1863 0.1863 0.1863 ( 5947 PWs) bands (ev): -58.2230 -58.2230 -32.6661 -32.6661 -31.8427 -31.8427 -31.8427 -31.8427 -7.3777 -7.3777 -6.4543 -6.4543 -6.4520 -6.4481 -6.4263 -6.4263 0.6058 0.6065 0.6065 0.6115 1.3926 1.3926 1.6438 1.6438 1.9488 1.9765 1.9849 1.9849 2.3320 2.3320 2.3459 2.3462 2.4368 2.4368 2.9055 2.9055 2.9599 2.9802 2.9802 2.9891 3.6890 3.6890 3.7456 3.7504 3.7800 3.8100 3.8100 3.9434 3.9434 3.9474 4.0512 4.0512 4.1931 4.1976 4.1976 4.2527 4.5748 4.5944 4.5944 4.6842 4.8888 4.8888 5.0713 5.0713 5.2890 5.2890 5.7297 5.7499 5.7876 5.7876 7.6294 7.6312 7.6312 7.6331 7.9009 7.9009 8.3047 8.3047 8.3164 8.3167 10.0990 10.0990 11.6370 11.6377 k = 0.1961 0.1961 0.1961 ( 5932 PWs) bands (ev): -58.2230 -58.2230 -32.6661 -32.6661 -31.8427 -31.8427 -31.8427 -31.8427 -7.3566 -7.3566 -6.4628 -6.4628 -6.4605 -6.4566 -6.4327 -6.4327 0.6264 0.6271 0.6271 0.6325 1.4047 1.4047 1.6225 1.6225 1.9529 1.9812 1.9891 1.9891 2.3151 2.3151 2.3275 2.3278 2.4256 2.4256 2.8728 2.8728 2.9465 2.9674 2.9674 2.9762 3.6979 3.6979 3.7573 3.7575 3.7845 3.8096 3.8096 3.9418 3.9418 3.9496 4.0501 4.0501 4.1983 4.2057 4.2057 4.2603 4.5734 4.5916 4.5916 4.6830 4.8779 4.8779 5.0274 5.0274 5.3307 5.3307 5.7322 5.7528 5.7902 5.7902 7.6411 7.6427 7.6427 7.6446 7.9032 7.9032 8.3118 8.3118 8.3225 8.3226 10.1463 10.1463 11.6544 11.6579 k = 0.2059 0.2059 0.2059 ( 5935 PWs) bands (ev): -58.2230 -58.2230 -32.6661 -32.6661 -31.8427 -31.8427 -31.8427 -31.8427 -7.3349 -7.3349 -6.4715 -6.4715 -6.4692 -6.4652 -6.4393 -6.4393 0.6466 0.6473 0.6473 0.6531 1.4120 1.4120 1.6045 1.6045 1.9570 1.9858 1.9932 1.9932 2.2988 2.2988 2.3095 2.3104 2.4144 2.4144 2.8405 2.8405 2.9335 2.9550 2.9550 2.9636 3.7050 3.7050 3.7539 3.7674 3.7993 3.8097 3.8097 3.9405 3.9405 3.9528 4.0491 4.0491 4.2024 4.2139 4.2139 4.2672 4.5741 4.5897 4.5897 4.6832 4.8651 4.8651 4.9853 4.9853 5.3734 5.3734 5.7353 5.7560 5.7933 5.7933 7.6530 7.6543 7.6543 7.6563 7.9082 7.9082 8.3193 8.3193 8.3286 8.3291 10.1891 10.1891 11.6705 11.6708 k = 0.2157 0.2157 0.2157 ( 5926 PWs) bands (ev): -58.2230 -58.2230 -32.6661 -32.6661 -31.8428 -31.8428 -31.8428 -31.8428 -7.3126 -7.3126 -6.4802 -6.4802 -6.4779 -6.4739 -6.4460 -6.4460 0.6662 0.6668 0.6668 0.6731 1.4125 1.4125 1.5921 1.5921 1.9611 1.9903 1.9973 1.9973 2.2835 2.2835 2.2925 2.2940 2.4032 2.4032 2.8089 2.8089 2.9210 2.9431 2.9431 2.9512 3.7104 3.7104 3.7482 3.7761 3.8105 3.8105 3.8164 3.9397 3.9397 3.9570 4.0482 4.0482 4.2056 4.2221 4.2221 4.2734 4.5767 4.5886 4.5886 4.6847 4.8495 4.8495 4.9463 4.9463 5.4169 5.4169 5.7391 5.7598 5.7971 5.7971 7.6650 7.6660 7.6660 7.6681 7.9160 7.9160 8.3271 8.3271 8.3350 8.3360 10.2278 10.2278 11.6851 11.6863 k = 0.2255 0.2255 0.2255 ( 5938 PWs) bands (ev): -58.2230 -58.2230 -32.6661 -32.6661 -31.8428 -31.8428 -31.8428 -31.8428 -7.2897 -7.2897 -6.4890 -6.4890 -6.4867 -6.4826 -6.4528 -6.4528 0.6850 0.6855 0.6855 0.6923 1.4045 1.4045 1.5865 1.5865 1.9652 1.9946 2.0012 2.0012 2.2693 2.2693 2.2766 2.2787 2.3921 2.3921 2.7783 2.7783 2.9089 2.9317 2.9317 2.9392 3.7141 3.7141 3.7424 3.7836 3.8119 3.8119 3.8333 3.9392 3.9392 3.9619 4.0474 4.0474 4.2078 4.2301 4.2301 4.2788 4.5807 4.5877 4.5877 4.6872 4.8299 4.8299 4.9120 4.9120 5.4610 5.4610 5.7439 5.7644 5.8019 5.8019 7.6772 7.6778 7.6778 7.6800 7.9264 7.9264 8.3354 8.3354 8.3418 8.3434 10.2623 10.2623 11.6973 11.6984 k = 0.2353 0.2353 0.2353 ( 5935 PWs) bands (ev): -58.2230 -58.2230 -32.6662 -32.6662 -31.8428 -31.8428 -31.8428 -31.8428 -7.2664 -7.2664 -6.4978 -6.4978 -6.4955 -6.4914 -6.4597 -6.4597 0.7027 0.7032 0.7032 0.7105 1.3883 1.3883 1.5874 1.5874 1.9693 1.9986 2.0049 2.0049 2.2566 2.2566 2.2623 2.2648 2.3811 2.3811 2.7492 2.7492 2.8972 2.9206 2.9206 2.9274 3.7164 3.7164 3.7371 3.7900 3.8140 3.8140 3.8497 3.9392 3.9392 3.9676 4.0466 4.0466 4.2093 4.2379 4.2379 4.2835 4.5859 4.5865 4.5865 4.6904 4.8058 4.8058 4.8836 4.8836 5.5056 5.5056 5.7500 5.7701 5.8079 5.8079 7.6893 7.6896 7.6896 7.6918 7.9394 7.9394 8.3440 8.3440 8.3491 8.3512 10.2931 10.2931 11.7062 11.7063 k = 0.2451 0.2451 0.2451 ( 5941 PWs) bands (ev): -58.2230 -58.2230 -32.6662 -32.6662 -31.8428 -31.8428 -31.8428 -31.8428 -7.2426 -7.2426 -6.5066 -6.5066 -6.5043 -6.5002 -6.4667 -6.4667 0.7193 0.7196 0.7196 0.7274 1.3657 1.3657 1.5929 1.5929 1.9734 2.0025 2.0085 2.0085 2.2454 2.2454 2.2495 2.2524 2.3703 2.3703 2.7218 2.7218 2.8860 2.9099 2.9099 2.9158 3.7175 3.7175 3.7326 3.7957 3.8166 3.8166 3.8653 3.9394 3.9394 3.9736 4.0458 4.0458 4.2101 4.2453 4.2453 4.2874 4.5842 4.5842 4.5917 4.6941 4.7783 4.7783 4.8606 4.8606 5.5505 5.5505 5.7577 5.7772 5.8153 5.8153 7.7014 7.7014 7.7014 7.7036 7.9547 7.9547 8.3532 8.3532 8.3568 8.3595 10.3202 10.3202 11.7111 11.7119 k = 0.2549 0.2549 0.2549 ( 5935 PWs) bands (ev): -58.2230 -58.2230 -32.6662 -32.6662 -31.8429 -31.8429 -31.8429 -31.8429 -7.2185 -7.2185 -6.5153 -6.5153 -6.5130 -6.5089 -6.4737 -6.4737 0.7346 0.7348 0.7348 0.7431 1.3387 1.3387 1.6008 1.6008 1.9776 2.0063 2.0120 2.0120 2.2359 2.2359 2.2385 2.2416 2.3597 2.3597 2.6966 2.6966 2.8751 2.8996 2.8996 2.9045 3.7177 3.7177 3.7288 3.8010 3.8196 3.8196 3.8801 3.9398 3.9398 3.9798 4.0451 4.0451 4.2105 4.2522 4.2522 4.2908 4.5796 4.5796 4.5977 4.6978 4.7503 4.7503 4.8412 4.8412 5.5956 5.5956 5.7672 5.7860 5.8245 5.8245 7.7130 7.7130 7.7133 7.7152 7.9723 7.9723 8.3628 8.3628 8.3651 8.3684 10.3442 10.3442 11.7106 11.7111 k = 0.2647 0.2647 0.2647 ( 5929 PWs) bands (ev): -58.2230 -58.2230 -32.6662 -32.6662 -31.8429 -31.8429 -31.8429 -31.8429 -7.1941 -7.1941 -6.5240 -6.5240 -6.5216 -6.5175 -6.4808 -6.4808 0.7484 0.7484 0.7484 0.7572 1.3088 1.3088 1.6093 1.6093 1.9818 2.0100 2.0155 2.0155 2.2281 2.2281 2.2293 2.2326 2.3493 2.3493 2.6739 2.6739 2.8646 2.8897 2.8897 2.8935 3.7172 3.7172 3.7259 3.8059 3.8229 3.8229 3.8941 3.9403 3.9403 3.9860 4.0444 4.0444 4.2105 4.2587 4.2587 4.2937 4.5714 4.5714 4.6035 4.7012 4.7249 4.7249 4.8235 4.8235 5.6407 5.6407 5.7788 5.7967 5.8357 5.8357 7.7245 7.7245 7.7250 7.7266 7.9921 7.9921 8.3729 8.3729 8.3738 8.3777 10.3651 10.3651 11.7042 11.7054 k = 0.2745 0.2745 0.2745 ( 5923 PWs) bands (ev): -58.2230 -58.2230 -32.6663 -32.6663 -31.8429 -31.8429 -31.8429 -31.8429 -7.1696 -7.1696 -6.5325 -6.5325 -6.5301 -6.5261 -6.4879 -6.4879 0.7604 0.7604 0.7606 0.7696 1.2772 1.2772 1.6174 1.6174 1.9862 2.0137 2.0191 2.0191 2.2219 2.2221 2.2221 2.2252 2.3391 2.3391 2.6540 2.6540 2.8545 2.8801 2.8801 2.8828 3.7163 3.7163 3.7239 3.8108 3.8264 3.8264 3.9072 3.9409 3.9409 3.9920 4.0438 4.0438 4.2104 4.2648 4.2648 4.2960 4.5583 4.5583 4.6086 4.7040 4.7042 4.7042 4.8065 4.8065 5.6856 5.6856 5.7926 5.8095 5.8491 5.8491 7.7358 7.7358 7.7365 7.7377 8.0139 8.0139 8.3831 8.3835 8.3835 8.3876 10.3834 10.3834 11.6900 11.6902 k = 0.2843 0.2843 0.2843 ( 5929 PWs) bands (ev): -58.2230 -58.2230 -32.6663 -32.6663 -31.8429 -31.8429 -31.8429 -31.8429 -7.1449 -7.1449 -6.5409 -6.5409 -6.5385 -6.5345 -6.4951 -6.4951 0.7708 0.7708 0.7711 0.7804 1.2445 1.2445 1.6242 1.6242 1.9908 2.0176 2.0229 2.0229 2.2161 2.2176 2.2176 2.2196 2.3293 2.3293 2.6372 2.6372 2.8448 2.8708 2.8708 2.8723 3.7151 3.7151 3.7228 3.8157 3.8300 3.8300 3.9195 3.9415 3.9415 3.9976 4.0432 4.0432 4.2102 4.2703 4.2703 4.2980 4.5402 4.5402 4.6127 4.6887 4.6887 4.7057 4.7898 4.7898 5.7301 5.7301 5.8088 5.8246 5.8649 5.8649 7.7468 7.7468 7.7478 7.7486 8.0376 8.0376 8.3929 8.3945 8.3945 8.3980 10.3994 10.3994 11.6678 11.6683 k = 0.2941 0.2941 0.2941 ( 5932 PWs) bands (ev): -58.2230 -58.2230 -32.6663 -32.6663 -31.8430 -31.8430 -31.8430 -31.8430 -7.1202 -7.1202 -6.5491 -6.5491 -6.5466 -6.5427 -6.5022 -6.5022 0.7794 0.7794 0.7799 0.7893 1.2111 1.2111 1.6291 1.6291 1.9958 2.0218 2.0270 2.0270 2.2120 2.2147 2.2147 2.2155 2.3199 2.3199 2.6237 2.6237 2.8355 2.8618 2.8618 2.8621 3.7138 3.7138 3.7226 3.8209 3.8336 3.8336 3.9310 3.9419 3.9419 4.0028 4.0425 4.0425 4.2101 4.2754 4.2754 4.2996 4.5182 4.5182 4.6156 4.6776 4.6776 4.7061 4.7729 4.7729 5.7740 5.7740 5.8276 5.8421 5.8834 5.8834 7.7575 7.7575 7.7587 7.7593 8.0629 8.0629 8.4031 8.4059 8.4059 8.4089 10.4132 10.4132 11.6367 11.6375 k = 0.3039 0.3039 0.3039 ( 5932 PWs) bands (ev): -58.2229 -58.2229 -32.6663 -32.6663 -31.8430 -31.8430 -31.8430 -31.8430 -7.0956 -7.0956 -6.5572 -6.5572 -6.5546 -6.5508 -6.5094 -6.5094 0.7862 0.7862 0.7870 0.7965 1.1775 1.1775 1.6320 1.6320 2.0013 2.0266 2.0316 2.0316 2.2092 2.2130 2.2130 2.2130 2.3108 2.3108 2.6137 2.6137 2.8266 2.8523 2.8532 2.8532 3.7125 3.7125 3.7234 3.8264 3.8373 3.8373 3.9417 3.9421 3.9421 4.0073 4.0417 4.0417 4.2102 4.2801 4.2801 4.3009 4.4941 4.4941 4.6170 4.6693 4.6693 4.7050 4.7560 4.7560 5.8170 5.8170 5.8488 5.8622 5.9047 5.9047 7.7681 7.7681 7.7693 7.7696 8.0897 8.0897 8.4138 8.4175 8.4175 8.4201 10.4251 10.4251 11.5965 11.5971 k = 0.3137 0.3137 0.3137 ( 5926 PWs) bands (ev): -58.2229 -58.2229 -32.6663 -32.6663 -31.8430 -31.8430 -31.8430 -31.8430 -7.0711 -7.0711 -6.5650 -6.5650 -6.5624 -6.5586 -6.5166 -6.5166 0.7914 0.7914 0.7924 0.8019 1.1439 1.1439 1.6327 1.6327 2.0072 2.0319 2.0369 2.0369 2.2076 2.2117 2.2124 2.2124 2.3022 2.3022 2.6071 2.6071 2.8181 2.8427 2.8450 2.8450 3.7114 3.7114 3.7252 3.8322 3.8410 3.8410 3.9420 3.9420 3.9517 4.0112 4.0408 4.0408 4.2106 4.2844 4.2844 4.3021 4.4694 