Program PWSCF v.5.1.1 starts on 2Nov2015 at 6:42:28 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: ./VCu3Te4.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 131 39 11 7849 1258 192 Max 132 40 13 7854 1283 197 Sum 6309 1885 545 376845 61205 9315 bravais-lattice index = 14 lattice parameter (alat) = 11.0728 a.u. unit-cell volume = 1357.6199 (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)= 11.072849 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 Te read from file: /home/autes/Pseudo/Te_MT_PBE.UPF MD5 check sum: 58ccb0a2ae5f507b1c31ab9daa3b9941 Pseudo is Norm-conserving, Zval = 6.0 Generated using "atomic" code by A. Dal Corso (espresso distribution) Using radial grid of 1245 points, 4 beta functions with: l(1) = 1 l(2) = 1 l(3) = 2 l(4) = 2 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 Te 6.00 127.60000 Te( 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= 210 Fermi-Dirac smearing, width (Ry)= 0.0010 cart. coord. in units 2pi/alat k( 1) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0047619 k( 2) = ( 0.0000000 0.0185185 -0.0000000), wk = 0.0047619 k( 3) = ( 0.0000000 0.0370370 -0.0000000), wk = 0.0047619 k( 4) = ( 0.0000000 0.0555556 -0.0000000), wk = 0.0047619 k( 5) = ( 0.0000000 0.0740741 -0.0000000), wk = 0.0047619 k( 6) = ( 0.0000000 0.0925926 -0.0000000), wk = 0.0047619 k( 7) = ( 0.0000000 0.1111111 -0.0000000), wk = 0.0047619 k( 8) = ( 0.0000000 0.1296296 -0.0000000), wk = 0.0047619 k( 9) = ( 0.0000000 0.1481482 -0.0000000), wk = 0.0047619 k( 10) = ( 0.0000000 0.1666667 -0.0000000), wk = 0.0047619 k( 11) = ( 0.0000000 0.1851852 -0.0000000), wk = 0.0047619 k( 12) = ( 0.0000000 0.2037037 -0.0000000), wk = 0.0047619 k( 13) = ( 0.0000000 0.2222222 -0.0000000), wk = 0.0047619 k( 14) = ( 0.0000000 0.2407407 -0.0000000), wk = 0.0047619 k( 15) = ( 0.0000000 0.2592593 -0.0000000), wk = 0.0047619 k( 16) = ( 0.0000000 0.2777778 -0.0000000), wk = 0.0047619 k( 17) = ( 0.0000000 0.2962963 -0.0000000), wk = 0.0047619 k( 18) = ( 0.0000000 0.3148148 -0.0000000), wk = 0.0047619 k( 19) = ( 0.0000000 0.3333333 -0.0000000), wk = 0.0047619 k( 20) = ( 0.0000000 0.3518519 -0.0000000), wk = 0.0047619 k( 21) = ( 0.0000000 0.3703704 -0.0000000), wk = 0.0047619 k( 22) = ( 0.0000000 0.3888889 -0.0000000), wk = 0.0047619 k( 23) = ( 0.0000000 0.4074074 -0.0000000), wk = 0.0047619 k( 24) = ( 0.0000000 0.4259259 -0.0000000), wk = 0.0047619 k( 25) = ( 0.0000000 0.4444444 -0.0000000), wk = 0.0047619 k( 26) = ( 0.0000000 0.4629630 -0.0000000), wk = 0.0047619 k( 27) = ( 0.0000000 0.4814815 -0.0000000), wk = 0.0047619 k( 28) = ( 0.0000000 0.5000000 -0.0000000), wk = 0.0047619 k( 29) = ( 0.0000000 0.5000000 -0.0000000), wk = 0.0047619 k( 30) = ( 0.0185185 0.5000000 -0.0000000), wk = 0.0047619 k( 31) = ( 0.0370370 0.5000000 -0.0000000), wk = 0.0047619 k( 32) = ( 0.0555556 0.5000000 -0.0000000), wk = 0.0047619 k( 33) = ( 0.0740741 0.5000000 -0.0000000), wk = 0.0047619 k( 34) = ( 0.0925926 0.5000000 -0.0000000), wk = 0.0047619 k( 35) = ( 0.1111111 0.5000000 -0.0000000), wk = 0.0047619 k( 36) = ( 0.1296296 0.5000000 -0.0000000), wk = 0.0047619 k( 37) = ( 0.1481482 0.5000000 -0.0000000), wk = 0.0047619 k( 38) = ( 0.1666667 0.5000000 -0.0000000), wk = 0.0047619 k( 39) = ( 0.1851852 0.5000000 -0.0000000), wk = 0.0047619 k( 40) = ( 0.2037037 0.5000000 -0.0000000), wk = 0.0047619 k( 41) = ( 0.2222222 0.5000000 -0.0000000), wk = 0.0047619 k( 42) = ( 0.2407407 0.5000000 -0.0000000), wk = 0.0047619 k( 43) = ( 0.2592593 0.5000000 -0.0000000), wk = 0.0047619 k( 44) = ( 0.2777778 0.5000000 -0.0000000), wk = 0.0047619 k( 45) = ( 0.2962963 0.5000000 -0.0000000), wk = 0.0047619 k( 46) = ( 0.3148148 0.5000000 -0.0000000), wk = 0.0047619 k( 47) = ( 0.3333333 0.5000000 -0.0000000), wk = 0.0047619 k( 48) = ( 0.3518519 0.5000000 -0.0000000), wk = 0.0047619 k( 49) = ( 0.3703704 0.5000000 -0.0000000), wk = 0.0047619 k( 50) = ( 0.3888889 0.5000000 -0.0000000), wk = 0.0047619 k( 51) = ( 0.4074074 0.5000000 -0.0000000), wk = 0.0047619 k( 52) = ( 0.4259259 0.5000000 -0.0000000), wk = 0.0047619 k( 53) = ( 0.4444444 0.5000000 -0.0000000), wk = 0.0047619 k( 54) = ( 0.4629630 0.5000000 -0.0000000), wk = 0.0047619 k( 55) = ( 0.4814815 0.5000000 -0.0000000), wk = 0.0047619 k( 56) = ( 0.5000000 0.5000000 -0.0000000), wk = 0.0047619 k( 57) = ( 0.5000000 0.5000000 -0.0000000), wk = 0.0047619 k( 58) = ( 0.4868421 0.4868421 -0.0000000), wk = 0.0047619 k( 59) = ( 0.4736842 0.4736842 -0.0000000), wk = 0.0047619 k( 60) = ( 0.4605263 0.4605263 -0.0000000), wk = 0.0047619 k( 61) = ( 0.4473684 0.4473684 -0.0000000), wk = 0.0047619 k( 62) = ( 0.4342105 0.4342105 -0.0000000), wk = 0.0047619 k( 63) = ( 0.4210526 0.4210526 -0.0000000), wk = 0.0047619 k( 64) = ( 0.4078947 0.4078947 -0.0000000), wk = 0.0047619 k( 65) = ( 0.3947368 0.3947368 -0.0000000), wk = 0.0047619 k( 66) = ( 0.3815789 0.3815789 -0.0000000), wk = 0.0047619 k( 67) = ( 0.3684211 0.3684210 -0.0000000), wk = 0.0047619 k( 68) = ( 0.3552632 