4.4694 4.6168 4.6621 4.6621 4.7023 4.7388 4.7388 5.8587 5.8587 5.8725 5.8847 5.9291 5.9291 7.7784 7.7784 7.7797 7.7797 8.1178 8.1178 8.4248 8.4294 8.4294 8.4315 10.4354 10.4354 11.5476 11.5476 k = 0.3235 0.3235 0.3235 ( 5926 PWs) bands (ev): -58.2229 -58.2229 -32.6664 -32.6664 -31.8430 -31.8430 -31.8430 -31.8430 -7.0467 -7.0467 -6.5725 -6.5725 -6.5698 -6.5662 -6.5238 -6.5238 0.7949 0.7949 0.7961 0.8056 1.1106 1.1106 1.6310 1.6310 2.0137 2.0380 2.0428 2.0428 2.2069 2.2115 2.2127 2.2127 2.2941 2.2941 2.6040 2.6040 2.8100 2.8335 2.8371 2.8371 3.7103 3.7103 3.7279 3.8385 3.8448 3.8448 3.9417 3.9417 3.9608 4.0144 4.0396 4.0396 4.2113 4.2882 4.2882 4.3030 4.4456 4.4456 4.6149 4.6551 4.6551 4.6978 4.7216 4.7216 5.8985 5.8987 5.8987 5.9095 5.9566 5.9566 7.7884 7.7884 7.7896 7.7898 8.1469 8.1469 8.4359 8.4414 8.4414 8.4431 10.4443 10.4443 11.4901 11.4904 k = 0.3333 0.3333 0.3333 ( 5926 PWs) bands (ev): -58.2229 -58.2229 -32.6664 -32.6664 -31.8431 -31.8431 -31.8431 -31.8431 -7.0227 -7.0227 -6.5798 -6.5798 -6.5770 -6.5735 -6.5310 -6.5310 0.7969 0.7969 0.7984 0.8078 1.0778 1.0778 1.6271 1.6271 2.0209 2.0449 2.0495 2.0495 2.2070 2.2123 2.2135 2.2135 2.2865 2.2865 2.6041 2.6041 2.8024 2.8247 2.8295 2.8295 3.7092 3.7092 3.7315 3.8450 3.8485 3.8485 3.9409 3.9409 3.9692 4.0168 4.0381 4.0381 4.2125 4.2917 4.2917 4.3040 4.4232 4.4232 4.6113 4.6474 4.6474 4.6915 4.7044 4.7044 5.9267 5.9366 5.9367 5.9367 5.9872 5.9872 7.7983 7.7983 7.7993 7.7997 8.1769 8.1769 8.4472 8.4533 8.4533 8.4547 10.4519 10.4519 11.4262 11.4264 k = 0.3431 0.3431 0.3431 ( 5938 PWs) bands (ev): -58.2229 -58.2229 -32.6664 -32.6664 -31.8431 -31.8431 -31.8431 -31.8431 -6.9991 -6.9991 -6.5868 -6.5868 -6.5839 -6.5806 -6.5382 -6.5382 0.7975 0.7975 0.7993 0.8084 1.0458 1.0458 1.6213 1.6213 2.0286 2.0525 2.0569 2.0569 2.2075 2.2138 2.2147 2.2147 2.2796 2.2796 2.6073 2.6073 2.7952 2.8163 2.8224 2.8224 3.7083 3.7083 3.7360 3.8519 3.8522 3.8522 3.9397 3.9397 3.9768 4.0184 4.0364 4.0364 4.2143 4.2948 4.2948 4.3048 4.4031 4.4031 4.6061 4.6386 4.6386 4.6834 4.6872 4.6872 5.9568 5.9655 5.9730 5.9730 6.0204 6.0204 7.8081 7.8081 7.8089 7.8094 8.2075 8.2075 8.4584 8.4651 8.4651 8.4662 10.4586 10.4586 11.3559 11.3562 k = 0.3529 0.3529 0.3529 ( 5926 PWs) bands (ev): -58.2229 -58.2229 -32.6664 -32.6664 -31.8431 -31.8431 -31.8431 -31.8431 -6.9758 -6.9758 -6.5935 -6.5935 -6.5905 -6.5873 -6.5454 -6.5454 0.7968 0.7968 0.7989 0.8078 1.0146 1.0146 1.6137 1.6137 2.0370 2.0610 2.0650 2.0650 2.2084 2.2157 2.2160 2.2160 2.2735 2.2735 2.6131 2.6131 2.7885 2.8083 2.8157 2.8157 3.7074 3.7074 3.7415 3.8559 3.8559 3.8592 3.9380 3.9380 3.9838 4.0193 4.0344 4.0344 4.2167 4.2974 4.2974 4.3058 4.3856 4.3856 4.5993 4.6285 4.6285 4.6703 4.6703 4.6736 5.9885 5.9962 6.0080 6.0080 6.0552 6.0552 7.8178 7.8178 7.8184 7.8190 8.2385 8.2385 8.4694 8.4765 8.4765 8.4775 10.4643 10.4643 11.2811 11.2823 k = 0.3627 0.3627 0.3627 ( 5920 PWs) bands (ev): -58.2229 -58.2229 -32.6664 -32.6664 -31.8431 -31.8431 -31.8431 -31.8431 -6.9531 -6.9531 -6.5998 -6.5998 -6.5967 -6.5937 -6.5527 -6.5527 0.7951 0.7951 0.7975 0.8061 0.9846 0.9846 1.6046 1.6046 2.0458 2.0701 2.0737 2.0737 2.2094 2.2171 2.2171 2.2180 2.2681 2.2681 2.6212 2.6212 2.7823 2.8008 2.8094 2.8094 3.7065 3.7065 3.7478 3.8597 3.8597 3.8666 3.9358 3.9358 3.9901 4.0195 4.0321 4.0321 4.2197 4.2994 4.2994 4.3068 4.3715 4.3715 4.5912 4.6168 4.6168 4.6539 4.6539 4.6622 6.0213 6.0281 6.0423 6.0423 6.0905 6.0905 7.8275 7.8275 7.8279 7.8285 8.2695 8.2695 8.4800 8.4875 8.4875 8.4882 10.4693 10.4693 11.2041 11.2060 k = 0.3725 0.3725 0.3725 ( 5926 PWs) bands (ev): -58.2229 -58.2229 -32.6665 -32.6665 -31.8431 -31.8431 -31.8431 -31.8431 -6.9310 -6.9310 -6.6058 -6.6058 -6.6026 -6.5997 -6.5599 -6.5599 0.7925 0.7925 0.7953 0.8034 0.9558 0.9558 1.5945 1.5945 2.0551 2.0798 2.0830 2.0830 2.2104 2.2177 2.2177 2.2205 2.2637 2.2637 2.6312 2.6312 2.7766 2.7937 2.8035 2.8035 3.7055 3.7055 3.7548 3.8633 3.8633 3.8741 3.9329 3.9329 3.9956 4.0188 4.0295 4.0295 4.2235 4.3005 4.3005 4.3079 4.3609 4.3609 4.5819 4.6036 4.6036 4.6378 4.6378 4.6494 6.0549 6.0608 6.0762 6.0762 6.1254 6.1254 7.8371 7.8371 7.8374 7.8380 8.3003 8.3003 8.4901 8.4978 8.4978 8.4983 10.4738 10.4738 11.1261 11.1287 k = 0.3824 0.3824 0.3824 ( 5929 PWs) bands (ev): -58.2229 -58.2229 -32.6665 -32.6665 -31.8432 -31.8432 -31.8432 -31.8432 -6.9096 -6.9096 -6.6114 -6.6114 -6.6081 -6.6054 -6.5672 -6.5672 0.7891 0.7891 0.7923 0.8000 0.9285 0.9285 1.5837 1.5837 2.0648 2.0900 2.0925 2.0925 2.2112 2.2178 2.2178 2.2229 2.2602 2.2602 2.6426 2.6426 2.7714 2.7871 2.7981 2.7981 3.7045 3.7045 3.7627 3.8670 3.8670 3.8816 3.9295 3.9295 4.0006 4.0176 4.0269 4.0269 4.2280 4.3008 4.3008 4.3092 4.3542 4.3542 4.5716 4.5891 4.5891 4.6223 4.6223 4.6353 6.0889 6.0939 6.1097 6.1097 6.1593 6.1593 7.8468 7.8468 7.8470 7.8476 8.3306 8.3306 8.4995 8.5073 8.5073 8.5077 10.4777 10.4777 11.0485 11.0516 k = 0.3922 0.3922 0.3922 ( 5926 PWs) bands (ev): -58.2229 -58.2229 -32.6665 -32.6665 -31.8432 -31.8432 -31.8432 -31.8432 -6.8889 -6.8889 -6.6166 -6.6166 -6.6132 -6.6107 -6.5746 -6.5746 0.7853 0.7853 0.7889 0.7960 0.9027 0.9027 1.5725 1.5725 2.0748 2.1005 2.1024 2.1024 2.2117 2.2172 2.2172 2.2251 2.2577 2.2577 2.6550 2.6550 2.7668 2.7810 2.7932 2.7932 3.7032 3.7032 3.7712 3.8705 3.8705 3.8889 3.9256 3.9256 4.0049 4.0158 4.0243 4.0243 4.2333 4.3005 4.3005 4.3107 4.3510 4.3510 4.5605 4.5737 4.5737 4.6069 4.6069 4.6201 6.1226 6.1269 6.1425 6.1425 6.1919 6.1919 7.8565 7.8565 7.8566 7.8571 8.3601 8.3601 8.5081 8.5159 8.5159 8.5161 10.4812 10.4812 10.9724 10.9759 k = 0.4020 0.4020 0.4020 ( 5938 PWs) bands (ev): -58.2229 -58.2229 -32.6665 -32.6665 -31.8432 -31.8432 -31.8432 -31.8432 -6.8690 -6.8690 -6.6214 -6.6214 -6.6178 -6.6155 -6.5820 -6.5820 0.7812 0.7812 0.7851 0.7917 0.8787 0.8787 1.5612 1.5612 2.0849 2.1113 2.1122 2.1122 2.2117 2.2159 2.2159 2.2269 2.2559 2.2559 2.6679 2.6679 2.7626 2.7754 2.7888 2.7888 3.7018 3.7018 3.7804 3.8740 3.8740 3.8957 3.9213 3.9213 4.0085 4.0136 4.0218 4.0218 4.2393 4.2999 4.2999 4.3124 4.3509 4.3509 4.5488 4.5577 4.5577 4.5917 4.5917 4.6040 6.1557 6.1594 6.1743 6.1743 6.2228 6.2228 7.8662 7.8662 7.8663 7.8667 8.3885 8.3885 8.5157 8.5234 8.5234 8.5235 10.4844 10.4844 10.8990 10.9028 k = 0.4118 0.4118 0.4118 ( 5950 PWs) bands (ev): -58.2229 -58.2229 -32.6665 -32.6665 -31.8432 -31.8432 -31.8432 -31.8432 -6.8500 -6.8500 -6.6258 -6.6258 -6.6221 -6.6200 -6.5895 -6.5895 0.7768 0.7768 0.7812 0.7872 0.8565 0.8565 1.5502 1.5502 2.0951 2.1220 2.1220 2.1221 2.2113 2.2143 2.2143 2.2283 2.2547 2.2547 2.6809 2.6809 2.7589 2.7703 2.7848 2.7848 3.7002 3.7002 3.7901 3.8773 3.8773 3.9018 3.9167 3.9167 4.0112 4.0115 4.0195 4.0195 4.2462 4.2997 4.2997 4.3143 4.3530 4.3530 4.5368 4.5416 4.5416 4.5765 4.5765 4.5873 6.1877 6.1907 6.2046 6.2046 6.2518 6.2518 7.8759 7.8759 7.8759 7.8763 8.4154 8.4154 8.5224 8.5298 8.5299 8.5299 10.4874 10.4874 10.8294 10.8334 k = 0.4216 0.4216 0.4216 ( 5944 PWs) bands (ev): -58.2229 -58.2229 -32.6665 -32.6665 -31.8432 -31.8432 -31.8432 -31.8432 -6.8320 -6.8320 -6.6298 -6.6298 -6.6259 -6.6241 -6.5969 -6.5969 0.7725 0.7725 0.7773 0.7827 0.8364 0.8364 1.5396 1.5396 2.1052 2.1315 2.1315 2.1328 2.2104 2.2125 2.2125 2.2291 2.2538 2.2538 2.6937 2.6937 2.7558 2.7658 2.7815 2.7815 3.6985 3.6985 3.8003 3.8804 3.8804 3.9069 3.9122 3.9122 4.0089 4.0138 4.0176 4.0176 4.2538 4.3003 4.3003 4.3164 4.3569 4.3569 4.5249 4.5257 4.5257 4.5613 4.5613 4.5703 6.2179 6.2205 6.2329 6.2329 6.2787 6.2787 7.8854 7.8854 7.8854 7.8857 8.4406 8.4406 8.5280 8.5349 8.5352 8.5352 10.4901 10.4901 10.7645 10.7685 k = 0.4314 0.4314 0.4314 ( 5932 PWs) bands (ev): -58.2229 -58.2229 -32.6665 -32.6665 -31.8432 -31.8432 -31.8432 -31.8432 -6.8150 -6.8150 -6.6334 -6.6334 -6.6293 -6.6277 -6.6044 -6.6044 0.7683 0.7683 0.7735 0.7783 0.8184 0.8184 1.5298 1.5298 2.1152 2.1406 2.1406 2.1434 2.2089 2.2107 2.2107 2.2293 2.2530 2.2530 2.7058 2.7058 2.7531 2.7617 2.7787 2.7787 3.6966 3.6966 3.8109 3.8831 3.8831 3.9078 3.9078 3.9107 4.0069 4.0156 4.0160 4.0160 4.2621 4.3019 4.3019 4.3187 4.3622 4.3622 4.5102 4.5102 4.5132 4.5462 4.5462 4.5533 6.2460 6.2481 6.2589 6.2589 6.3034 6.3034 7.8946 7.8947 7.8947 7.8949 8.4637 8.4637 8.5326 8.5389 8.5395 8.5395 10.4925 10.4925 10.7051 10.7090 k = 0.4412 0.4412 0.4412 ( 5935 PWs) bands (ev): -58.2229 -58.2229 -32.6666 -32.6666 -31.8432 -31.8432 -31.8432 -31.8432 -6.7993 -6.7993 -6.6365 -6.6365 -6.6323 -6.6308 -6.6118 -6.6118 0.7643 0.7643 0.7701 0.7742 0.8026 0.8026 1.5209 1.5209 2.1251 2.1491 2.1491 2.1536 2.2068 2.2091 2.2091 2.2287 2.2520 2.2520 2.7169 2.7169 2.7509 2.7582 2.7765 2.7765 3.6946 3.6946 3.8218 3.8853 3.8853 3.9040 3.9040 3.9128 4.0055 4.0147 4.0147 4.0167 4.2709 4.3043 4.3043 4.3210 4.3684 4.3684 4.4955 4.4955 4.5020 4.5313 4.5313 4.5366 6.2715 6.2731 6.2820 6.2820 6.3255 6.3255 7.9034 7.9035 7.9035 7.9036 8.4845 8.4845 8.5361 8.5418 8.5426 8.5426 10.4947 10.4947 10.6521 10.6558 k = 0.4510 0.4510 0.4510 ( 5941 PWs) bands (ev): -58.2229 -58.2229 -32.6666 -32.6666 -31.8433 -31.8433 -31.8433 -31.8433 -6.7849 -6.7849 -6.6392 -6.6392 -6.6347 -6.6335 -6.6189 -6.6189 0.7606 0.7606 0.7670 0.7705 0.7892 0.7892 1.5131 1.5131 2.1346 2.1566 2.1566 2.1631 2.2041 2.2080 2.2080 2.2273 2.2509 2.2509 2.7264 2.7264 2.7492 2.7552 2.7750 2.7750 3.6927 3.6927 3.8328 3.8868 3.8868 3.9010 3.9010 3.9128 4.0049 4.0137 4.0137 4.0172 4.2802 4.3074 4.3074 4.3232 4.3755 4.3755 4.4818 4.4818 4.4918 4.5168 4.5168 4.5206 6.2939 6.2952 6.3019 6.3019 6.3450 6.3450 7.9115 7.9115 7.9115 7.9116 8.5026 8.5026 8.5388 8.5437 8.5449 8.5449 10.4967 10.4967 10.6061 10.6094 k = 0.4608 0.4608 0.4608 ( 5938 PWs) bands (ev): -58.2229 -58.2229 -32.6666 -32.6666 -31.8433 -31.8433 -31.8433 -31.8433 -6.7721 -6.7721 -6.6415 -6.6415 -6.6368 -6.6358 -6.6257 -6.6257 0.7573 0.7573 0.7644 0.7672 0.7783 0.7783 1.5065 1.5065 2.1437 2.1630 2.1630 2.1719 2.2012 2.2073 2.2073 2.2250 2.2496 2.2496 2.7343 2.7343 2.7479 2.7526 2.7742 2.7742 3.6908 3.6908 3.8438 3.8873 3.8873 3.8992 3.8992 3.9108 4.0052 4.0130 4.0130 4.0171 4.2896 4.3110 4.3110 4.3250 4.3832 4.3832 4.4695 4.4695 4.4828 4.5030 4.5030 4.5057 6.3128 6.3138 6.3184 6.3184 6.3615 6.3615 7.9187 7.9187 7.9187 7.9187 8.5177 8.5177 8.5407 8.5448 8.5464 8.5464 10.4983 10.4983 10.5677 10.5705 k = 0.4706 0.4706 0.4706 ( 5929 PWs) bands (ev): -58.2229 -58.2229 -32.6666 -32.6666 -31.8433 -31.8433 -31.8433 -31.8433 -6.7612 -6.7612 -6.6435 -6.6435 -6.6383 -6.6376 -6.6317 -6.6317 0.7544 0.7544 0.7624 0.7645 0.7701 0.7701 1.5013 1.5013 2.1523 2.1681 2.1681 2.1789 2.1986 2.2072 2.2072 2.2219 2.2482 2.2482 2.7401 2.7401 2.7470 2.7505 2.7741 2.7741 3.6893 3.6893 3.8548 3.8868 3.8868 3.8987 3.8987 3.9067 4.0063 4.0126 4.0126 4.0165 4.2988 4.3145 4.3145 4.3261 4.3913 4.3913 4.4589 4.4589 4.4755 4.4904 4.4904 4.4926 6.3279 6.3286 6.3313 6.3313 6.3748 6.3748 7.9246 7.9246 7.9246 7.9246 8.5297 8.5297 8.5421 8.5452 8.5473 8.5473 10.4994 10.4994 10.5374 10.5396 k = 0.4804 0.4804 0.4804 ( 5923 PWs) bands (ev): -58.2229 -58.2229 -32.6666 -32.6666 -31.8433 -31.8433 -31.8433 -31.8433 -6.7527 -6.7527 -6.6451 -6.6451 -6.6394 -6.6389 -6.6363 -6.6363 0.7519 0.7519 0.7611 0.7625 0.7645 0.7645 1.4975 1.4975 2.1604 2.1716 2.1716 2.1820 2.1986 2.2075 2.2075 2.2180 2.2469 2.2469 2.7441 2.7441 2.7466 2.7489 2.7744 2.7744 3.6881 3.6881 3.8654 3.8859 3.8859 3.8988 3.8988 3.9009 4.0080 4.0123 4.0123 4.0154 4.3074 4.3176 4.3176 4.3259 4.3990 4.3990 4.4504 4.4504 4.4705 4.4797 4.4797 4.4817 6.3389 6.3394 6.3406 6.3406 6.3844 6.3844 7.9291 7.9291 7.9291 7.9291 8.5382 8.5382 8.5431 8.5452 8.5479 8.5479 10.5000 10.5000 10.5157 10.5172 k = 0.4902 0.4902 0.4902 ( 5904 PWs) bands (ev): -58.2229 -58.2229 -32.6666 -32.6666 -31.8433 -31.8433 -31.8433 -31.8433 -6.7472 -6.7472 -6.6465 -6.6465 -6.6400 -6.6397 -6.6392 -6.6392 0.7501 0.7501 0.7604 0.7611 0.7614 0.7614 1.4952 1.4952 2.1679 2.1738 2.1738 2.1797 2.2026 2.2079 2.2079 2.2134 2.2460 2.2460 2.7462 2.7462 2.7465 2.7477 2.7749 2.7749 3.6874 3.6874 3.8756 3.8853 3.8853 3.8936 3.8991 3.8991 4.0101 4.0121 4.0121 4.0139 4.3148 4.3197 4.3197 4.3242 4.4053 4.4053 4.4445 4.4445 4.4683 4.4722 4.4722 4.4739 6.3457 6.3459 6.3461 6.3461 6.3904 6.3904 7.9318 7.9318 7.9318 7.9318 8.5431 8.5431 8.5439 8.5449 8.5486 8.5486 10.4995 10.4995 10.5026 10.5034 k = 0.5000 0.5000 0.5000 ( 5904 PWs) bands (ev): -58.2229 -58.2229 -32.6666 -32.6666 -31.8433 -31.8433 -31.8433 -31.8433 -6.7453 -6.7453 -6.6471 -6.6471 -6.6401 -6.6401 -6.6401 -6.6401 0.7495 0.7495 0.7604 0.7604 0.7604 0.7604 1.4944 1.4944 2.1745 2.1745 2.1745 2.1745 2.2081 2.2081 2.2081 2.2081 2.2457 2.2457 2.7469 2.7469 2.7469 2.7469 2.7751 2.7751 3.6871 3.6871 3.8850 3.8850 3.8850 3.8850 3.8992 3.8992 4.0121 4.0121 4.0121 4.0121 4.3205 4.3205 4.3205 4.3205 4.4078 4.4078 4.4423 4.4423 4.4694 4.4694 4.4694 4.4694 6.3480 6.3480 6.3480 6.3480 6.3923 6.3923 7.9328 7.9328 7.9328 7.9328 8.5444 8.5444 8.5444 8.5444 8.5490 8.5490 10.4985 10.4985 10.4985 10.4985 k = 0.5000 0.5000 0.5000 ( 5904 PWs) bands (ev): -58.2229 -58.2229 -32.6666 -32.6666 -31.8433 -31.8433 -31.8433 -31.8433 -6.7453 -6.7453 -6.6471 -6.6471 -6.6401 -6.6401 -6.6401 -6.6401 0.7495 0.7495 0.7604 0.7604 0.7604 0.7604 1.4944 1.4944 2.1745 2.1745 2.1745 2.1745 2.2081 2.2081 2.2081 2.2081 2.2457 2.2457 2.7469 2.7469 2.7469 2.7469 2.7751 2.7751 3.6871 3.6871 3.8850 3.8850 3.8850 3.8850 3.8992 3.8992 4.0121 4.0121 4.0121 4.0121 4.3205 4.3205 4.3205 4.3205 4.4078 4.4078 4.4423 4.4423 4.4694 4.4694 4.4694 4.4694 6.3480 6.3480 6.3480 6.3480 6.3923 6.3923 7.9328 7.9328 7.9328 7.9328 8.5444 8.5444 8.5444 8.5444 8.5490 8.5490 10.4985 10.4985 10.4985 10.4985 k = 0.4881 0.5000 0.4881 ( 5904 PWs) bands (ev): -58.2229 -58.2229 -32.6666 -32.6666 -31.8433 -31.8433 -31.8433 -31.8433 -6.7472 -6.7472 -6.6465 -6.6465 -6.6400 -6.6398 -6.6391 -6.6390 0.7501 0.7501 0.7604 0.7611 0.7612 0.7614 1.4951 1.4951 2.1681 2.1723 2.1752 2.1795 2.2028 2.2066 2.2092 2.2131 2.2460 2.2461 2.7462 2.7465 2.7465 2.7476 2.7749 2.7749 3.6873 3.6874 3.8760 3.8829 3.8875 3.8933 3.8991 3.8991 4.0102 4.0116 4.0126 4.0139 4.3149 4.3186 4.3208 4.3242 4.4052 4.4056 4.4439 4.4449 4.4684 4.4717 4.4723 4.4741 6.3455 6.3456 6.3464 6.3465 6.3904 6.3904 7.9313 7.9313 7.9324 7.9324 8.5429 8.5434 8.5439 8.5448 8.5485 8.5487 10.4998 10.5001 10.5022 10.5028 k = 0.4762 0.5000 0.4762 ( 5926 PWs) bands (ev): -58.2229 -58.2229 -32.6666 -32.6666 -31.8433 -31.8433 -31.8433 -31.8433 -6.7525 -6.7525 -6.6455 -6.6454 -6.6396 -6.6391 -6.6361 -6.6359 0.7519 0.7519 0.7613 0.7627 0.7639 0.7643 1.4974 1.4974 2.1608 2.1691 2.1740 2.1827 2.1977 2.2056 2.2096 2.2177 2.2469 2.2471 2.7441 2.7447 2.7463 2.7485 2.7744 2.7744 3.6880 3.6881 3.8663 3.8813 3.8900 3.8987 3.8989 3.9006 4.0082 4.0112 4.0132 4.0154 4.3071 4.3160 4.3189 4.3265 4.3989 4.4010 4.4461 4.4518 4.4712 4.4780 4.4798 4.4832 6.3380 6.3384 6.3415 6.3418 6.3846 6.3847 7.9270 7.9271 7.9312 7.9312 8.5377 8.5393 8.5431 8.5449 8.5475 8.5483 10.5026 10.5037 10.5116 10.5122 k = 0.4643 0.5000 0.4643 ( 5934 PWs) bands (ev): -58.2229 -58.2229 -32.6666 -32.6666 -31.8433 -31.8433 -31.8433 -31.8433 -6.7607 -6.7607 -6.6447 -6.6445 -6.6384 -6.6377 -6.6310 -6.6306 0.7544 0.7544 0.7633 0.7652 0.7687 0.7694 1.5011 1.5012 2.1528 2.1652 2.1702 2.1835 2.1931 2.2064 2.2091 2.2216 2.2482 2.2488 2.7406 2.7416 2.7463 2.7496 2.7739 2.7740 3.6892 3.6893 3.8561 3.8802 3.8920 3.8980 3.8992 3.9070 4.0065 4.0109 4.0138 4.0166 4.2975 4.3128 4.3151 4.3276 4.3923 4.3967 4.4474 4.4610 4.4779 4.4865 4.4919 4.4954 6.3257 6.3263 6.3335 6.3339 6.3753 6.3756 7.9202 7.9203 7.9292 7.9292 8.5290 8.5316 8.5421 8.5444 8.5469 8.5479 10.5063 10.5082 10.5253 10.5253 k = 0.4524 0.5000 0.4524 ( 5938 PWs) bands (ev): -58.2229 -58.2229 -32.6666 -32.6666 -31.8433 -31.8433 -31.8433 -31.8433 -6.7712 -6.7711 -6.6444 -6.6442 -6.6363 -6.6354 -6.6244 -6.6239 0.7570 0.7573 0.7667 0.7688 0.7757 0.7766 1.5063 1.5063 2.1442 2.1607 2.1637 2.1826 2.1883 2.2076 2.2091 2.2249 2.2499 2.2511 2.7355 2.7369 2.7464 2.7507 2.7740 2.7741 3.6906 3.6910 3.8456 3.8797 3.8923 3.8973 3.9005 3.9127 4.0053 4.0108 4.0143 4.0177 4.2868 4.3093 4.3101 4.3270 4.3874 4.3939 4.4482 4.4706 4.4877 4.4982 4.5062 4.5096 6.3084 6.3094 6.3223 6.3228 6.3630 6.3636 7.9111 7.9113 7.9264 7.9265 8.5170 8.5206 8.5407 8.5432 8.5462 8.5472 10.5112 10.5138 10.5434 10.5437 k = 0.4405 0.5000 0.4405 ( 5936 PWs) bands (ev): -58.2229 -58.2229 -32.6666 -32.6666 -31.8433 -31.8433 -31.8432 -31.8432 -6.7833 -6.7832 -6.6446 -6.6443 -6.6332 -6.6322 -6.6170 -6.6164 0.7594 0.7602 0.7715 0.7736 0.7849 0.7861 1.5128 1.5129 2.1350 2.1555 2.1556 2.1800 2.1836 2.2054 2.2128 2.2278 2.2518 2.2536 2.7286 2.7304 2.7463 2.7515 2.7750 2.7750 3.6923 3.6930 3.8350 3.8795 3.8913 3.8965 3.9020 3.9182 4.0047 4.0107 4.0147 4.0186 4.2757 4.3046 4.3056 4.3245 4.3851 4.3932 4.4492 4.4799 4.4995 4.5131 4.5217 4.5248 6.2865 6.2879 6.3078 6.3086 6.3480 6.3490 7.9003 7.9007 7.9229 7.9230 8.5020 8.5064 8.5387 8.5414 8.5450 8.5459 10.5177 10.5209 10.5665 10.5671 k = 0.4286 0.5000 0.4286 ( 5928 PWs) bands (ev): -58.2229 -58.2229 -32.6666 -32.6666 -31.8433 -31.8433 -31.8432 -31.8432 -6.7967 -6.7965 -6.6450 -6.6448 -6.6294 -6.6283 -6.6089 -6.6083 0.7618 0.7632 0.7775 0.7797 0.7963 0.7978 1.5206 1.5207 2.1254 2.1461 2.1500 2.1746 2.1803 2.2023 2.2169 2.2303 2.2538 2.2562 2.7201 2.7222 2.7462 2.7522 2.7770 2.7772 3.6941 3.6950 3.8246 3.8795 3.8895 3.8958 3.9025 3.9240 4.0050 4.0108 4.0148 4.0196 4.2646 4.2989 4.3017 4.3203 4.3854 4.3943 4.4510 4.4893 4.5123 4.5306 4.5381 4.5404 6.2602 6.2620 6.2902 6.2912 6.3307 6.3322 7.8881 7.8887 7.9185 7.9187 8.4842 8.4893 8.5359 8.5388 8.5430 8.5439 10.5258 10.5295 10.5945 10.5953 k = 0.4167 0.5000 0.4167 ( 5940 PWs) bands (ev): -58.2229 -58.2229 -32.6665 -32.6665 -31.8433 -31.8433 -31.8432 -31.8432 -6.8112 -6.8110 -6.6458 -6.6456 -6.6248 -6.6236 -6.6006 -6.5999 0.7642 0.7662 0.7847 0.7869 0.8098 0.8114 1.5294 1.5297 2.1153 2.1359 2.1440 2.1676 2.1774 2.1985 2.2209 2.2325 2.2560 2.2588 2.7097 2.7122 2.7461 2.7527 2.7801 2.7806 3.6957 3.6967 3.8145 3.8793 3.8871 3.8956 3.9016 3.9302 4.0058 4.0111 4.0145 4.0206 4.2539 4.2934 4.2981 4.3153 4.3875 4.3968 4.4539 4.4988 4.5254 4.5495 4.5551 4.5562 6.2302 6.2323 6.2696 6.2708 6.3113 6.3132 7.8751 7.8760 7.9134 7.9138 8.4639 8.4696 8.5322 8.5355 8.5399 8.5409 10.5356 10.5399 10.6273 10.6282 k = 0.4048 0.5000 0.4048 ( 5944 PWs) bands (ev): -58.2229 -58.2229 -32.6665 -32.6665 -31.8433 -31.8432 -31.8432 -31.8432 -6.8265 -6.8262 -6.6468 -6.6467 -6.6195 -6.6182 -6.5921 -6.5913 0.7666 0.7692 0.7929 0.7950 0.8250 0.8268 1.5393 1.5397 2.1049 2.1253 2.1376 2.1597 2.1741 2.1941 2.2249 2.2344 2.2585 2.2615 2.6979 2.7006 2.7463 2.7534 2.7842 2.7851 3.6971 3.6979 3.8053 3.8788 3.8842 3.8960 3.8996 3.9369 4.0071 4.0118 4.0138 4.0217 4.2440 4.2884 4.2950 4.3103 4.3908 4.4004 4.4581 4.5090 4.5384 4.5675 4.5727 4.5738 6.1970 6.1994 6.2465 6.2478 6.2900 6.2921 7.8616 7.8628 7.9075 7.9081 8.4415 8.4477 8.5274 8.5311 8.5357 8.5368 10.5473 10.5521 10.6646 10.6656 k = 0.3929 0.5000 0.3929 ( 5956 PWs) bands (ev): -58.2229 -58.2229 -32.6665 -32.6665 -31.8432 -31.8432 -31.8432 -31.8432 -6.8425 -6.8422 -6.6482 -6.6480 -6.6135 -6.6121 -6.5835 -6.5826 0.7691 0.7722 0.8018 0.8041 0.8420 0.8439 1.5501 1.5506 2.0943 2.1142 2.1310 2.1512 2.1705 2.1892 2.2286 2.2362 2.2612 2.2642 2.6846 2.6876 2.7468 2.7545 2.7892 2.7904 3.6979 3.6980 3.7972 3.8777 3.8806 3.8971 3.8973 3.9439 4.0083 4.0129 4.0130 4.0229 4.2349 4.2839 4.2926 4.3059 4.3946 4.4043 4.4639 4.5198 4.5505 4.5823 4.5910 4.5949 6.1613 6.1637 6.2209 6.2223 6.2668 6.2690 7.8479 7.8495 7.9009 7.9017 8.4171 8.4237 8.5214 8.5256 8.5302 8.5316 10.5609 10.5661 10.7063 10.7073 k = 0.3810 0.5000 0.3810 ( 5948 PWs) bands (ev): -58.2229 -58.2229 -32.6665 -32.6665 -31.8432 -31.8432 -31.8432 -31.8432 -6.8590 -6.8587 -6.6498 -6.6497 -6.6069 -6.6054 -6.5748 -6.5739 0.7716 0.7752 0.8115 0.8138 0.8606 0.8625 1.5614 1.5622 2.0835 2.1030 2.1240 2.1423 2.1665 2.1840 2.2321 2.2379 2.2645 2.2672 2.6701 2.6732 2.7479 2.7562 2.7951 2.7966 3.6966 3.6981 3.7908 3.8761 3.8762 3.8949 3.8993 3.9510 4.0090 4.0118 4.0152 4.0241 4.2270 4.2803 4.2913 4.3024 4.3985 4.4083 4.4716 4.5313 4.5615 4.5951 4.6099 4.6176 6.1237 6.1261 6.1935 6.1949 6.2417 6.2439 7.8344 7.8364 7.8935 7.8946 8.3913 8.3980 8.5142 8.5189 8.5234 8.5251 10.5762 10.5818 10.7521 10.7531 k = 0.3690 0.5000 0.3690 ( 5940 PWs) bands (ev): -58.2229 -58.2229 -32.6665 -32.6665 -31.8432 -31.8432 -31.8431 -31.8431 -6.8761 -6.8757 -6.6518 -6.6517 -6.5997 -6.5981 -6.5660 -6.5650 0.7739 0.7780 0.8218 0.8242 0.8805 0.8824 1.5732 1.5742 2.0727 2.0917 2.1169 2.1330 2.1623 2.1783 2.2353 2.2396 2.2683 2.2704 2.6544 2.6577 2.7498 2.7587 2.8017 2.8034 3.6934 3.6975 3.7862 3.8709 3.8741 3.8936 3.9019 3.9578 4.0095 4.0107 4.0178 4.0254 4.2203 4.2774 4.2910 4.3001 4.4022 4.4120 4.4810 4.5435 4.5710 4.6064 4.6294 4.6413 6.0850 6.0872 6.1645 6.1658 6.2148 6.2168 7.8211 7.8235 7.8852 7.8868 8.3644 8.3711 8.5057 8.5108 8.5154 8.5173 10.5934 10.5993 10.8018 10.8029 k = 0.3571 0.5000 0.3571 ( 5936 PWs) bands (ev): -58.2229 -58.2229 -32.6665 -32.6665 -31.8432 -31.8432 -31.8431 -31.8431 -6.8936 -6.8931 -6.6540 -6.6540 -6.5920 -6.5903 -6.5572 -6.5561 0.7761 0.7807 0.8325 0.8351 0.9016 0.9035 1.5853 1.5866 2.0619 2.0803 2.1097 2.1235 2.1577 2.1724 2.2383 2.2414 2.2726 2.2740 2.6378 2.6411 2.7526 2.7619 2.8090 2.8108 3.6884 3.6959 3.7836 3.8651 3.8719 3.8932 3.9047 3.9641 4.0096 4.0098 4.0205 4.0267 4.2149 4.2755 4.2919 4.2989 4.4055 4.4154 4.4919 4.5564 4.5789 4.6158 4.6494 4.6656 6.0458 6.0475 6.1343 6.1355 6.1862 6.1878 7.8083 7.8112 7.8761 7.8782 8.3368 8.3434 8.4959 8.5014 8.5062 8.5081 10.6121 10.6183 10.8552 10.8563 k = 0.3452 0.5000 0.3452 ( 5936 PWs) bands (ev): -58.2229 -58.2229 -32.6665 -32.6665 -31.8432 -31.8432 -31.8431 -31.8431 -6.9113 -6.9109 -6.6566 -6.6566 -6.5837 -6.5819 -6.5482 -6.5471 0.7780 0.7830 0.8436 0.8463 0.9237 0.9255 1.5973 1.5990 2.0512 2.0691 2.1024 2.1139 2.1530 2.1663 2.2413 2.2435 2.2777 2.2780 2.6204 2.6237 2.7564 2.7661 2.8170 2.8188 3.6816 3.6931 3.7826 3.8589 3.8694 3.8940 3.9076 3.9697 4.0086 4.0101 4.0232 4.0281 4.2109 4.2746 4.2939 4.2991 4.4084 4.4185 4.5040 4.5699 4.5850 4.6234 4.6698 4.6904 6.0065 6.0075 6.1033 6.1041 6.1561 6.1570 7.7960 7.7994 7.8661 7.8689 8.3090 8.3151 8.4851 8.4905 8.4958 8.4976 10.6323 10.6387 10.9121 10.9131 k = 0.3333 0.5000 0.3333 ( 5944 PWs) bands (ev): -58.2229 -58.2229 -32.6665 -32.6665 -31.8432 -31.8432 -31.8431 -31.8431 -6.9293 -6.9288 -6.6596 -6.6595 -6.5750 -6.5731 -6.5392 -6.5381 0.7795 0.7849 0.8550 0.8577 0.9466 0.9482 1.6090 1.6111 2.0406 2.0580 2.0951 2.1043 2.1481 2.1601 2.2445 2.2461 2.2824 2.2833 2.6024 2.6056 2.7614 2.7714 2.8255 2.8273 3.6737 3.6893 3.7827 3.8526 3.8668 3.8959 3.9103 3.9743 4.0079 4.0102 4.0257 4.0295 4.2084 4.2747 4.2970 4.3005 4.4105 4.4216 4.5168 4.5839 4.5896 4.6289 4.6904 4.7155 5.9676 5.9676 6.0718 6.0722 6.1245 6.1247 7.7843 7.7881 7.8551 7.8587 8.2814 8.2868 8.4731 8.4783 8.4845 8.4857 10.6538 10.6603 10.9720 10.9731 k = 0.3214 0.5000 0.3214 ( 5936 PWs) bands (ev): -58.2229 -58.2229 -32.6664 -32.6664 -31.8432 -31.8432 -31.8430 -31.8430 -6.9474 -6.9469 -6.6629 -6.6628 -6.5658 -6.5639 -6.5302 -6.5290 0.7805 0.7863 0.8664 0.8693 0.9701 0.9716 1.6202 1.6229 2.0303 2.0472 2.0879 2.0949 2.1430 2.1538 2.2483 2.2494 2.2874 2.2895 2.5839 2.5870 2.7675 2.7777 2.8346 2.8363 3.6650 3.6844 3.7835 3.8465 3.8642 3.8990 3.9124 3.9780 4.0075 4.0103 4.0280 4.0312 4.2074 4.2759 4.3010 4.3032 4.4121 4.4248 4.5295 4.5930 4.5981 4.6326 4.7112 4.7407 5.9282 5.9296 6.0399 6.0402 6.0906 6.0923 7.7733 7.7775 7.8430 7.8476 8.2545 8.2590 8.4600 8.4647 8.4722 8.4727 10.6762 10.6827 11.0349 11.0360 k = 0.3095 0.5000 0.3095 ( 5932 PWs) bands (ev): -58.2229 -58.2229 -32.6664 -32.6664 -31.8432 -31.8432 -31.8430 -31.8430 -6.9656 -6.9651 -6.6665 -6.6664 -6.5562 -6.5542 -6.5210 -6.5198 0.7809 0.7871 0.8779 0.8808 0.9940 0.9952 1.6307 1.6339 2.0204 2.0368 2.0809 2.0857 2.1379 2.1475 2.2527 2.2536 2.2928 2.2961 2.5651 2.5680 2.7749 2.7851 2.8443 2.8457 3.6559 3.6785 3.7846 3.8404 3.8616 3.9032 3.9138 3.9805 4.0076 4.0101 4.0302 4.0333 4.2078 4.2780 4.3055 4.3073 4.4129 4.4282 4.5409 4.5966 4.6117 4.6352 4.7321 4.7661 5.8894 5.8926 6.0075 6.0087 6.0556 6.0595 7.7628 7.7676 7.8297 7.8354 8.2287 8.2320 8.4459 8.4497 8.4587 8.4593 10.6993 10.7059 11.1003 11.1015 k = 0.2976 0.5000 0.2976 ( 5932 PWs) bands (ev): -58.2229 -58.2229 -32.6664 -32.6664 -31.8432 -31.8432 -31.8430 -31.8430 -6.9838 -6.9832 -6.6703 -6.6703 -6.5463 -6.5443 -6.5118 -6.5106 0.7807 0.7872 0.8891 0.8922 1.0180 1.0190 1.6403 1.6441 2.0109 2.0268 2.0742 2.0770 2.1326 2.1413 2.2579 2.2589 2.2987 2.3032 2.5462 2.5489 2.7837 2.7937 2.8544 2.8557 3.6467 3.6719 3.7857 3.8346 3.8589 3.9083 3.9143 3.9819 4.0080 4.0095 4.0322 4.0359 4.2096 4.2808 4.3102 4.3126 4.4128 4.4319 4.5483 4.6027 4.6204 4.6409 4.7530 4.7913 5.8512 5.8566 5.9753 5.9778 6.0198 6.0266 7.7531 7.7582 7.8151 7.8220 8.2044 8.2063 8.4307 8.4335 8.4440 8.4459 10.7228 10.7294 11.1681 11.1693 k = 0.2857 0.5000 0.2857 ( 5944 PWs) bands (ev): -58.2230 -58.2230 -32.6664 -32.6664 -31.8432 -31.8432 -31.8430 -31.8430 -7.0019 -7.0013 -6.6745 -6.6745 -6.5361 -6.5340 -6.5026 -6.5013 0.7797 0.7865 0.9001 0.9032 1.0420 1.0426 1.6489 1.6533 2.0019 2.0175 2.0678 2.0687 2.1274 2.1351 2.2642 2.2652 2.3051 2.3106 2.5274 2.5297 2.7938 2.8034 2.8651 2.8660 3.6377 3.6646 3.7865 3.8290 3.8563 3.9135 3.9144 3.9822 4.0086 4.0087 4.0342 4.0392 4.2128 4.2843 4.3147 4.3191 4.4119 4.4359 4.5498 4.6136 4.6200 4.6540 4.7737 4.8164 5.8134 5.8214 5.9436 5.9477 5.9838 5.9943 7.7439 7.7494 7.7990 7.8074 8.1820 8.1823 8.4144 8.4162 8.4289 8.4320 10.7465 10.7529 11.2378 11.2391 k = 0.2738 0.5000 0.2738 ( 5942 PWs) bands (ev): -58.2230 -58.2230 -32.6664 -32.6664 -31.8432 -31.8432 -31.8429 -31.8429 -7.0199 -7.0193 -6.6789 -6.6789 -6.5257 -6.5236 -6.4933 -6.4920 0.7779 0.7850 0.9107 0.9139 1.0657 1.0659 1.6563 1.6613 1.9936 2.0088 2.0611 2.0619 2.1222 2.1290 2.2714 2.2727 2.3120 2.3185 2.5087 2.5107 2.8053 2.8144 2.8763 2.8769 3.6292 3.6570 3.7869 3.8235 3.8538 3.9116 3.9212 3.9814 4.0073 4.0096 4.0362 4.0435 4.2171 4.2883 4.3185 4.3267 4.4102 4.4403 4.5455 4.6143 4.6294 4.6707 4.7942 4.8412 5.7755 5.7867 5.9127 5.9187 5.9484 5.9632 7.7354 7.7413 7.7816 7.7913 8.1604 8.1619 8.3969 8.3978 8.4137 8.4179 10.7699 10.7762 11.3092 11.3107 k = 0.2619 0.5000 0.2619 ( 5954 PWs) bands (ev): -58.2230 -58.2230 -32.6663 -32.6663 -31.8431 -31.8431 -31.8429 -31.8429 -7.0376 -7.0370 -6.6835 -6.6835 -6.5151 -6.5129 -6.4841 -6.4828 0.7753 0.7826 0.9207 0.9240 1.0887 1.0889 1.6624 1.6681 1.9860 2.0009 2.0542 2.0565 2.1169 2.1231 2.2796 2.2813 2.3195 2.3266 2.4904 2.4920 2.8182 2.8266 2.8880 2.8882 3.6210 3.6491 3.7869 3.8183 3.8514 3.9086 3.9287 3.9794 4.0059 4.0103 4.0381 4.0489 4.2225 4.2927 4.3213 4.3352 4.4077 4.4449 4.5371 4.6054 4.6488 4.6891 4.8143 4.8656 5.7369 5.7518 5.8832 5.8908 5.9145 5.9339 7.7275 7.7336 7.7627 7.7738 8.1409 8.1442 8.3783 8.3787 8.3986 8.4036 10.7929 10.7990 11.3818 11.3836 k = 0.2500 0.5000 0.2500 ( 5940 PWs) bands (ev): -58.2230 -58.2230 -32.6663 -32.6663 -31.8431 -31.8431 -31.8429 -31.8429 -7.0551 -7.0545 -6.6882 -6.6882 -6.5043 -6.5022 -6.4748 -6.4736 0.7718 0.7792 0.9302 0.9335 1.1108 1.1114 1.6674 1.6736 1.9794 1.9940 2.0480 2.0516 2.1118 2.1174 2.2887 2.2908 2.3274 2.3350 2.4727 2.4738 2.8325 2.8400 2.9000 2.9002 3.6135 3.6412 3.7863 3.8133 3.8492 3.9046 3.9368 3.9763 4.0046 4.0110 4.0402 4.0553 4.2288 4.2974 4.3228 4.3442 4.4047 4.4492 4.5263 4.5942 4.6708 4.7086 4.8340 4.8894 5.6973 