0.3552632 -0.0000000), wk = 0.0047619 k( 69) = ( 0.3421053 0.3421053 -0.0000000), wk = 0.0047619 k( 70) = ( 0.3289474 0.3289474 -0.0000000), wk = 0.0047619 k( 71) = ( 0.3157895 0.3157895 -0.0000000), wk = 0.0047619 k( 72) = ( 0.3026316 0.3026316 -0.0000000), wk = 0.0047619 k( 73) = ( 0.2894737 0.2894737 -0.0000000), wk = 0.0047619 k( 74) = ( 0.2763158 0.2763158 -0.0000000), wk = 0.0047619 k( 75) = ( 0.2631579 0.2631579 -0.0000000), wk = 0.0047619 k( 76) = ( 0.2500000 0.2500000 -0.0000000), wk = 0.0047619 k( 77) = ( 0.2368421 0.2368421 -0.0000000), wk = 0.0047619 k( 78) = ( 0.2236842 0.2236842 -0.0000000), wk = 0.0047619 k( 79) = ( 0.2105263 0.2105263 -0.0000000), wk = 0.0047619 k( 80) = ( 0.1973684 0.1973684 -0.0000000), wk = 0.0047619 k( 81) = ( 0.1842105 0.1842105 -0.0000000), wk = 0.0047619 k( 82) = ( 0.1710526 0.1710526 -0.0000000), wk = 0.0047619 k( 83) = ( 0.1578947 0.1578947 -0.0000000), wk = 0.0047619 k( 84) = ( 0.1447368 0.1447368 -0.0000000), wk = 0.0047619 k( 85) = ( 0.1315790 0.1315790 -0.0000000), wk = 0.0047619 k( 86) = ( 0.1184210 0.1184210 -0.0000000), wk = 0.0047619 k( 87) = ( 0.1052632 0.1052632 -0.0000000), wk = 0.0047619 k( 88) = ( 0.0921053 0.0921053 -0.0000000), wk = 0.0047619 k( 89) = ( 0.0789474 0.0789474 -0.0000000), wk = 0.0047619 k( 90) = ( 0.0657895 0.0657895 -0.0000000), wk = 0.0047619 k( 91) = ( 0.0526316 0.0526316 -0.0000000), wk = 0.0047619 k( 92) = ( 0.0394737 0.0394737 -0.0000000), wk = 0.0047619 k( 93) = ( 0.0263158 0.0263158 -0.0000000), wk = 0.0047619 k( 94) = ( 0.0131579 0.0131579 -0.0000000), wk = 0.0047619 k( 95) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0047619 k( 96) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0047619 k( 97) = ( 0.0106383 0.0106383 0.0106383), wk = 0.0047619 k( 98) = ( 0.0212766 0.0212766 0.0212766), wk = 0.0047619 k( 99) = ( 0.0319149 0.0319149 0.0319149), wk = 0.0047619 k( 100) = ( 0.0425532 0.0425532 0.0425532), wk = 0.0047619 k( 101) = ( 0.0531915 0.0531915 0.0531915), wk = 0.0047619 k( 102) = ( 0.0638298 0.0638298 0.0638298), wk = 0.0047619 k( 103) = ( 0.0744681 0.0744681 0.0744681), wk = 0.0047619 k( 104) = ( 0.0851064 0.0851064 0.0851064), wk = 0.0047619 k( 105) = ( 0.0957447 0.0957447 0.0957447), wk = 0.0047619 k( 106) = ( 0.1063830 0.1063830 0.1063830), wk = 0.0047619 k( 107) = ( 0.1170213 0.1170213 0.1170213), wk = 0.0047619 k( 108) = ( 0.1276596 0.1276596 0.1276596), wk = 0.0047619 k( 109) = ( 0.1382979 0.1382979 0.1382979), wk = 0.0047619 k( 110) = ( 0.1489362 0.1489362 0.1489362), wk = 0.0047619 k( 111) = ( 0.1595745 0.1595745 0.1595745), wk = 0.0047619 k( 112) = ( 0.1702128 0.1702128 0.1702128), wk = 0.0047619 k( 113) = ( 0.1808511 0.1808511 0.1808511), wk = 0.0047619 k( 114) = ( 0.1914894 0.1914894 0.1914894), wk = 0.0047619 k( 115) = ( 0.2021277 0.2021277 0.2021277), wk = 0.0047619 k( 116) = ( 0.2127660 0.2127660 0.2127660), wk = 0.0047619 k( 117) = ( 0.2234043 0.2234043 0.2234043), wk = 0.0047619 k( 118) = ( 0.2340425 0.2340425 0.2340425), wk = 0.0047619 k( 119) = ( 0.2446809 0.2446808 0.2446808), wk = 0.0047619 k( 120) = ( 0.2553191 0.2553191 0.2553191), wk = 0.0047619 k( 121) = ( 0.2659574 0.2659574 0.2659574), wk = 0.0047619 k( 122) = ( 0.2765957 0.2765957 0.2765957), wk = 0.0047619 k( 123) = ( 0.2872340 0.2872340 0.2872340), wk = 0.0047619 k( 124) = ( 0.2978723 0.2978723 0.2978723), wk = 0.0047619 k( 125) = ( 0.3085106 0.3085106 0.3085106), wk = 0.0047619 k( 126) = ( 0.3191489 0.3191489 0.3191489), wk = 0.0047619 k( 127) = ( 0.3297872 0.3297872 0.3297872), wk = 0.0047619 k( 128) = ( 0.3404255 0.3404255 0.3404255), wk = 0.0047619 k( 129) = ( 0.3510638 0.3510638 0.3510638), wk = 0.0047619 k( 130) = ( 0.3617021 0.3617021 0.3617021), wk = 0.0047619 k( 131) = ( 0.3723404 0.3723404 0.3723404), wk = 0.0047619 k( 132) = ( 0.3829787 0.3829787 0.3829787), wk = 0.0047619 k( 133) = ( 0.3936170 0.3936170 0.3936170), wk = 0.0047619 k( 134) = ( 0.4042553 0.4042553 0.4042553), wk = 0.0047619 k( 135) = ( 0.4148936 0.4148936 0.4148936), wk = 0.0047619 k( 136) = ( 0.4255319 0.4255319 0.4255319), wk = 0.0047619 k( 137) = ( 0.4361702 0.4361702 0.4361702), wk = 0.0047619 k( 138) = ( 0.4468085 0.4468085 0.4468085), wk = 0.0047619 k( 139) = ( 0.4574468 0.4574468 0.4574468), wk = 0.0047619 k( 140) = ( 0.4680851 0.4680851 0.4680851), wk = 0.0047619 k( 141) = ( 0.4787234 0.4787234 0.4787234), wk = 0.0047619 k( 142) = ( 0.4893617 0.4893617 0.4893617), wk = 0.0047619 k( 143) = ( 0.5000000 0.5000000 0.5000000), wk = 0.0047619 k( 144) = ( 0.5000000 0.5000000 0.5000000), wk = 0.0047619 k( 145) = ( 0.4868421 0.5000000 0.4868421), wk = 0.0047619 k( 146) = ( 0.4736842 0.5000000 0.4736842), wk = 0.0047619 k( 147) = ( 0.4605263 0.5000000 0.4605263), wk = 0.0047619 k( 148) = ( 0.4473684 0.5000000 0.4473684), wk = 0.0047619 k( 149) = ( 0.4342105 0.5000000 0.4342105), wk = 0.0047619 k( 150) = ( 0.4210526 0.5000000 0.4210526), wk = 0.0047619 k( 151) = ( 0.4078947 0.5000000 0.4078947), wk = 0.0047619 k( 152) = ( 0.3947368 