5.7160 5.8554 5.8637 5.8837 5.9070 7.7201 7.7265 7.7425 7.7550 8.1239 8.1290 8.3589 8.3590 8.3837 8.3894 10.8152 10.8210 11.4554 11.4575 k = 0.2381 0.5000 0.2381 ( 5950 PWs) bands (ev): -58.2230 -58.2230 -32.6663 -32.6663 -31.8431 -31.8431 -31.8428 -31.8428 -7.0722 -7.0716 -6.6931 -6.6931 -6.4935 -6.4913 -6.4657 -6.4644 0.7674 0.7749 0.9390 0.9423 1.1320 1.1330 1.6711 1.6779 1.9737 1.9880 2.0427 2.0473 2.1068 2.1118 2.2985 2.3009 2.3358 2.3437 2.4557 2.4562 2.8483 2.8546 2.9122 2.9129 3.6065 3.6332 3.7850 3.8084 3.8472 3.8998 3.9451 3.9720 4.0034 4.0115 4.0424 4.0624 4.2357 4.3023 4.3229 4.3530 4.4014 4.4522 4.5146 4.5810 4.6948 4.7289 4.8532 4.9125 5.6561 5.6787 5.8297 5.8365 5.8577 5.8827 7.7131 7.7194 7.7217 7.7349 8.1096 8.1163 8.3389 8.3390 8.3691 8.3752 10.8365 10.8419 11.5295 11.5321 k = 0.2262 0.5000 0.2262 ( 5950 PWs) bands (ev): -58.2230 -58.2230 -32.6663 -32.6663 -31.8431 -31.8431 -31.8428 -31.8428 -7.0889 -7.0884 -6.6981 -6.6981 -6.4827 -6.4805 -6.4566 -6.4554 0.7622 0.7697 0.9470 0.9503 1.1520 1.1535 1.6738 1.6810 1.9691 1.9832 2.0382 2.0437 2.1018 2.1065 2.3087 2.3115 2.3447 2.3525 2.4394 2.4395 2.8653 2.8705 2.9250 2.9262 3.6002 3.6254 3.7830 3.8036 3.8454 3.8945 3.9537 3.9667 4.0024 4.0120 4.0446 4.0701 4.2430 4.3072 4.3216 4.3605 4.3993 4.4524 4.5043 4.5662 4.7205 4.7500 4.8716 4.9348 5.6131 5.6395 5.8063 5.8098 5.8367 5.8613 7.6988 7.7061 7.7140 7.7143 8.0977 8.1060 8.3187 8.3189 8.3548 8.3612 10.8565 10.8615 11.6036 11.6068 k = 0.2143 0.5000 0.2143 ( 5954 PWs) bands (ev): -58.2230 -58.2230 -32.6663 -32.6663 -31.8431 -31.8431 -31.8428 -31.8428 -7.1052 -7.1046 -6.7032 -6.7032 -6.4719 -6.4698 -6.4477 -6.4465 0.7561 0.7637 0.9543 0.9575 1.1708 1.1728 1.6754 1.6830 1.9657 1.9796 2.0346 2.0406 2.0970 2.1014 2.3190 2.3221 2.3539 2.3614 2.4237 2.4245 2.8837 2.8876 2.9383 2.9401 3.5946 3.6177 3.7802 3.7990 3.8439 3.8888 3.9599 3.9629 4.0018 4.0124 4.0469 4.0781 4.2504 4.3121 4.3188 4.3640 4.4005 4.4472 4.4983 4.5502 4.7475 4.7718 4.8894 4.9561 5.5686 5.5982 5.7848 5.7853 5.8199 5.8429 7.6760 7.6903 7.7021 7.7083 8.0882 8.0978 8.2987 8.2988 8.3410 8.3475 10.8751 10.8797 11.6773 11.6814 k = 0.2024 0.5000 0.2024 ( 5950 PWs) bands (ev): -58.2230 -58.2230 -32.6663 -32.6663 -31.8431 -31.8431 -31.8427 -31.8427 -7.1209 -7.1203 -6.7082 -6.7082 -6.4613 -6.4592 -6.4389 -6.4377 0.7493 0.7568 0.9607 0.9639 1.1882 1.1907 1.6761 1.6839 1.9635 1.9774 2.0318 2.0382 2.0924 2.0966 2.3291 2.3325 2.3633 2.3702 2.4093 2.4110 2.9032 2.9058 2.9522 2.9546 3.5896 3.6103 3.7765 3.7946 3.8428 3.8830 3.9533 3.9712 4.0014 4.0128 4.0493 4.0862 4.2572 4.3148 4.3166 4.3621 4.4068 4.4365 4.4976 4.5336 4.7754 4.7941 4.9063 4.9761 5.5227 5.5551 5.7622 5.7668 5.8065 5.8276 7.6528 7.6680 7.6964 7.7030 8.0806 8.0914 8.2791 8.2792 8.3275 8.3342 10.8920 10.8962 11.7497 11.7551 k = 0.1905 0.5000 0.1905 ( 5952 PWs) bands (ev): -58.2230 -58.2230 -32.6662 -32.6662 -31.8431 -31.8431 -31.8427 -31.8427 -7.1360 -7.1355 -6.7132 -6.7132 -6.4508 -6.4487 -6.4304 -6.4292 0.7419 0.7492 0.9662 0.9694 1.2042 1.2070 1.6761 1.6839 1.9626 1.9764 2.0297 2.0363 2.0879 2.0920 2.3381 2.3422 2.3722 2.3781 2.3972 2.4003 2.9238 2.9251 2.9666 2.9696 3.5851 3.6030 3.7721 3.7902 3.8420 3.8774 3.9459 3.9797 4.0012 4.0133 4.0518 4.0941 4.2627 4.3099 4.3204 4.3565 4.4164 4.4232 4.5003 4.5167 4.8037 4.8167 4.9223 4.9947 5.4757 5.5106 5.7424 5.7508 5.7960 5.8150 7.6296 7.6451 7.6914 7.6982 8.0747 8.0864 8.2603 8.2606 8.3147 8.3213 10.9072 10.9108 11.8193 11.8271 k = 0.1786 0.5000 0.1786 ( 5948 PWs) bands (ev): -58.2230 -58.2230 -32.6662 -32.6662 -31.8431 -31.8431 -31.8427 -31.8427 -7.1505 -7.1500 -6.7182 -6.7181 -6.4406 -6.4386 -6.4221 -6.4210 0.7339 0.7409 0.9710 0.9740 1.2186 1.2218 1.6753 1.6831 1.9631 1.9769 2.0284 2.0350 2.0835 2.0877 2.3448 2.3499 2.3771 2.3819 2.3919 2.3967 2.9452 2.9453 2.9816 2.9853 3.5810 3.5959 3.7670 3.7860 3.8416 3.8721 3.9382 3.9879 4.0012 4.0138 4.0542 4.1016 4.2657 4.3040 4.3224 4.3495 4.4104 4.4276 4.5006 4.5046 4.8319 4.8392 4.9373 5.0116 5.4281 5.4651 5.7257 5.7376 5.7879 5.8049 7.6067 7.6221 7.6870 7.6937 8.0698 8.0823 8.2427 8.2432 8.3024 8.3090 10.9205 10.9236 11.8714 11.8824 k = 0.1667 0.5000 0.1667 ( 5930 PWs) bands (ev): -58.2230 -58.2230 -32.6662 -32.6662 -31.8431 -31.8431 -31.8427 -31.8427 -7.1643 -7.1638 -6.7230 -6.7230 -6.4306 -6.4287 -6.4141 -6.4130 0.7254 0.7323 0.9750 0.9779 1.2315 1.2350 1.6739 1.6815 1.9650 1.9787 2.0278 2.0342 2.0794 2.0836 2.3467 2.3522 2.3768 2.3819 2.3977 2.4023 2.9662 2.9675 2.9971 3.0015 3.5772 3.5889 3.7613 3.7819 3.8415 3.8675 3.9304 3.9958 4.0017 4.0145 4.0565 4.1085 4.2650 4.2969 4.3210 4.3432 4.4009 4.4391 4.4865 4.5097 4.8595 4.8615 4.9512 5.0265 5.3802 5.4191 5.7123 5.7274 5.7819 5.7970 7.5843 7.5995 7.6829 7.6896 8.0656 8.0785 8.2269 8.2276 8.2908 8.2972 10.9318 10.9343 11.8193 11.8282 k = 0.1548 0.5000 0.1548 ( 5946 PWs) bands (ev): -58.2230 -58.2230 -32.6662 -32.6662 -31.8430 -31.8430 -31.8426 -31.8426 -7.1773 -7.1768 -6.7276 -6.7276 -6.4211 -6.4192 -6.4064 -6.4054 0.7167 0.7232 0.9782 0.9810 1.2428 1.2465 1.6721 1.6794 1.9680 1.9818 2.0277 2.0338 2.0754 2.0798 2.3428 2.3469 2.3813 2.3853 2.4065 2.4103 2.9877 2.9901 3.0131 3.0183 3.5733 3.5819 3.7553 3.7778 3.8415 3.8636 3.9225 4.0012 4.0044 4.0153 4.0583 4.1143 4.2605 4.2876 4.3147 4.3387 4.3968 4.4487 4.4771 4.5152 4.8832 4.8858 4.9639 5.0391 5.3325 5.3729 5.7022 5.7202 5.7776 5.7908 7.5626 7.5774 7.6793 7.6857 8.0612 8.0743 8.2135 8.2143 8.2798 8.2861 10.9410 10.9429 11.7448 11.7566 k = 0.1429 0.5000 0.1429 ( 5938 PWs) bands (ev): -58.2230 -58.2230 -32.6662 -32.6662 -31.8430 -31.8430 -31.8426 -31.8426 -7.1896 -7.1891 -6.7321 -6.7321 -6.4119 -6.4101 -6.3991 -6.3982 0.7078 0.7140 0.9808 0.9834 1.2527 1.2565 1.6698 1.6767 1.9722 1.9860 2.0281 2.0337 2.0717 2.0763 2.3359 2.3387 2.3887 2.3915 2.4154 2.4185 3.0096 3.0129 3.0297 3.0357 3.5693 3.5749 3.7494 3.7738 3.8417 3.8608 3.9149 4.0023 4.0113 4.0162 4.0596 4.1191 4.2530 4.2753 4.3050 4.3339 4.3987 4.4521 4.4782 4.5211 4.9041 4.9103 4.9755 5.0492 5.2853 5.3272 5.6957 5.7161 5.7747 5.7862 7.5419 7.5560 7.6760 7.6823 8.0562 8.0692 8.2030 8.2038 8.2696 8.2756 10.9481 10.9493 11.6714 11.6843 k = 0.1310 0.5000 0.1310 ( 5942 PWs) bands (ev): -58.2230 -58.2230 -32.6662 -32.6662 -31.8430 -31.8430 -31.8426 -31.8426 -7.2010 -7.2006 -6.7364 -6.7364 -6.4033 -6.4016 -6.3922 -6.3913 0.6989 0.7047 0.9827 0.9851 1.2611 1.2649 1.6672 1.6737 1.9774 1.9911 2.0290 2.0340 2.0682 2.0731 2.3282 2.3302 2.3966 2.3986 2.4240 2.4266 3.0315 3.0355 3.0466 3.0535 3.5649 3.5677 3.7438 3.7699 3.8418 3.8592 3.9076 4.0032 4.0174 4.0183 4.0599 4.1226 4.2436 4.2606 4.2937 4.3263 4.4057 4.4514 4.4882 4.5271 4.9240 4.9325 4.9859 5.0565 5.2392 5.2821 5.6926 5.7153 5.7730 5.7828 7.5223 7.5357 7.6731 7.6791 8.0502 8.0626 8.1957 8.1963 8.2602 8.2659 10.9529 10.9536 11.6004 11.6138 k = 0.1190 0.5000 0.1190 ( 5948 PWs) bands (ev): -58.2230 -58.2230 -32.6661 -32.6661 -31.8430 -31.8430 -31.8426 -31.8426 -7.2116 -7.2112 -6.7404 -6.7404 -6.3951 -6.3936 -6.3858 -6.3850 0.6902 0.6956 0.9841 0.9863 1.2683 1.2720 1.6645 1.6704 1.9834 1.9970 2.0301 2.0345 2.0649 2.0701 2.3206 2.3222 2.4043 2.4057 2.4320 2.4341 3.0533 3.0576 3.0639 3.0717 3.5596 3.5603 3.7390 3.7662 3.8417 3.8590 3.9008 4.0041 4.0187 4.0251 4.0589 4.1246 4.2332 4.2448 4.2819 4.3153 4.4164 4.4528 4.5009 4.5332 4.9426 4.9518 4.9954 5.0610 5.1946 5.2381 5.6930 5.7173 5.7722 5.7802 7.5039 7.5164 7.6705 7.6761 8.0430 8.0545 8.1917 8.1919 8.2516 8.2568 10.9555 10.9556 11.5330 11.5465 k = 0.1071 0.5000 0.1071 ( 5944 PWs) bands (ev): -58.2230 -58.2230 -32.6661 -32.6661 -31.8430 -31.8430 -31.8425 -31.8425 -7.2212 -7.2209 -6.7441 -6.7441 -6.3876 -6.3862 -6.3799 -6.3791 0.6818 0.6868 0.9850 0.9871 1.2742 1.2778 1.6617 1.6670 1.9900 2.0034 2.0316 2.0353 2.0619 2.0674 2.3134 2.3147 2.4117 2.4125 2.4392 2.4411 3.0746 3.0789 3.0814 3.0901 3.5525 3.5536 3.7353 3.7626 3.8416 3.8601 3.8946 4.0049 4.0204 4.0318 4.0566 4.1249 4.2215 4.2301 4.2700 4.3014 4.4295 4.4577 4.5144 4.5393 4.9599 4.9679 5.0040 5.0625 5.1522 5.1957 5.6965 5.7220 5.7721 5.7785 7.4870 7.4985 7.6683 7.6735 8.0348 8.0452 8.1902 8.1904 8.2438 8.2486 10.9554 10.9558 11.4700 11.4834 k = 0.0952 0.5000 0.0952 ( 5948 PWs) bands (ev): -58.2230 -58.2230 -32.6661 -32.6661 -31.8430 -31.8430 -31.8425 -31.8425 -7.2300 -7.2297 -6.7475 -6.7475 -6.3807 -6.3794 -6.3744 -6.3738 0.6739 0.6784 0.9856 0.9874 1.2791 1.2825 1.6589 1.6636 1.9969 2.0100 2.0332 2.0364 2.0592 2.0649 2.3069 2.3080 2.4185 2.4188 2.4457 2.4475 3.0950 3.0990 3.0991 3.1084 3.5445 3.5465 3.7329 3.7592 3.8416 3.8625 3.8890 4.0051 4.0224 4.0382 4.0531 4.1237 4.2075 4.2190 4.2585 4.2857 4.4443 4.4653 4.5278 4.5451 4.9756 4.9803 5.0121 5.0604 5.1132 5.1552 5.7026 5.7287 5.7727 5.7773 7.4715 7.4820 7.6664 7.6711 8.0260 8.0352 8.1907 8.1913 8.2368 8.2411 10.9530 10.9538 11.4126 11.4256 k = 0.0833 0.5000 0.0833 ( 5956 PWs) bands (ev): -58.2230 -58.2230 -32.6661 -32.6661 -31.8430 -31.8430 -31.8425 -31.8425 -7.2377 -7.2375 -6.7506 -6.7505 -6.3745 -6.3733 -6.3696 -6.3690 0.6666 0.6706 0.9859 0.9875 1.2831 1.2861 1.6562 1.6603 2.0037 2.0165 2.0349 2.0376 2.0568 2.0626 2.3009 2.3020 2.4244 2.4246 2.4514 2.4531 3.1140 3.1165 3.1180 3.1261 3.5362 3.5386 3.7316 3.7561 3.8420 3.8659 3.8839 4.0039 4.0246 4.0432 4.0501 4.1208 4.1925 4.2112 4.2474 4.2691 4.4603 4.4749 4.5407 4.5504 4.9893 4.9896 5.0195 5.0512 5.0821 5.1173 5.7108 5.7368 5.7737 5.7765 7.4577 7.4670 7.6647 7.6690 8.0171 8.0251 8.1928 8.1936 8.2308 8.2345 10.9485 10.9496 11.3616 11.3739 k = 0.0714 0.5000 0.0714 ( 5950 PWs) bands (ev): -58.2230 -58.2230 -32.6661 -32.6661 -31.8430 -31.8430 -31.8425 -31.8425 -7.2445 -7.2443 -6.7532 -6.7532 -6.3690 -6.3680 -6.3653 -6.3647 0.6601 0.6635 0.9860 0.9874 1.2862 1.2890 1.6538 1.6572 2.0104 2.0226 2.0367 2.0392 2.0548 2.0605 2.2957 2.2966 2.4295 2.4300 2.4564 2.4580 3.1313 3.1337 3.1356 3.1426 3.5278 3.5300 3.7315 3.7532 3.8430 3.8704 3.8795 4.0000 4.0273 4.0429 4.0533 4.1164 4.1782 4.2059 4.2363 4.2531 4.4770 4.4858 4.5528 4.5550 4.9953 5.0014 5.0253 5.0289 5.0663 5.0830 5.7203 5.7455 5.7750 5.7760 7.4456 7.4537 7.6634 7.6671 8.0086 8.0153 8.1960 8.1967 8.2256 8.2287 10.9421 10.9434 11.3179 11.3290 k = 0.0595 0.5000 0.0595 ( 5934 PWs) bands (ev): -58.2230 -58.2230 -32.6661 -32.6661 -31.8430 -31.8430 -31.8425 -31.8425 -7.2503 -7.2501 -6.7556 -6.7556 -6.3643 -6.3634 -6.3616 -6.3611 0.6543 0.6572 0.9860 0.9871 1.2887 1.2911 1.6516 1.6544 2.0164 2.0278 2.0386 2.0410 2.0532 2.0586 2.2911 2.2920 2.4339 2.4346 2.4607 2.4622 3.1471 3.1496 3.1515 3.1575 3.5195 3.5213 3.7323 3.7506 3.8446 3.8755 3.8762 3.9924 4.0304 4.0417 4.0592 4.1108 4.1655 4.2026 4.2240 4.2395 4.4939 4.4973 4.5586 4.5633 4.9980 4.9989 5.0154 5.0259 5.0567 5.0582 5.7302 5.7539 5.7759 5.7767 7.4354 7.4422 7.6623 7.6655 8.0008 8.0064 8.1996 8.2001 8.2213 8.2237 10.9344 10.9357 11.2818 11.2915 k = 0.0476 0.5000 0.0476 ( 5938 PWs) bands (ev): -58.2230 -58.2230 -32.6661 -32.6661 -31.8430 -31.8430 -31.8425 -31.8425 -7.2550 -7.2549 -6.7575 -6.7575 -6.3604 -6.3597 -6.3585 -6.3581 0.6496 0.6519 0.9859 0.9868 1.2907 1.2926 1.6497 1.6520 2.0215 2.0316 2.0407 2.0431 2.0522 2.0567 2.2873 2.2881 2.4375 2.4384 2.4642 2.4655 3.1612 3.1635 3.1655 3.1700 3.5117 3.5129 3.7337 3.7483 3.8468 3.8718 3.8831 3.9814 4.0340 4.0425 4.0649 4.1043 4.1551 4.2011 4.2095 4.2295 4.5088 4.5106 4.5610 4.5717 4.9748 4.9970 5.0153 5.0228 5.0479 5.0516 5.7397 5.7610 5.7765 5.7786 7.4269 7.4325 7.6615 7.6641 7.9941 7.9986 8.2031 8.2033 8.2180 8.2195 10.9262 10.9273 11.2533 11.2614 k = 0.0357 0.5000 0.0357 ( 5922 PWs) bands (ev): -58.2230 -58.2230 -32.6661 -32.6661 -31.8430 -31.8430 -31.8425 -31.8425 -7.2587 -7.2586 -6.7590 -6.7590 -6.3574 -6.3568 -6.3560 -6.3557 0.6458 0.6476 0.9858 0.9865 1.2921 1.2936 1.6483 1.6500 2.0256 2.0338 2.0429 2.0453 2.0518 2.0551 2.2843 2.2850 2.4405 2.4413 2.4670 2.4681 3.1733 3.1749 3.1770 3.1800 3.5047 3.5054 3.7354 3.7462 3.8494 3.8684 3.8916 3.9682 4.0379 4.0447 4.0698 4.0975 4.1483 4.1944 4.2012 4.2221 4.5198 4.5262 4.5623 4.5772 4.9558 4.9814 5.0117 5.0287 5.0461 5.0483 5.7481 5.7653 5.7782 5.7806 7.4205 7.4247 7.6610 7.6630 7.9888 7.9922 8.2059 8.2062 8.2157 8.2163 10.9182 10.9191 11.2322 11.2384 k = 0.0238 0.5000 0.0238 ( 5926 PWs) bands (ev): -58.2230 -58.2230 -32.6661 -32.6661 -31.8430 -31.8430 -31.8424 -31.8424 -7.2614 -7.2613 -6.7601 -6.7601 -6.3552 -6.3549 -6.3542 -6.3540 0.6432 0.6444 0.9857 0.9861 1.2932 1.2942 1.6473 1.6484 2.0287 2.0344 2.0451 2.0473 2.0519 2.0535 2.2822 2.2827 2.4427 2.4433 2.4691 2.4698 3.1828 3.1836 3.1855 3.1871 3.4992 3.4995 3.7372 3.7443 3.8524 3.8651 3.9015 3.9539 4.0418 4.0471 4.0733 4.0907 4.1461 4.1799 4.2023 4.2162 4.5299 4.5392 4.5629 4.5791 4.9431 4.9627 5.0138 5.0299 5.0442 5.0492 5.7550 5.7666 5.7810 5.7825 7.4160 7.4188 7.6607 7.6620 7.9850 7.9873 8.2075 8.2084 8.2141 8.2145 10.9116 10.9122 11.2181 11.2223 k = 0.0119 0.5000 0.0119 ( 5926 PWs) bands (ev): -58.2230 -58.2230 -32.6661 -32.6661 -31.8430 -31.8430 -31.8424 -31.8424 -7.2630 -7.2629 -6.7607 -6.7607 -6.3539 -6.3537 -6.3530 -6.3529 0.6417 0.6423 0.9857 0.9859 1.2939 1.2944 1.6468 1.6473 2.0311 2.0340 2.0470 2.0486 2.0520 2.0523 2.2809 2.2812 2.4441 2.4444 2.4704 2.4708 3.1891 3.1893 3.1905 3.1910 3.4956 3.4957 3.7390 3.7425 3.8555 3.8619 3.9130 3.9396 4.0455 4.0485 4.0761 4.0845 4.1489 4.1668 4.2045 4.2114 4.5383 4.5459 4.5658 4.5772 4.9375 4.9481 5.0174 5.0264 5.0460 5.0493 5.7601 5.7658 5.7833 5.7839 7.4136 7.4150 7.6607 7.6613 7.9830 7.9841 8.2084 8.2092 8.2134 8.2140 10.9073 10.9076 11.2102 11.2123 k = 0.0000 0.5000-0.0000 ( 5942 PWs) bands (ev): -58.2230 -58.2230 -32.6661 -32.6661 -31.8430 -31.8430 -31.8424 -31.8424 -7.2635 -7.2635 -6.7609 -6.7609 -6.3534 -6.3534 -6.3526 -6.3526 0.6414 0.6414 0.9857 0.9857 1.2943 1.2943 1.6468 1.6468 2.0328 2.0328 2.0484 2.0484 2.0519 2.0519 2.2806 2.2806 2.4446 2.4446 2.4709 2.4709 3.1917 3.1917 3.1918 3.1918 3.4943 3.4943 3.7407 3.7407 3.8587 3.8587 3.9258 3.9258 4.0480 4.0480 4.0795 4.0795 4.1562 4.1562 4.2075 4.2075 4.5444 4.5444 4.5720 4.5720 4.9394 4.9394 5.0216 5.0216 5.0481 5.0481 5.7636 5.7636 5.7843 5.7843 7.4133 7.4133 7.6609 7.6609 7.9826 7.9826 8.2089 8.2089 8.2137 8.2137 10.9059 10.9059 11.2084 11.2084 k = 0.5000 0.5000-0.0000 ( 5912 PWs) bands (ev): -58.2229 -58.2229 -32.6663 -32.6663 -31.8433 -31.8433 -31.8427 -31.8427 -6.9750 -6.9750 -6.6622 -6.6622 -6.6548 -6.6548 -6.4477 -6.4477 0.9952 0.9952 1.0041 1.0041 1.0410 1.0410 1.8982 1.8982 1.9881 1.9881 2.0245 2.0245 2.0553 2.0553 2.0687 2.0687 2.3836 2.3836 2.5103 2.5103 2.6952 2.6952 2.7093 2.7093 3.6304 3.6304 3.8218 3.8218 3.8467 3.8467 3.9556 3.9556 4.0194 4.0194 4.1620 4.1620 4.1996 4.1996 4.5246 4.5246 4.5392 4.5392 4.6079 4.6079 4.6688 4.6688 4.7507 4.7507 5.4264 5.4264 5.4471 5.4471 6.2060 6.2060 7.6204 7.6204 7.8486 7.8486 7.9781 7.9781 8.3949 8.3949 8.4023 8.4023 11.4891 11.4891 11.4930 11.4930 k = 0.5000 0.5000 0.0167 ( 5936 PWs) bands (ev): -58.2229 -58.2229 -32.6663 -32.6663 -31.8433 -31.8433 -31.8427 -31.8427 -6.9746 -6.9746 -6.6622 -6.6622 -6.6548 -6.6548 -6.4480 -6.4480 0.9944 0.9944 1.0033 1.0033 1.0402 1.0402 1.8947 1.8947 1.9905 1.9905 2.0248 2.0248 2.0558 2.0558 2.0691 2.0691 2.3833 2.3833 2.5114 2.5114 2.6953 2.6953 2.7094 2.7094 3.6308 3.6308 3.8221 3.8221 3.8463 3.8463 3.9558 3.9558 4.0195 4.0195 4.1609 4.1609 4.1987 4.1987 4.5236 4.5236 4.5390 4.5390 4.6078 4.6078 4.6682 4.6682 4.7507 4.7507 5.4284 5.4284 5.4502 5.4502 6.2064 6.2064 7.6197 7.6197 7.8513 7.8513 7.9780 7.9780 8.3955 8.3955 8.4029 8.4029 11.4865 11.4865 11.4904 11.4904 k = 0.5000 0.5000 0.0333 ( 5960 PWs) bands (ev): -58.2230 -58.2230 -32.6663 -32.6663 -31.8433 -31.8433 -31.8427 -31.8427 -6.9734 -6.9734 -6.6621 -6.6621 -6.6546 -6.6546 -6.4489 -6.4489 0.9921 0.9921 1.0010 1.0010 1.0377 1.0377 1.8853 1.8853 1.9967 1.9967 2.0257 2.0257 2.0572 2.0572 2.0704 2.0704 2.3824 2.3824 2.5148 2.5148 2.6957 2.6957 2.7099 2.7099 3.6320 3.6320 3.8227 3.8227 3.8453 3.8453 3.9564 3.9564 4.0198 4.0198 4.1578 4.1578 4.1960 4.1960 4.5209 4.5209 4.5382 4.5382 4.6076 4.6076 4.6663 4.6663 4.7510 4.7510 5.4348 5.4348 5.4594 5.4594 6.2077 6.2077 7.6178 7.6178 7.8594 7.8594 7.9778 7.9778 8.3971 8.3971 8.4045 8.4045 11.4787 11.4787 11.4826 11.4826 k = 0.5000 0.5000 0.0500 ( 5948 PWs) bands (ev): -58.2230 -58.2230 -32.6663 -32.6663 -31.8433 -31.8433 -31.8427 -31.8427 -6.9715 -6.9715 -6.6618 -6.6618 -6.6544 -6.6544 -6.4504 -6.4504 0.9884 0.9884 0.9973 0.9973 1.0336 1.0336 1.8718 1.8718 2.0050 2.0050 2.0272 2.0272 2.0595 2.0595 2.0725 2.0725 2.3812 2.3812 2.5203 2.5203 2.6964 2.6964 2.7107 2.7107 3.6340 3.6340 3.8239 3.8239 3.8437 3.8437 3.9576 3.9576 4.0205 4.0205 4.1527 4.1527 4.1919 4.1919 4.5169 4.5169 4.5369 4.5369 4.6071 4.6071 4.6633 4.6633 4.7515 4.7515 5.4457 5.4457 5.4742 5.4742 6.2098 6.2098 7.6151 7.6151 7.8723 7.8723 7.9775 7.9775 8.3999 8.3999 8.4072 8.4072 11.4658 11.4658 11.4695 11.4695 k = 0.5000 0.5000 0.0667 ( 5956 PWs) bands (ev): -58.2230 -58.2230 -32.6663 -32.6663 -31.8433 -31.8433 -31.8427 -31.8427 -6.9688 -6.9688 -6.6615 -6.6615 -6.6542 -6.6542 -6.4524 -6.4524 0.9833 0.9833 0.9922 0.9922 1.0279 1.0279 1.8557 1.8557 2.0136 2.0136 2.0297 2.0297 2.0627 2.0627 2.0754 2.0754 2.3794 2.3794 2.5278 2.5278 2.6973 2.6973 2.7118 2.7118 3.6367 3.6367 3.8255 3.8255 3.8415 3.8415 3.9589 3.9589 4.0213 4.0213 4.1460 4.1460 4.1864 4.1864 4.5117 4.5117 4.5348 4.5348 4.6059 4.6059 4.6593 4.6593 4.7519 4.7519 5.4614 5.4614 5.4938 5.4938 6.2128 6.2128 7.6124 7.6124 7.8893 7.8893 7.9771 7.9771 8.4037 8.4037 8.4109 8.4109 11.4479 11.4479 11.4513 11.4513 k = 0.5000 0.5000 0.0833 ( 5956 PWs) bands (ev): -58.2230 -58.2230 -32.6663 -32.6663 -31.8433 -31.8433 -31.8428 -31.8428 -6.9653 -6.9653 -6.6611 -6.6611 -6.6538 -6.6538 -6.4551 -6.4551 0.9769 0.9769 0.9858 0.9858 1.0208 1.0208 1.8380 1.8380 2.0214 2.0214 2.0336 2.0336 2.0667 2.0667 2.0792 2.0792 2.3771 2.3771 2.5371 2.5371 2.6985 2.6985 2.7133 2.7133 3.6403 3.6403 3.8275 3.8275 3.8388 3.8388 3.9606 3.9606 4.0223 4.0223 4.1378 4.1378 4.1798 4.1798 4.5057 4.5057 4.5320 4.5320 4.6037 4.6037 4.6544 4.6544 4.7521 4.7521 5.4819 5.4819 5.5180 5.5180 6.2165 6.2165 7.6101 7.6101 7.9095 7.9095 7.9769 7.9769 8.4086 8.4086 8.4156 8.4156 11.4249 11.4249 11.4280 11.4280 k = 0.5000 0.5000 0.1000 ( 5960 PWs) bands (ev): -58.2230 -58.2230 -32.6663 -32.6663 -31.8433 -31.8433 -31.8428 -31.8428 -6.9611 -6.9611 -6.6606 -6.6606 -6.6534 -6.6534 -6.4583 -6.4583 0.9693 0.9693 0.9782 0.9782 1.0122 1.0122 1.8193 1.8193 2.0273 2.0273 2.0397 2.0397 2.0714 2.0714 2.0837 2.0837 2.3743 2.3743 2.5479 2.5479 2.7000 2.7000 2.7150 2.7150 3.6445 3.6445 3.8299 3.8299 3.8356 3.8356 3.9624 3.9624 4.0234 4.0234 4.1285 4.1285 4.1726 4.1726 4.4991 4.4991 4.5285 4.5285 4.6004 4.6004 4.6486 4.6486 4.7519 4.7519 5.5070 5.5070 5.5462 5.5462 6.2211 6.2211 7.6088 7.6088 7.9319 7.9319 7.9776 7.9776 8.4143 8.4143 8.4212 8.4212 11.3970 11.3970 11.3999 11.3999 k = 0.5000 0.5000 0.1167 ( 5956 PWs) bands (ev): -58.2230 -58.2230 -32.6664 -32.6664 -31.8433 -31.8433 -31.8428 -31.8428 -6.9562 -6.9562 -6.6600 -6.6600 -6.6529 -6.6529 -6.4621 -6.4621 0.9605 0.9605 0.9694 0.9694 1.0023 1.0023 1.7999 1.7999 2.0317 2.0317 2.0474 2.0474 2.0768 2.0768 2.0889 2.0889 2.3710 2.3710 2.5598 2.5598 2.7017 2.7017 2.7171 2.7171 3.6495 3.6495 3.8314 3.8314 3.8333 3.8333 3.9643 3.9643 4.0246 4.0246 4.1183 4.1183 4.1652 4.1652 4.4919 4.4919 4.5243 4.5243 4.5957 4.5957 4.6423 4.6423 4.7511 4.7511 5.5364 5.5364 5.5780 5.5780 6.2263 6.2263 7.6089 7.6089 7.9528 7.9528 7.9821 7.9821 8.4208 8.4208 8.4276 8.4276 11.3646 11.3646 11.3670 11.3670 k = 0.5000 0.5000 0.1333 ( 5956 PWs) bands (ev): -58.2230 -58.2230 -32.6664 -32.6664 -31.8433 -31.8433 -31.8428 -31.8428 -6.9505 -6.9505 -6.6594 -6.6594 -6.6523 -6.6523 -6.4664 -6.4664 0.9508 0.9508 0.9596 0.9596 0.9912 0.9912 1.7801 1.7801 2.0358 2.0358 2.0555 2.0555 2.0826 2.0826 2.0948 2.0948 2.3673 2.3673 2.5726 2.5726 2.7036 2.7036 2.7194 2.7194 3.6551 3.6551 3.8278 3.8278 3.8362 3.8362 3.9661 3.9661 4.0258 4.0258 4.1075 4.1075 4.1581 4.1581 4.4841 4.4841 4.5197 4.5197 4.5896 4.5896 4.6354 4.6354 4.7495 4.7495 5.5697 5.5697 5.6131 5.6131 6.2321 6.2321 7.6107 7.6107 7.9631 7.9631 7.9992 7.9992 8.4281 8.4281 8.4347 8.4347 11.3278 11.3278 11.3298 11.3298 k = 0.5000 0.5000 0.1500 ( 5964 PWs) bands (ev): -58.2230 -58.2230 -32.6664 -32.6664 -31.8433 -31.8433 -31.8428 -31.8428 -6.9442 -6.9442 -6.6587 -6.6587 -6.6517 -6.6517 -6.4713 -6.4713 0.9402 0.9402 0.9490 0.9490 0.9791 0.9791 1.7601 1.7601 2.0399 2.0399 2.0637 2.0637 2.0888 2.0888 2.1013 2.1013 2.3631 2.3631 2.5860 2.5860 2.7057 2.7057 2.7219 2.7219 3.6611 3.6611 3.8236 3.8236 3.8396 3.8396 3.9678 3.9678 4.0267 4.0267 4.0962 4.0962 4.1518 4.1518 4.4758 4.4758 4.5147 4.5147 4.5822 4.5822 4.6280 4.6280 4.7470 4.7470 5.6064 5.6064 5.6510 5.6510 6.2385 6.2385 7.6144 7.6144 7.9648 7.9648 8.0266 8.0266 8.4360 8.4360 8.4424 8.4424 11.2870 11.2870 11.2887 11.2887 k = 0.5000 0.5000 0.1667 ( 5948 PWs) bands (ev): -58.2230 -58.2230 -32.6664 -32.6664 -31.8433 -31.8433 -31.8429 -31.8429 -6.9372 -6.9372 -6.6580 -6.6580 -6.6511 -6.6511 -6.4768 -6.4768 0.9289 0.9289 0.9376 0.9376 0.9661 0.9661 1.7401 1.7401 2.0443 2.0443 2.0718 2.0718 2.0953 2.0953 2.1084 2.1084 2.3585 2.3585 2.5997 2.5997 2.7079 2.7079 2.7246 2.7246 3.6677 3.6677 3.8192 3.8192 3.8434 3.8434 3.9694 3.9694 4.0272 4.0272 4.0849 4.0849 4.1468 4.1468 4.4671 4.4671 4.5093 4.5093 4.5735 4.5735 4.6203 4.6203 4.7434 4.7434 5.6462 5.6462 5.6914 5.6914 6.2455 6.2455 7.6202 7.6202 7.9642 7.9642 8.0575 8.0575 8.4443 8.4443 8.4505 8.4505 11.2428 11.2428 11.2442 11.2442 k = 0.5000 0.5000 0.1833 ( 5956 PWs) bands (ev): -58.2230 -58.2230 -32.6664 -32.6664 -31.8433 -31.8433 -31.8429 -31.8429 -6.9295 -6.9295 -6.6572 -6.6572 -6.6504 -6.6504 -6.4828 -6.4828 0.9170 0.9170 0.9257 0.9257 0.9524 0.9524 1.7202 1.7202 2.0489 2.0489 2.0799 2.0799 2.1021 2.1021 2.1160 2.1160 2.3535 2.3535 2.6135 2.6135 2.7103 2.7103 2.7275 2.7275 3.6743 3.6743 3.8149 3.8149 3.8474 3.8474 3.9707 3.9707 4.0270 4.0270 4.0737 4.0737 4.1435 4.1435 4.4579 4.4579 4.5037 4.5037 4.5635 4.5635 4.6123 4.6123 4.7386 4.7386 5.6886 5.6886 5.7339 5.7339 6.2529 6.2529 7.6282 7.6282 7.9629 7.9629 8.0903 8.0903 8.4530 8.4530 8.4590 8.4590 11.1956 11.1956 11.1968 11.1968 k = 0.5000 0.5000 0.2000 ( 5956 PWs) bands (ev): -58.2230 -58.2230 -32.6664 -32.6664 -31.8433 -31.8433 -31.8429 -31.8429 -6.9213 -6.9213 -6.6563 -6.6563 -6.6497 -6.6497 -6.4893 -6.4893 0.9048 0.9048 0.9133 0.9133 0.9382 0.9382 1.7006 1.7006 2.0540 2.0540 2.0879 2.0879 2.1090 2.1090 2.1240 2.1240 2.3482 2.3482 2.6271 2.6271 2.7129 2.7129 2.7305 2.7305 3.6811 3.6811 3.8107 3.8107 3.8515 3.8515 3.9718 3.9718 4.0259 4.0259 4.0631 4.0631 4.1421 4.1421 4.4484 4.4484 4.4980 4.4980 4.5526 4.5526 4.6039 4.6039 4.7325 4.7325 5.7330 5.7330 5.7780 5.7780 6.2606 6.2606 7.6383 7.6383 7.9612 7.9612 8.1242 8.1242 8.4618 8.4618 8.4676 8.4676 11.1460 11.1460 11.1472 11.1472 k = 0.5000 0.5000 0.2167 ( 5960 PWs) bands (ev): -58.2230 -58.2230 -32.6664 -32.6664 -31.8433 -31.8433 -31.8429 -31.8429 -6.9125 -6.9125 -6.6554 -6.6554 -6.6489 -6.6489 -6.4964 -6.4964 0.8922 0.8922 0.9007 0.9007 0.9236 0.9236 1.6813 1.6813 2.0593 2.0593 2.0959 2.0959 2.1159 2.1159 2.1322 2.1322 2.3424 2.3424 2.6404 2.6404 2.7155 2.7155 2.7337 2.7337 3.6877 3.6877 3.8070 3.8070 3.8558 3.8558 3.9724 3.9724 4.0236 4.0236 4.0535 4.0535 4.1428 4.1428 4.4386 4.4386 4.4922 4.4922 4.5409 4.5409 4.5953 4.5953 4.7250 4.7250 5.7790 5.7790 5.8233 5.8233 6.2686 6.2686 7.6506 7.6506 7.9593 7.9593 8.1588 8.1588 8.4707 8.4707 8.4763 8.4763 11.0946 11.0946 11.0961 11.0961 k = 0.5000 0.5000 0.2333 ( 5952 PWs) bands (ev): -58.2229 -58.2229 -32.6664 -32.6664 -31.8433 -31.8433 -31.8430 -31.8430 -6.9031 -6.9031 -6.6545 -6.6545 -6.6482 -6.6482 -6.5039 -6.5039 0.8795 0.8795 0.8879 0.8879 0.9087 0.9087 1.6626 1.6626 2.0650 2.0650 2.1040 2.1040 2.1229 2.1229 2.1406 2.1406 2.3363 2.3363 2.6532 2.6532 2.7182 2.7182 2.7370 2.7370 3.6938 3.6938 3.8040 3.8040 3.8601 3.8601 3.9724 3.9724 4.0200 4.0200 4.0456 4.0456 4.1456 4.1456 4.4285 4.4285 4.4864 4.4864 4.5287 4.5287 4.5865 4.5865 4.7161 4.7161 5.8262 5.8262 5.8695 5.8695 6.2768 6.2768 7.6650 7.6650 7.9573 7.9573 8.1938 8.1938 8.4795 8.4795 8.4849 8.4849 11.0421 11.0421 11.0440 11.0440 k = 0.5000 0.5000 0.2500 ( 5952 PWs) bands (ev): -58.2229 -58.2229 -32.6665 -32.6665 -31.8433 -31.8433 -31.8430 -31.8430 -6.8932 -6.8932 -6.6536 -6.6536 -6.6474 -6.6474 -6.5119 -6.5119 0.8668 0.8668 0.8752 0.8752 0.8939 0.8939 1.6444 1.6444 2.0710 2.0710 2.1120 2.1120 2.1298 2.1298 2.1491 2.1491 2.3299 2.3299 2.6652 2.6652 2.7209 2.7209 2.7403 2.7403 3.6990 3.6990 3.8020 3.8020 3.8644 3.8644 3.9717 3.9717 4.0152 4.0152 4.0396 4.0396 4.1504 4.1504 4.4184 4.4184 4.4807 4.4807 4.5160 4.5160 4.5774 4.5774 4.7058 4.7058 5.8739 5.8739 5.9161 5.9161 6.2852 6.2852 7.6813 7.6813 7.9552 7.9552 8.2288 8.2288 8.4881 8.4881 8.4933 8.4933 10.9892 10.9892 10.9914 10.9914 k = 0.5000 0.5000 0.2667 ( 5948 PWs) bands (ev): -58.2229 -58.2229 -32.6665 -32.6665 -31.8433 -31.8433 -31.8430 -31.8430 -6.8829 -6.8829 -6.6527 -6.6527 -6.6466 -6.6466 -6.5204 -6.5204 0.8542 0.8542 0.8625 0.8625 0.8792 0.8792 1.6269 1.6269 2.0773 2.0773 2.1201 2.1201 2.1366 2.1366 2.1575 2.1575 2.3232 2.3232 2.6765 2.6765 2.7237 2.7237 2.7437 2.7437 3.7031 3.7031 3.8015 3.8015 3.8687 3.8687 3.9698 3.9698 4.0100 4.0100 4.0352 4.0352 4.1569 4.1569 4.4082 4.4082 4.4750 4.4750 4.5033 4.5033 4.5683 4.5683 4.6940 4.6940 5.9218 5.9218 5.9628 5.9628 6.2935 6.2935 7.6994 7.6994 7.9530 7.9530 8.2635 8.2635 8.4963 8.4963 8.5013 8.5013 10.9365 10.9365 10.9392 10.9392 k = 0.5000 0.5000 0.2833 ( 5940 PWs) bands (ev): -58.2229 -58.2229 -32.6665 -32.6665 -31.8433 -31.8433 -31.8431 -31.8431 -6.8722 -6.8722 -6.6518 -6.6518 -6.6459 -6.6459 -6.5293 -6.5293 0.8419 0.8419 0.8502 0.8502 0.8648 0.8648 1.6101 1.6101 2.0839 2.0839 2.1281 2.1281 2.1432 2.1432 2.1658 2.1658 2.3163 2.3163 2.6870 2.6870 2.7264 2.7264 2.7471 2.7471 3.7057 3.7057 3.8026 3.8026 3.8728 3.8728 3.9666 3.9666 4.0056 4.0056 4.0320 4.0320 4.1651 4.1651 4.3982 4.3982 4.4694 4.4694 4.4908 4.4908 4.5591 4.5591 4.6807 4.6807 5.9694 5.9694 6.0090 6.0090 6.3018 6.3018 7.7191 7.7191 7.9508 7.9508 8.2975 8.2975 8.5040 8.5040 8.5089 8.5089 10.8846 10.8846 10.8878 10.8878 k = 0.5000 0.5000 0.3000 ( 5952 PWs) bands (ev): -58.2229 -58.2229 -32.6665 -32.6665 -31.8433 -31.8433 -31.8431 -31.8431 -6.8611 -6.8611 -6.6509 -6.6509 -6.6451 -6.6451 -6.5387 -6.5387 0.8300 0.8300 0.8382 0.8382 0.8509 0.8509 1.5942 1.5942 2.0906 2.0906 2.1360 2.1360 2.1495 2.1495 2.1738 2.1738 2.3091 2.3091 2.6965 2.6965 2.7291 2.7291 2.7504 2.7504 3.7069 3.7069 3.8054 3.8054 3.8767 3.8767 3.9618 3.9618 4.0026 4.0026 4.0294 4.0294 4.1748 4.1748 4.3883 4.3883 4.4635 4.4635 4.4789 4.4789 4.5498 4.5498 4.6661 4.6661 6.0162 6.0162 6.0542 6.0542 6.3100 6.3100 7.7399 7.7399 7.9486 7.9486 8.3304 8.3304 8.5111 8.5111 8.5158 8.5158 10.8342 10.8342 10.8377 10.8377 k = 0.5000 0.5000 0.3167 ( 5960 PWs) bands (ev): -58.2229 -58.2229 -32.6665 -32.6665 -31.8433 -31.8433 -31.8431 -31.8431 -6.8497 -6.8497 -6.6501 -6.6501 -6.6444 -6.6444 -6.5483 -6.5483 0.8185 0.8185 0.8268 0.8268 0.8377 0.8377 1.5792 1.5792 2.0977 2.0977 2.1438 2.1438 2.1556 2.1556 2.1815 2.1815 2.3018 2.3018 2.7052 2.7052 2.7317 2.7317 2.7537 2.7537 3.7066 3.7066 3.8097 3.8097 3.8803 3.8803 3.9559 3.9559 4.0010 4.0010 4.0272 4.0272 4.1858 4.1858 4.3789 4.3789 4.4567 4.4567 4.4688 4.4688 4.5405 4.5405 4.6503 4.6503 6.0618 6.0618 6.0982 6.0982 6.3179 6.3179 7.7617 7.7617 7.9464 7.9464 