0.5000000 0.3947368), wk = 0.0047619 k( 153) = ( 0.3815789 0.5000000 0.3815789), wk = 0.0047619 k( 154) = ( 0.3684211 0.5000000 0.3684210), wk = 0.0047619 k( 155) = ( 0.3552632 0.5000000 0.3552632), wk = 0.0047619 k( 156) = ( 0.3421053 0.5000000 0.3421053), wk = 0.0047619 k( 157) = ( 0.3289474 0.5000000 0.3289474), wk = 0.0047619 k( 158) = ( 0.3157895 0.5000000 0.3157895), wk = 0.0047619 k( 159) = ( 0.3026316 0.5000000 0.3026316), wk = 0.0047619 k( 160) = ( 0.2894737 0.5000000 0.2894737), wk = 0.0047619 k( 161) = ( 0.2763158 0.5000000 0.2763158), wk = 0.0047619 k( 162) = ( 0.2631579 0.5000000 0.2631579), wk = 0.0047619 k( 163) = ( 0.2500000 0.5000000 0.2500000), wk = 0.0047619 k( 164) = ( 0.2368421 0.5000000 0.2368421), wk = 0.0047619 k( 165) = ( 0.2236842 0.5000000 0.2236842), wk = 0.0047619 k( 166) = ( 0.2105263 0.5000000 0.2105263), wk = 0.0047619 k( 167) = ( 0.1973684 0.5000000 0.1973684), wk = 0.0047619 k( 168) = ( 0.1842105 0.5000000 0.1842105), wk = 0.0047619 k( 169) = ( 0.1710526 0.5000000 0.1710526), wk = 0.0047619 k( 170) = ( 0.1578947 0.5000000 0.1578947), wk = 0.0047619 k( 171) = ( 0.1447368 0.5000000 0.1447368), wk = 0.0047619 k( 172) = ( 0.1315790 0.5000000 0.1315789), wk = 0.0047619 k( 173) = ( 0.1184210 0.5000000 0.1184210), wk = 0.0047619 k( 174) = ( 0.1052632 0.5000000 0.1052632), wk = 0.0047619 k( 175) = ( 0.0921053 0.5000000 0.0921053), wk = 0.0047619 k( 176) = ( 0.0789474 0.5000000 0.0789474), wk = 0.0047619 k( 177) = ( 0.0657895 0.5000000 0.0657895), wk = 0.0047619 k( 178) = ( 0.0526316 0.5000000 0.0526316), wk = 0.0047619 k( 179) = ( 0.0394737 0.5000000 0.0394737), wk = 0.0047619 k( 180) = ( 0.0263158 0.5000000 0.0263158), wk = 0.0047619 k( 181) = ( 0.0131579 0.5000000 0.0131579), wk = 0.0047619 k( 182) = ( 0.0000000 0.5000000 -0.0000000), wk = 0.0047619 k( 183) = ( 0.5000000 0.5000000 -0.0000000), wk = 0.0047619 k( 184) = ( 0.5000000 0.5000000 0.0185185), wk = 0.0047619 k( 185) = ( 0.5000000 0.5000000 0.0370370), wk = 0.0047619 k( 186) = ( 0.5000000 0.5000000 0.0555556), wk = 0.0047619 k( 187) = ( 0.5000000 0.5000000 0.0740741), wk = 0.0047619 k( 188) = ( 0.5000000 0.5000000 0.0925926), wk = 0.0047619 k( 189) = ( 0.5000000 0.5000000 0.1111111), wk = 0.0047619 k( 190) = ( 0.5000000 0.5000000 0.1296296), wk = 0.0047619 k( 191) = ( 0.5000000 0.5000000 0.1481481), wk = 0.0047619 k( 192) = ( 0.5000000 0.5000000 0.1666667), wk = 0.0047619 k( 193) = ( 0.5000000 0.5000000 0.1851852), wk = 0.0047619 k( 194) = ( 0.5000000 0.5000000 0.2037037), wk = 0.0047619 k( 195) = ( 0.5000000 0.5000000 0.2222222), wk = 0.0047619 k( 196) = ( 0.5000000 0.5000000 0.2407407), wk = 0.0047619 k( 197) = ( 0.5000000 0.5000000 0.2592593), wk = 0.0047619 k( 198) = ( 0.5000000 0.5000000 0.2777778), wk = 0.0047619 k( 199) = ( 0.5000000 0.5000000 0.2962963), wk = 0.0047619 k( 200) = ( 0.5000000 0.5000000 0.3148148), wk = 0.0047619 k( 201) = ( 0.5000000 0.5000000 0.3333333), wk = 0.0047619 k( 202) = ( 0.5000000 0.5000000 0.3518518), wk = 0.0047619 k( 203) = ( 0.5000000 0.5000000 0.3703704), wk = 0.0047619 k( 204) = ( 0.5000000 0.5000000 0.3888889), wk = 0.0047619 k( 205) = ( 0.5000000 0.5000000 0.4074074), wk = 0.0047619 k( 206) = ( 0.5000000 0.5000000 0.4259259), wk = 0.0047619 k( 207) = ( 0.5000000 0.5000000 0.4444444), wk = 0.0047619 k( 208) = ( 0.5000000 0.5000000 0.4629630), wk = 0.0047619 k( 209) = ( 0.5000000 0.5000000 0.4814815), wk = 0.0047619 k( 210) = ( 0.5000000 0.5000000 0.5000000), wk = 0.0047619 cryst. coord. k( 1) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0047619 k( 2) = ( 0.0000000 0.0185185 0.0000000), wk = 0.0047619 k( 3) = ( 0.0000000 0.0370370 0.0000000), wk = 0.0047619 k( 4) = ( 0.0000000 0.0555556 0.0000000), wk = 0.0047619 k( 5) = ( 0.0000000 0.0740741 0.0000000), wk = 0.0047619 k( 6) = ( 0.0000000 0.0925926 0.0000000), wk = 0.0047619 k( 7) = ( 0.0000000 0.1111111 0.0000000), wk = 0.0047619 k( 8) = ( 0.0000000 0.1296296 0.0000000), wk = 0.0047619 k( 9) = ( 0.0000000 0.1481482 0.0000000), wk = 0.0047619 k( 10) = ( 0.0000000 0.1666667 0.0000000), wk = 0.0047619 k( 11) = ( 0.0000000 0.1851852 0.0000000), wk = 0.0047619 k( 12) = ( 0.0000000 0.2037037 0.0000000), wk = 0.0047619 k( 13) = ( 0.0000000 0.2222222 0.0000000), wk = 0.0047619 k( 14) = ( 0.0000000 0.2407407 0.0000000), wk = 0.0047619 k( 15) = ( 0.0000000 0.2592593 0.0000000), wk = 0.0047619 k( 16) = ( 0.0000000 0.2777778 0.0000000), wk = 0.0047619 k( 17) = ( 0.0000000 0.2962963 0.0000000), wk = 0.0047619 k( 18) = ( 0.0000000 0.3148148 0.0000000), wk = 0.0047619 k( 19) = ( 0.0000000 0.3333333 0.0000000), wk = 0.0047619 k( 20) = ( 0.0000000 0.3518519 0.0000000), wk = 0.0047619 k( 21) = ( 0.0000000 0.3703704 0.0000000), wk = 0.0047619 k( 22) = ( 0.0000000 0.3888889 0.0000000), wk = 0.0047619 k( 23) = ( 0.0000000 0.4074074 0.0000000), wk = 0.0047619 k( 24) = ( 0.0000000 0.4259259 0.0000000), wk = 0.0047619 k( 25) = ( 0.0000000 0.4444444 0.0000000), wk = 0.0047619 k( 26) = ( 0.0000000 0.4629630 