8.3621 8.3621 8.5176 8.5176 8.5221 8.5221 10.7857 10.7857 10.7897 10.7897 k = 0.5000 0.5000 0.3333 ( 5972 PWs) bands (ev): -58.2230 -58.2230 -32.6665 -32.6665 -31.8433 -31.8433 -31.8431 -31.8431 -6.8381 -6.8381 -6.6493 -6.6493 -6.6437 -6.6437 -6.5583 -6.5583 0.8076 0.8076 0.8160 0.8160 0.8251 0.8251 1.5652 1.5652 2.1049 2.1049 2.1514 2.1514 2.1612 2.1612 2.1888 2.1888 2.2943 2.2943 2.7128 2.7128 2.7342 2.7342 2.7569 2.7569 3.7052 3.7052 3.8152 3.8152 3.8836 3.8836 3.9493 3.9493 4.0004 4.0004 4.0254 4.0254 4.1979 4.1979 4.3699 4.3699 4.4478 4.4478 4.4616 4.4616 4.5314 4.5314 4.6332 4.6332 6.1055 6.1055 6.1403 6.1403 6.3256 6.3256 7.7840 7.7840 7.9443 7.9443 8.3920 8.3920 8.5233 8.5233 8.5276 8.5276 10.7397 10.7397 10.7440 10.7440 k = 0.5000 0.5000 0.3500 ( 5956 PWs) bands (ev): -58.2229 -58.2229 -32.6665 -32.6665 -31.8433 -31.8433 -31.8432 -31.8432 -6.8263 -6.8263 -6.6485 -6.6485 -6.6431 -6.6431 -6.5685 -6.5685 0.7974 0.7974 0.8059 0.8059 0.8135 0.8135 1.5522 1.5522 2.1124 2.1124 2.1586 2.1586 2.1664 2.1664 2.1955 2.1955 2.2869 2.2869 2.7196 2.7196 2.7366 2.7366 2.7600 2.7600 3.7032 3.7032 3.8217 3.8217 3.8867 3.8867 3.9425 3.9425 4.0006 4.0006 4.0238 4.0238 4.2112 4.2112 4.3616 4.3616 4.4379 4.4379 4.4569 4.4569 4.5225 4.5225 4.6152 4.6152 6.1471 6.1471 6.1800 6.1800 6.3331 6.3331 7.8065 7.8065 7.9423 7.9423 8.4199 8.4199 8.5283 8.5283 8.5324 8.5324 10.6967 10.6967 10.7013 10.7013 k = 0.5000 0.5000 0.3667 ( 5948 PWs) bands (ev): -58.2229 -58.2229 -32.6665 -32.6665 -31.8433 -31.8433 -31.8432 -31.8432 -6.8144 -6.8144 -6.6478 -6.6478 -6.6425 -6.6425 -6.5789 -6.5789 0.7880 0.7880 0.7966 0.7966 0.8028 0.8028 1.5405 1.5405 2.1200 2.1200 2.1654 2.1654 2.1712 2.1712 2.2016 2.2016 2.2795 2.2795 2.7255 2.7255 2.7388 2.7388 2.7629 2.7629 3.7007 3.7007 3.8288 3.8288 3.8894 3.8894 3.9356 3.9356 4.0014 4.0014 4.0223 4.0223 4.2254 4.2254 4.3539 4.3539 4.4281 4.4281 4.4534 4.4534 4.5139 4.5139 4.5963 4.5963 6.1859 6.1859 6.2169 6.2169 6.3403 6.3403 7.8285 7.8285 7.9405 7.9405 8.4455 8.4455 8.5324 8.5324 8.5365 8.5365 10.6571 10.6571 10.6619 10.6619 k = 0.5000 0.5000 0.3833 ( 5940 PWs) bands (ev): -58.2229 -58.2229 -32.6665 -32.6665 -31.8433 -31.8433 -31.8432 -31.8432 -6.8026 -6.8026 -6.6472 -6.6472 -6.6420 -6.6420 -6.5894 -6.5894 0.7794 0.7794 0.7883 0.7883 0.7932 0.7932 1.5299 1.5299 2.1276 2.1276 2.1713 2.1713 2.1758 2.1758 2.2069 2.2069 2.2723 2.2723 2.7306 2.7306 2.7408 2.7408 2.7656 2.7656 3.6980 3.6980 3.8361 3.8361 3.8917 3.8917 3.9289 3.9289 4.0024 4.0024 4.0210 4.0210 4.2402 4.2402 4.3470 4.3470 4.4191 4.4191 4.4509 4.4509 4.5057 4.5057 4.5768 4.5768 6.2215 6.2215 6.2504 6.2504 6.3472 6.3472 7.8497 7.8497 7.9388 7.9388 8.4685 8.4685 8.5359 8.5359 8.5397 8.5397 10.6212 10.6212 10.6262 10.6262 k = 0.5000 0.5000 0.4000 ( 5948 PWs) bands (ev): -58.2229 -58.2229 -32.6666 -32.6666 -31.8433 -31.8433 -31.8432 -31.8432 -6.7910 -6.7910 -6.6466 -6.6466 -6.6415 -6.6415 -6.5998 -6.5998 0.7718 0.7718 0.7809 0.7809 0.7848 0.7848 1.5207 1.5207 2.1352 2.1352 2.1758 2.1758 2.1807 2.1807 2.2112 2.2112 2.2654 2.2654 2.7349 2.7349 2.7425 2.7425 2.7680 2.7680 3.6954 3.6954 3.8435 3.8435 3.8937 3.8937 3.9223 3.9223 4.0036 4.0036 4.0197 4.0197 4.2555 4.2555 4.3410 4.3410 4.4114 4.4114 4.4490 4.4490 4.4978 4.4978 4.5569 4.5569 6.2535 6.2535 6.2796 6.2796 6.3541 6.3541 7.8696 7.8696 7.9373 7.9373 8.4888 8.4888 8.5386 8.5386 8.5423 8.5423 10.5895 10.5895 10.5945 10.5945 k = 0.5000 0.5000 0.4167 ( 5940 PWs) bands (ev): -58.2229 -58.2229 -32.6666 -32.6666 -31.8433 -31.8433 -31.8432 -31.8432 -6.7798 -6.7798 -6.6462 -6.6462 -6.6411 -6.6411 -6.6100 -6.6100 0.7651 0.7651 0.7746 0.7746 0.7776 0.7776 1.5127 1.5127 2.1428 2.1428 2.1787 2.1787 2.1859 2.1859 2.2144 2.2144 2.2590 2.2590 2.7384 2.7384 2.7441 2.7441 2.7701 2.7701 3.6930 3.6930 3.8509 3.8509 3.8953 3.8953 3.9159 3.9159 4.0050 4.0050 4.0185 4.0185 4.2707 4.2707 4.3358 4.3358 4.4054 4.4054 4.4479 4.4479 4.4904 4.4904 4.5370 4.5370 6.2814 6.2814 6.3040 6.3040 6.3613 6.3613 7.8875 7.8875 7.9359 7.9359 8.5060 8.5060 8.5407 8.5407 8.5443 8.5443 10.5621 10.5621 10.5670 10.5670 k = 0.5000 0.5000 0.4333 ( 5940 PWs) bands (ev): -58.2229 -58.2229 -32.6666 -32.6666 -31.8433 -31.8433 -31.8433 -31.8433 -6.7693 -6.7693 -6.6459 -6.6459 -6.6407 -6.6407 -6.6196 -6.6196 0.7596 0.7596 0.7693 0.7693 0.7716 0.7716 1.5062 1.5062 2.1502 2.1502 2.1804 2.1804 2.1909 2.1909 2.2162 2.2162 2.2537 2.2537 2.7413 2.7413 2.7453 2.7453 2.7718 2.7718 3.6910 3.6910 3.8582 3.8582 3.8966 3.8966 3.9097 3.9097 4.0064 4.0064 4.0172 4.0172 4.2852 4.2852 4.3316 4.3316 4.4015 4.4015 4.4473 4.4473 4.4837 4.4837 4.5175 4.5175 6.3049 6.3049 6.3226 6.3226 6.3691 6.3691 7.9031 7.9031 7.9348 7.9348 8.5202 8.5202 8.5422 8.5422 8.5458 8.5458 10.5394 10.5394 10.5437 10.5437 k = 0.5000 0.5000 0.4500 ( 5940 PWs) bands (ev): -58.2229 -58.2229 -32.6666 -32.6666 -31.8433 -31.8433 -31.8433 -31.8433 -6.7599 -6.7599 -6.6457 -6.6457 -6.6405 -6.6405 -6.6281 -6.6281 0.7552 0.7552 0.7653 0.7653 0.7668 0.7668 1.5010 1.5010 2.1573 2.1573 2.1809 2.1809 2.1956 2.1956 2.2162 2.2162 2.2497 2.2497 2.7435 2.7435 2.7463 2.7463 2.7732 2.7732 3.6893 3.6893 3.8652 3.8652 3.8975 3.8975 3.9037 3.9037 4.0078 4.0078 4.0159 4.0159 4.2982 4.2982 4.3281 4.3281 4.4003 4.4003 4.4469 4.4469 4.4777 4.4777 4.4994 4.4994 6.3235 6.3235 6.3353 6.3353 6.3774 6.3774 7.9157 7.9157 7.9339 7.9339 8.5311 8.5311 8.5433 8.5433 8.5469 8.5469 10.5216 10.5216 10.5248 10.5248 k = 0.5000 0.5000 0.4667 ( 5920 PWs) bands (ev): -58.2229 -58.2229 -32.6666 -32.6666 -31.8433 -31.8433 -31.8433 -31.8433 -6.7522 -6.7522 -6.6459 -6.6459 -6.6403 -6.6403 -6.6348 -6.6348 0.7521 0.7521 0.7624 0.7624 0.7634 0.7634 1.4974 1.4974 2.1638 2.1638 2.1801 2.1801 2.2000 2.2000 2.2146 2.2146 2.2473 2.2473 2.7452 2.7452 2.7469 2.7469 2.7743 2.7743 3.6881 3.6881 3.8720 3.8720 3.8968 3.8968 3.8992 3.8992 4.0093 4.0093 4.0147 4.0147 4.3088 4.3088 4.3254 4.3254 4.4019 4.4019 4.4462 4.4462 4.4728 4.4728 4.4840 4.4840 6.3370 6.3370 6.3429 6.3429 6.3851 6.3851 7.9251 7.9251 7.9333 7.9333 8.5388 8.5388 8.5440 8.5440 8.5478 8.5478 10.5087 10.5087 10.5106 10.5106 k = 0.5000 0.5000 0.4833 ( 5904 PWs) bands (ev): -58.2229 -58.2229 -32.6666 -32.6666 -31.8433 -31.8433 -31.8433 -31.8433 -6.7471 -6.7471 -6.6466 -6.6466 -6.6401 -6.6401 -6.6389 -6.6389 0.7501 0.7501 0.7608 0.7608 0.7613 0.7613 1.4951 1.4951 2.1697 2.1697 2.1780 2.1780 2.2041 2.2041 2.2117 2.2117 2.2461 2.2461 2.7463 2.7463 2.7471 2.7471 2.7749 2.7749 3.6873 3.6873 3.8787 3.8787 3.8912 3.8912 3.8991 3.8991 4.0107 4.0107 4.0134 4.0134 4.3161 4.3161 4.3232 4.3232 4.4056 4.4056 4.4441 4.4441 4.4695 4.4695 4.4738 4.4738 6.3453 6.3453 6.3468 6.3468 6.3905 6.3905 7.9308 7.9308 7.9329 7.9329 8.5431 8.5431 8.5444 8.5444 8.5486 8.5486 10.5010 10.5010 10.5017 10.5017 k = 0.5000 0.5000 0.5000 ( 5904 PWs) bands (ev): -58.2229 -58.2229 -32.6666 -32.6666 -31.8433 -31.8433 -31.8433 -31.8433 -6.7453 -6.7453 -6.6471 -6.6471 -6.6401 -6.6401 -6.6401 -6.6401 0.7495 0.7495 0.7604 0.7604 0.7604 0.7604 1.4944 1.4944 2.1745 2.1745 2.1745 2.1745 2.2081 2.2081 2.2081 2.2081 2.2457 2.2457 2.7469 2.7469 2.7469 2.7469 2.7751 2.7751 3.6871 3.6871 3.8850 3.8850 3.8850 3.8850 3.8992 3.8992 4.0121 4.0121 4.0121 4.0121 4.3205 4.3205 4.3205 4.3205 4.4078 4.4078 4.4423 4.4423 4.4694 4.4694 4.4694 4.4694 6.3480 6.3480 6.3480 6.3480 6.3923 6.3923 7.9328 7.9328 7.9328 7.9328 8.5444 8.5444 8.5444 8.5444 8.5490 8.5490 10.4985 10.4985 10.4985 10.4985 Writing output data file VCu3S4.save init_run : 4.17s CPU 12.29s WALL ( 1 calls) electrons : 1726.34s CPU 1744.51s WALL ( 1 calls) Called by init_run: wfcinit : 0.00s CPU 0.00s WALL ( 1 calls) potinit : 0.36s CPU 1.49s WALL ( 1 calls) Called by electrons: c_bands : 1726.31s CPU 1744.08s WALL ( 1 calls) v_of_rho : 0.16s CPU 0.84s WALL ( 1 calls) v_h : 0.01s CPU 0.01s WALL ( 1 calls) v_xc : 0.15s CPU 0.53s WALL ( 1 calls) newd : 1.53s CPU 1.77s WALL ( 1 calls) Called by c_bands: init_us_2 : 0.03s CPU 0.12s WALL ( 231 calls) cegterg : 1664.93s CPU 1680.30s WALL ( 840 calls) Called by sum_band: Called by *egterg: h_psi : 538.37s CPU 550.74s WALL ( 16448 calls) s_psi : 103.05s CPU 103.85s WALL ( 16448 calls) g_psi : 1.30s CPU 1.29s WALL ( 15377 calls) cdiaghg : 782.44s CPU 780.54s WALL ( 15608 calls) cegterg:over : 130.71s CPU 128.85s WALL ( 15377 calls) cegterg:upda : 37.46s CPU 40.98s WALL ( 15377 calls) cegterg:last : 26.26s CPU 26.69s WALL ( 1764 calls) Called by h_psi: h_psi:vloc : 348.62s CPU 357.97s WALL ( 16448 calls) h_psi:vnl : 189.13s CPU 191.52s WALL ( 16448 calls) add_vuspsi : 78.54s CPU 81.88s WALL ( 16448 calls) General routines calbec : 110.48s CPU 109.48s WALL ( 16448 calls) fft : 0.54s CPU 1.30s WALL ( 19 calls) ffts : 0.02s CPU 0.02s WALL ( 4 calls) fftw : 304.53s CPU 310.92s WALL ( 1728164 calls) interpolate : 0.06s CPU 0.06s WALL ( 4 calls) davcio : 0.02s CPU 1.33s WALL ( 462 calls) Parallel routines fft_scatter : 210.92s CPU 206.63s WALL ( 1728187 calls) PWSCF : 30m 2.01s CPU 32m 2.67s WALL This run was terminated on: 0:32:26 2Nov2015 =------------------------------------------------------------------------------= JOB DONE. 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