0.0000000), wk = 0.0047619 k( 27) = ( 0.0000000 0.4814815 0.0000000), wk = 0.0047619 k( 28) = ( 0.0000000 0.5000000 0.0000000), wk = 0.0047619 k( 29) = ( 0.0000000 0.5000000 0.0000000), wk = 0.0047619 k( 30) = ( 0.0185185 0.5000000 0.0000000), wk = 0.0047619 k( 31) = ( 0.0370370 0.5000000 0.0000000), wk = 0.0047619 k( 32) = ( 0.0555556 0.5000000 0.0000000), wk = 0.0047619 k( 33) = ( 0.0740741 0.5000000 0.0000000), wk = 0.0047619 k( 34) = ( 0.0925926 0.5000000 0.0000000), wk = 0.0047619 k( 35) = ( 0.1111111 0.5000000 0.0000000), wk = 0.0047619 k( 36) = ( 0.1296296 0.5000000 0.0000000), wk = 0.0047619 k( 37) = ( 0.1481482 0.5000000 0.0000000), wk = 0.0047619 k( 38) = ( 0.1666667 0.5000000 0.0000000), wk = 0.0047619 k( 39) = ( 0.1851852 0.5000000 0.0000000), wk = 0.0047619 k( 40) = ( 0.2037037 0.5000000 0.0000000), wk = 0.0047619 k( 41) = ( 0.2222222 0.5000000 0.0000000), wk = 0.0047619 k( 42) = ( 0.2407407 0.5000000 0.0000000), wk = 0.0047619 k( 43) = ( 0.2592593 0.5000000 0.0000000), wk = 0.0047619 k( 44) = ( 0.2777778 0.5000000 0.0000000), wk = 0.0047619 k( 45) = ( 0.2962963 0.5000000 0.0000000), wk = 0.0047619 k( 46) = ( 0.3148148 0.5000000 -0.0000000), wk = 0.0047619 k( 47) = ( 0.3333333 0.5000000 -0.0000000), wk = 0.0047619 k( 48) = ( 0.3518519 0.5000000 0.0000000), wk = 0.0047619 k( 49) = ( 0.3703704 0.5000000 0.0000000), wk = 0.0047619 k( 50) = ( 0.3888889 0.5000000 0.0000000), wk = 0.0047619 k( 51) = ( 0.4074074 0.5000000 0.0000000), wk = 0.0047619 k( 52) = ( 0.4259259 0.5000000 0.0000000), wk = 0.0047619 k( 53) = ( 0.4444444 0.5000000 0.0000000), wk = 0.0047619 k( 54) = ( 0.4629630 0.5000000 0.0000000), wk = 0.0047619 k( 55) = ( 0.4814815 0.5000000 0.0000000), wk = 0.0047619 k( 56) = ( 0.5000000 0.5000000 0.0000000), wk = 0.0047619 k( 57) = ( 0.5000000 0.5000000 0.0000000), wk = 0.0047619 k( 58) = ( 0.4868421 0.4868421 0.0000000), wk = 0.0047619 k( 59) = ( 0.4736842 0.4736842 0.0000000), wk = 0.0047619 k( 60) = ( 0.4605263 0.4605263 0.0000000), wk = 0.0047619 k( 61) = ( 0.4473684 0.4473684 0.0000000), wk = 0.0047619 k( 62) = ( 0.4342105 0.4342105 0.0000000), wk = 0.0047619 k( 63) = ( 0.4210526 0.4210526 0.0000000), wk = 0.0047619 k( 64) = ( 0.4078947 0.4078947 0.0000000), wk = 0.0047619 k( 65) = ( 0.3947368 0.3947368 0.0000000), wk = 0.0047619 k( 66) = ( 0.3815789 0.3815789 0.0000000), wk = 0.0047619 k( 67) = ( 0.3684211 0.3684211 0.0000000), wk = 0.0047619 k( 68) = ( 0.3552632 0.3552632 0.0000000), wk = 0.0047619 k( 69) = ( 0.3421053 0.3421053 0.0000000), wk = 0.0047619 k( 70) = ( 0.3289474 0.3289474 0.0000000), wk = 0.0047619 k( 71) = ( 0.3157895 0.3157895 0.0000000), wk = 0.0047619 k( 72) = ( 0.3026316 0.3026316 0.0000000), wk = 0.0047619 k( 73) = ( 0.2894737 0.2894737 0.0000000), wk = 0.0047619 k( 74) = ( 0.2763158 0.2763158 0.0000000), wk = 0.0047619 k( 75) = ( 0.2631579 0.2631579 0.0000000), wk = 0.0047619 k( 76) = ( 0.2500000 0.2500000 0.0000000), wk = 0.0047619 k( 77) = ( 0.2368421 0.2368421 0.0000000), wk = 0.0047619 k( 78) = ( 0.2236842 0.2236842 0.0000000), wk = 0.0047619 k( 79) = ( 0.2105263 0.2105263 0.0000000), wk = 0.0047619 k( 80) = ( 0.1973684 0.1973684 0.0000000), wk = 0.0047619 k( 81) = ( 0.1842105 0.1842105 0.0000000), wk = 0.0047619 k( 82) = ( 0.1710526 0.1710526 0.0000000), wk = 0.0047619 k( 83) = ( 0.1578947 0.1578947 0.0000000), wk = 0.0047619 k( 84) = ( 0.1447368 0.1447368 0.0000000), wk = 0.0047619 k( 85) = ( 0.1315790 0.1315790 0.0000000), wk = 0.0047619 k( 86) = ( 0.1184210 0.1184210 0.0000000), wk = 0.0047619 k( 87) = ( 0.1052632 0.1052632 0.0000000), wk = 0.0047619 k( 88) = ( 0.0921053 0.0921053 0.0000000), wk = 0.0047619 k( 89) = ( 0.0789474 0.0789474 0.0000000), wk = 0.0047619 k( 90) = ( 0.0657895 0.0657895 0.0000000), wk = 0.0047619 k( 91) = ( 0.0526316 0.0526316 0.0000000), wk = 0.0047619 k( 92) = ( 0.0394737 0.0394737 0.0000000), wk = 0.0047619 k( 93) = ( 0.0263158 0.0263158 0.0000000), wk = 0.0047619 k( 94) = ( 0.0131579 0.0131579 0.0000000), wk = 0.0047619 k( 95) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0047619 k( 96) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0047619 k( 97) = ( 0.0106383 0.0106383 0.0106383), wk = 0.0047619 k( 98) = ( 0.0212766 0.0212766 0.0212766), wk = 0.0047619 k( 99) = ( 0.0319149 0.0319149 0.0319149), wk = 0.0047619 k( 100) = ( 0.0425532 0.0425532 0.0425532), wk = 0.0047619 k( 101) = ( 0.0531915 0.0531915 0.0531915), wk = 0.0047619 k( 102) = ( 0.0638298 0.0638298 0.0638298), wk = 0.0047619 k( 103) = ( 0.0744681 0.0744681 0.0744681), wk = 0.0047619 k( 104) = ( 0.0851064 0.0851064 0.0851064), wk = 0.0047619 k( 105) = ( 0.0957447 0.0957447 0.0957447), wk = 0.0047619 k( 106) = ( 0.1063830 0.1063830 0.1063830), wk = 0.0047619 k( 107) = ( 0.1170213 0.1170213 0.1170213), wk = 0.0047619 k( 108) = ( 0.1276596 0.1276596 0.1276596), wk = 0.0047619 k( 109) = ( 0.1382979 0.1382979 0.1382979), wk = 0.0047619 k( 110) = ( 0.1489362 0.1489362 0.1489362), wk = 0.0047619 k( 111) = ( 0.1595745 0.1595745 0.1595745), wk = 0.0047619 k( 112) = ( 0.1702128 0.1702128 0.1702128), wk = 0.0047619 k( 113) = ( 0.1808511 0.1808511 0.1808511), wk = 0.0047619 k( 114) = ( 0.1914894 0.1914894 0.1914894), wk = 0.0047619 k( 115) = ( 0.2021277 0.2021277 0.2021277), wk = 0.0047619 k( 116) = ( 0.2127660 0.2127660 0.2127660), wk = 0.0047619 k( 117) = ( 0.2234043 0.2234043 0.2234043), wk = 0.0047619 k( 118) = ( 0.2340425 0.2340425 0.2340425), wk = 0.0047619 k( 119) = ( 0.2446809 0.2446809 0.2446809), wk = 0.0047619 k( 120) = ( 0.2553191 0.2553191 0.2553191), wk = 0.0047619 k( 121) = ( 0.2659574 0.2659574 0.2659574), wk = 0.0047619 k( 122) = ( 0.2765957 0.2765957 0.2765957), wk = 0.0047619 k( 123) = ( 0.2872340 0.2872340 0.2872340), wk = 0.0047619 k( 124) = ( 0.2978723 0.2978723 0.2978723), wk = 0.0047619 k( 125) = ( 0.3085106 0.3085106 0.3085106), wk = 0.0047619 k( 126) = ( 0.3191489 0.3191489 0.3191489), wk = 0.0047619 k( 127) = ( 0.3297872 0.3297872 0.3297872), wk = 0.0047619 k( 128) = ( 0.3404255 0.3404255 0.3404255), wk = 0.0047619 k( 129) = ( 0.3510638 0.3510638 0.3510638), wk = 0.0047619 k( 130) = ( 0.3617021 0.3617021 0.3617021), wk = 0.0047619 k( 131) = ( 0.3723404 0.3723404 0.3723404), wk = 0.0047619 k( 132) = ( 0.3829787 0.3829787 0.3829787), wk = 0.0047619 k( 133) = ( 0.3936170 0.3936170 0.3936170), wk = 0.0047619 k( 134) = ( 0.4042553 0.4042553 0.4042553), wk = 0.0047619 k( 135) = ( 0.4148936 0.4148936 0.4148936), wk = 0.0047619 k( 136) = ( 0.4255319 0.4255319 0.4255319), wk = 0.0047619 k( 137) = ( 0.4361702 0.4361702 0.4361702), wk = 0.0047619 k( 138) = ( 0.4468085 0.4468085 0.4468085), wk = 0.0047619 k( 139) = ( 0.4574468 0.4574468 0.4574468), wk = 0.0047619 k( 140) = ( 0.4680851 0.4680851 0.4680851), wk = 0.0047619 k( 141) = ( 0.4787234 0.4787234 0.4787234), wk = 0.0047619 k( 142) = ( 0.4893617 0.4893617 0.4893617), wk = 0.0047619 k( 143) = ( 0.5000000 0.5000000 0.5000000), wk = 0.0047619 k( 144) = ( 0.5000000 0.5000000 0.5000000), wk = 0.0047619 k( 145) = ( 0.4868421 0.5000000 0.4868421), wk = 0.0047619 k( 146) = ( 0.4736842 0.5000000 0.4736842), wk = 0.0047619 k( 147) = ( 0.4605263 0.5000000 0.4605263), wk = 0.0047619 k( 148) = ( 0.4473684 0.5000000 0.4473684), wk = 0.0047619 k( 149) = ( 0.4342105 0.5000000 0.4342105), wk = 0.0047619 k( 150) = ( 0.4210526 0.5000000 0.4210526), wk = 0.0047619 k( 151) = ( 0.4078947 0.5000000 0.4078947), wk = 0.0047619 k( 152) = ( 0.3947368 0.5000000 0.3947368), wk = 0.0047619 k( 153) = ( 0.3815789 0.5000000 0.3815789), wk = 0.0047619 k( 154) = ( 0.3684211 0.5000000 0.3684211), wk = 0.0047619 k( 155) = ( 0.3552632 0.5000000 0.3552632), wk = 0.0047619 k( 156) = ( 0.3421053 0.5000000 0.3421053), wk = 0.0047619 k( 157) = ( 0.3289474 0.5000000 0.3289474), wk = 0.0047619 k( 158) = ( 0.3157895 0.5000000 0.3157895), wk = 0.0047619 k( 159) = ( 0.3026316 0.5000000 0.3026316), wk = 0.0047619 k( 160) = ( 0.2894737 0.5000000 0.2894737), wk = 0.0047619 k( 161) = ( 0.2763158 0.5000000 0.2763158), wk = 0.0047619 k( 162) = ( 0.2631579 0.5000000 0.2631579), wk = 0.0047619 k( 163) = ( 0.2500000 0.5000000 0.2500000), wk = 0.0047619 k( 164) = ( 0.2368421 0.5000000 0.2368421), wk = 0.0047619 k( 165) = ( 0.2236842 0.5000000 0.2236842), wk = 0.0047619 k( 166) = ( 0.2105263 0.5000000 0.2105263), wk = 0.0047619 k( 167) = ( 0.1973684 0.5000000 0.1973684), wk = 0.0047619 k( 168) = ( 0.1842105 0.5000000 0.1842105), wk = 0.0047619 k( 169) = ( 0.1710526 0.5000000 0.1710526), wk = 0.0047619 k( 170) = ( 0.1578947 0.5000000 0.1578947), wk = 0.0047619 k( 171) = ( 0.1447368 0.5000000 0.1447368), wk = 0.0047619 k( 172) = ( 0.1315790 0.5000000 0.1315790), wk = 0.0047619 k( 173) = ( 0.1184210 0.5000000 0.1184210), wk = 0.0047619 k( 174) = ( 0.1052632 0.5000000 0.1052632), wk = 0.0047619 k( 175) = ( 0.0921053 0.5000000 0.0921053), wk = 0.0047619 k( 176) = ( 0.0789474 0.5000000 0.0789474), wk = 0.0047619 k( 177) = ( 0.0657895 0.5000000 0.0657895), wk = 0.0047619 k( 178) = ( 0.0526316 0.5000000 0.0526316), wk = 0.0047619 k( 179) = ( 0.0394737 0.5000000 0.0394737), wk = 0.0047619 k( 180) = ( 0.0263158 0.5000000 0.0263158), wk = 0.0047619 k( 181) = ( 0.0131579 0.5000000 0.0131579), wk = 0.0047619 k( 182) = ( 0.0000000 0.5000000 0.0000000), wk = 0.0047619 k( 183) = ( 0.5000000 0.5000000 0.0000000), wk = 0.0047619 k( 184) = ( 0.5000000 0.5000000 0.0185185), wk = 0.0047619 k( 185) = ( 0.5000000 0.5000000 0.0370370), wk = 0.0047619 k( 186) = ( 0.5000000 0.5000000 0.0555556), wk = 0.0047619 k( 187) = ( 0.5000000 0.5000000 0.0740741), wk = 0.0047619 k( 188) = ( 0.5000000 0.5000000 0.0925926), wk = 0.0047619 k( 189) = ( 0.5000000 0.5000000 0.1111111), wk = 0.0047619 k( 190) = ( 0.5000000 0.5000000 0.1296296), wk = 0.0047619 k( 191) = ( 0.5000000 0.5000000 0.1481482), wk = 0.0047619 k( 192) = ( 0.5000000 0.5000000 0.1666667), wk = 0.0047619 k( 193) = ( 0.5000000 0.5000000 0.1851852), wk = 0.0047619 k( 194) = ( 0.5000000 0.5000000 0.2037037), wk = 0.0047619 k( 195) = ( 0.5000000 0.5000000 0.2222222), wk = 0.0047619 k( 196) = ( 0.5000000 0.5000000 0.2407407), wk = 0.0047619 k( 197) = ( 0.5000000 0.5000000 0.2592593), wk = 0.0047619 k( 198) = ( 0.5000000 0.5000000 0.2777778), wk = 0.0047619 k( 199) = ( 0.5000000 0.5000000 0.2962963), wk = 0.0047619 k( 200) = ( 0.5000000 0.5000000 0.3148148), wk = 0.0047619 k( 201) = ( 0.5000000 0.5000000 0.3333333), wk = 0.0047619 k( 202) = ( 0.5000000 0.5000000 0.3518519), wk = 0.0047619 k( 203) = ( 0.5000000 0.5000000 0.3703704), wk = 0.0047619 k( 204) = ( 0.5000000 0.5000000 0.3888889), wk = 0.0047619 k( 205) = ( 0.5000000 0.5000000 0.4074074), wk = 0.0047619 k( 206) = ( 0.5000000 0.5000000 0.4259259), wk = 0.0047619 k( 207) = ( 0.5000000 0.5000000 0.4444444), wk = 0.0047619 k( 208) = ( 0.5000000 0.5000000 0.4629630), wk = 0.0047619 k( 209) = ( 0.5000000 0.5000000 0.4814815), wk = 0.0047619 k( 210) = ( 0.5000000 0.5000000 0.5000000), wk = 0.0047619 Dense grid: 376845 G-vectors FFT dimensions: ( 90, 90, 90) Smooth grid: 61205 G-vectors FFT dimensions: ( 50, 50, 50) Largest allocated arrays est. size (Mb) dimensions Kohn-Sham Wavefunctions 0.43 Mb ( 332, 84) NL pseudopotentials 0.51 Mb ( 166, 200) Each V/rho on FFT grid 0.25 Mb ( 16200) Each G-vector array 0.06 Mb ( 7854) G-vector shells 0.01 Mb ( 1350) Largest temporary arrays est. size (Mb) dimensions Auxiliary wavefunctions 1.70 Mb ( 332, 336) Each subspace H/S matrix 1.72 Mb ( 336, 336) Each matrix 0.51 Mb ( 200, 2, 84) The potential is recalculated from file : ./VCu3Te4.save/charge-density.dat Starting wfc are 106 randomized atomic wfcs Band Structure Calculation Davidson diagonalization with overlap Computing kpt #: 1 total cpu time spent up to now is 46.3 secs Computing kpt #: 2 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 57.8 secs Computing kpt #: 3 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 69.2 secs Computing kpt #: 4 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 80.9 secs Computing kpt #: 5 total cpu time spent up to now is 90.4 secs Computing kpt #: 6 total cpu time spent up to now is 99.6 secs Computing kpt #: 7 total cpu time spent up to now is 107.4 secs Computing kpt #: 8 total cpu time spent up to now is 117.8 secs Computing kpt #: 9 total cpu time spent up to now is 125.1 secs Computing kpt #: 10 total cpu time spent up to now is 132.4 secs Computing kpt #: 11 total cpu time spent up to now is 139.6 secs Computing kpt #: 12 total cpu time spent up to now is 147.0 secs Computing kpt #: 13 total cpu time spent up to now is 155.2 secs Computing kpt #: 14 total cpu time spent up to now is 163.2 secs Computing kpt #: 15 total cpu time spent up to now is 172.7 secs Computing kpt #: 16 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 184.2 secs Computing kpt #: 17 total cpu time spent up to now is 192.1 secs Computing kpt #: 18 total cpu time spent up to now is 200.0 secs Computing kpt #: 19 total cpu time spent up to now is 207.6 secs Computing kpt #: 20 total cpu time spent up to now is 215.0 secs Computing kpt #: 21 total cpu time spent up to now is 222.3 secs Computing kpt #: 22 total cpu time spent up to now is 229.2 secs Computing kpt #: 23 total cpu time spent up to now is 235.8 secs Computing kpt #: 24 total cpu time spent up to now is 242.0 secs Computing kpt #: 25 total cpu time spent up to now is 248.0 secs Computing kpt #: 26 total cpu time spent up to now is 253.7 secs Computing kpt #: 27 total cpu time spent up to now is 259.3 secs Computing kpt #: 28 total cpu time spent up to now is 265.0 secs Computing kpt #: 29 total cpu time spent up to now is 270.6 secs Computing kpt #: 30 total cpu time spent up to now is 276.3 secs Computing kpt #: 31 total cpu time spent up to now is 282.0 secs Computing kpt #: 32 total cpu time spent up to now is 288.0 secs Computing kpt #: 33 total cpu time spent up to now is 294.1 secs Computing kpt #: 34 total cpu time spent up to now is 300.2 secs Computing kpt #: 35 total cpu time spent up to now is 306.3 secs Computing kpt #: 36 total cpu time spent up to now is 312.5 secs Computing kpt #: 37 total cpu time spent up to now is 318.7 secs Computing kpt #: 38 total cpu time spent up to now is 325.1 secs Computing kpt #: 39 total cpu time spent up to now is 332.0 secs Computing kpt #: 40 total cpu time spent up to now is 339.2 secs Computing kpt #: 41 total cpu time spent up to now is 346.1 secs Computing kpt #: 42 total cpu time spent up to now is 353.6 secs Computing kpt #: 43 total cpu time spent up to now is 361.0 secs Computing kpt #: 44 total cpu time spent up to now is 368.4 secs Computing kpt #: 45 total cpu time spent up to now is 375.7 secs Computing kpt #: 46 total cpu time spent up to now is 382.9 secs Computing kpt #: 47 total cpu time spent up to now is 389.5 secs Computing kpt #: 48 total cpu time spent up to now is 396.0 secs Computing kpt #: 49 total cpu time spent up to now is 402.3 secs Computing kpt #: 50 total cpu time spent up to now is 408.4 secs Computing kpt #: 51 total cpu time spent up to now is 416.9 secs Computing kpt #: 52 total cpu time spent up to now is 423.1 secs Computing kpt #: 53 total cpu time spent up to now is 429.1 secs Computing kpt #: 54 total cpu time spent up to now is 435.1 secs Computing kpt #: 55 total cpu time spent up to now is 441.2 secs Computing kpt #: 56 total cpu time spent up to now is 446.8 secs Computing kpt #: 57 total cpu time spent up to now is 452.2 secs Computing kpt #: 58 total cpu time spent up to now is 458.0 secs Computing kpt #: 59 total cpu time spent up to now is 464.0 secs Computing kpt #: 60 total cpu time spent up to now is 470.2 secs Computing kpt #: 61 total cpu time spent up to now is 476.3 secs Computing kpt #: 62 total cpu time spent up to now is 482.8 secs Computing kpt #: 63 total cpu time spent up to now is 490.1 secs Computing kpt #: 64 total cpu time spent up to now is 497.7 secs Computing kpt #: 65 total cpu time spent up to now is 507.7 secs Computing kpt #: 66 total cpu time spent up to now is 515.3 secs Computing kpt #: 67 total cpu time spent up to now is 523.2 secs Computing kpt #: 68 total cpu time spent up to now is 530.9 secs Computing kpt #: 69 total cpu time spent up to now is 538.5 secs Computing kpt #: 70 total cpu time spent up to now is 546.0 secs Computing kpt #: 71 total cpu time spent up to now is 553.5 secs Computing kpt #: 72 total cpu time spent up to now is 561.0 secs Computing kpt #: 73 total cpu time spent up to now is 568.2 secs Computing kpt #: 74 total cpu time spent up to now is 575.5 secs Computing kpt #: 75 total cpu time spent up to now is 582.8 secs Computing kpt #: 76 total cpu time spent up to now is 590.4 secs Computing kpt #: 77 total cpu time spent up to now is 598.0 secs Computing kpt #: 78 total cpu time spent up to now is 605.6 secs Computing kpt #: 79 total cpu time spent up to now is 614.3 secs Computing kpt #: 80 total cpu time spent up to now is 622.0 secs Computing kpt #: 81 total cpu time spent up to now is 630.5 secs Computing kpt #: 82 total cpu time spent up to now is 640.4 secs Computing kpt #: 83 total cpu time spent up to now is 650.5 secs Computing kpt #: 84 total cpu time spent up to now is 661.9 secs Computing kpt #: 85 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 674.0 secs Computing kpt #: 86 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 686.2 secs Computing kpt #: 87 total cpu time spent up to now is 696.8 secs Computing kpt #: 88 total cpu time spent up to now is 707.6 secs Computing kpt #: 89 total cpu time spent up to now is 718.9 secs Computing kpt #: 90 total cpu time spent up to now is 729.4 secs Computing kpt #: 91 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 741.2 secs Computing kpt #: 92 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 753.2 secs Computing kpt #: 93 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 765.3 secs Computing kpt #: 94 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 777.3 secs Computing kpt #: 95 total cpu time spent up to now is 782.6 secs Computing kpt #: 96 total cpu time spent up to now is 788.4 secs Computing kpt #: 97 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 800.3 secs Computing kpt #: 98 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 811.8 secs Computing kpt #: 99 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 823.8 secs Computing kpt #: 100 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 835.6 secs Computing kpt #: 101 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 847.2 secs Computing kpt #: 102 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 859.0 secs Computing kpt #: 103 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 871.0 secs Computing kpt #: 104 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 882.9 secs Computing kpt #: 105 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 894.8 secs Computing kpt #: 106 total cpu time spent up to now is 902.5 secs Computing kpt #: 107 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 914.2 secs Computing kpt #: 108 total cpu time spent up to now is 924.0 secs Computing kpt #: 109 total cpu time spent up to now is 931.5 secs Computing kpt #: 110 total cpu time spent up to now is 941.6 secs Computing kpt #: 111 total cpu time spent up to now is 949.0 secs Computing kpt #: 112 total cpu time spent up to now is 956.4 secs Computing kpt #: 113 total cpu time spent up to now is 963.7 secs Computing kpt #: 114 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 975.8 secs Computing kpt #: 115 total cpu time spent up to now is 983.1 secs Computing kpt #: 116 total cpu time spent up to now is 990.1 secs Computing kpt #: 117 total cpu time spent up to now is 997.2 secs Computing kpt #: 118 total cpu time spent up to now is 1004.3 secs Computing kpt #: 119 total cpu time spent up to now is 1011.9 secs Computing kpt #: 120 total cpu time spent up to now is 1020.5 secs Computing kpt #: 121 total cpu time spent up to now is 1027.3 secs Computing kpt #: 122 total cpu time spent up to now is 1034.1 secs Computing kpt #: 123 total cpu time spent up to now is 1040.9 secs Computing kpt #: 124 total cpu time spent up to now is 1047.8 secs Computing kpt #: 125 total cpu time spent up to now is 1054.5 secs Computing kpt #: 126 total cpu time spent up to now is 1061.2 secs Computing kpt #: 127 total cpu time spent up to now is 1068.0 secs Computing kpt #: 128 total cpu time spent up to now is 1074.0 secs Computing kpt #: 129 total cpu time spent up to now is 1080.9 secs Computing kpt #: 130 total cpu time spent up to now is 1087.4 secs Computing kpt #: 131 total cpu time spent up to now is 1094.1 secs Computing kpt #: 132 total cpu time spent up to now is 1100.8 secs Computing kpt #: 133 total cpu time spent up to now is 1107.3 secs Computing kpt #: 134 total cpu time spent up to now is 1113.6 secs Computing kpt #: 135 total cpu time spent up to now is 1119.9 secs Computing kpt #: 136 total cpu time spent up to now is 1126.6 secs Computing kpt #: 137 total cpu time spent up to now is 1133.2 secs Computing kpt #: 138 total cpu time spent up to now is 1139.4 secs Computing kpt #: 139 total cpu time spent up to now is 1146.2 secs Computing kpt #: 140 total cpu time spent up to now is 1151.8 secs Computing kpt #: 141 total cpu time spent up to now is 1157.4 secs Computing kpt #: 142 total cpu time spent up to now is 1163.0 secs Computing kpt #: 143 total cpu time spent up to now is 1168.7 secs Computing kpt #: 144 total cpu time spent up to now is 1174.2 secs Computing kpt #: 145 total cpu time spent up to now is 1179.8 secs Computing kpt #: 146 total cpu time spent up to now is 1186.6 secs Computing kpt #: 147 total cpu time spent up to now is 1193.0 secs Computing kpt #: 148 total cpu time spent up to now is 1199.8 secs Computing kpt #: 149 total cpu time spent up to now is 1205.9 secs Computing kpt #: 150 total cpu time spent up to now is 1212.0 secs Computing kpt #: 151 total cpu time spent up to now is 1217.9 secs Computing kpt #: 152 total cpu time spent up to now is 1224.0 secs Computing kpt #: 153 total cpu time spent up to now is 1230.0 secs Computing kpt #: 154 total cpu time spent up to now is 1236.1 secs Computing kpt #: 155 total cpu time spent up to now is 1242.3 secs Computing kpt #: 156 total cpu time spent up to now is 1248.4 secs Computing kpt #: 157 total cpu time spent up to now is 1254.5 secs Computing kpt #: 158 total cpu time spent up to now is 1260.8 secs Computing kpt #: 159 total cpu time spent up to now is 1273.2 secs Computing kpt #: 160 total cpu time spent up to now is 1279.4 secs Computing kpt #: 161 total cpu time spent up to now is 1286.0 secs Computing kpt #: 162 total cpu time spent up to now is 1293.1 secs Computing kpt #: 163 total cpu time spent up to now is 1312.4 secs Computing kpt #: 164 total cpu time spent up to now is 1321.7 secs Computing kpt #: 165 total cpu time spent up to now is 1376.1 secs Computing kpt #: 166 total cpu time spent up to now is 1382.8 secs Computing kpt #: 167 total cpu time spent up to now is 1389.0 secs Computing kpt #: 168 total cpu time spent up to now is 1395.2 secs Computing kpt #: 169 total cpu time spent up to now is 1413.2 secs Computing kpt #: 170 total cpu time spent up to now is 1420.6 secs Computing kpt #: 171 total cpu time spent up to now is 1426.8 secs Computing kpt #: 172 total cpu time spent up to now is 1437.1 secs Computing kpt #: 173 total cpu time spent up to now is 1443.5 secs Computing kpt #: 174 total cpu time spent up to now is 1449.9 secs Computing kpt #: 175 total cpu time spent up to now is 1456.3 secs Computing kpt #: 176 total cpu time spent up to now is 1462.5 secs Computing kpt #: 177 total cpu time spent up to now is 1468.8 secs Computing kpt #: 178 total cpu time spent up to now is 1474.6 secs Computing kpt #: 179 total cpu time spent up to now is 1480.6 secs Computing kpt #: 180 total cpu time spent up to now is 1486.3 secs Computing kpt #: 181 total cpu time spent up to now is 1492.1 secs Computing kpt #: 182 total cpu time spent up to now is 1498.2 secs Computing kpt #: 183 total cpu time spent up to now is 1503.6 secs Computing kpt #: 184 total cpu time spent up to now is 1509.4 secs Computing kpt #: 185 total cpu time spent up to now is 1515.2 secs Computing kpt #: 186 total cpu time spent up to now is 1521.1 secs Computing kpt #: 187 total cpu time spent up to now is 1527.2 secs Computing kpt #: 188 total cpu time spent up to now is 1533.3 secs Computing kpt #: 189 total cpu time spent up to now is 1539.3 secs Computing kpt #: 190 total cpu time spent up to now is 1545.5 secs Computing kpt #: 191 total cpu time spent up to now is 1551.7 secs Computing kpt #: 192 total cpu time spent up to now is 1557.9 secs Computing kpt #: 193 total cpu time spent up to now is 1564.3 secs Computing kpt #: 194 total cpu time spent up to now is 1570.6 secs Computing kpt #: 195 total cpu time spent up to now is 1577.3 secs Computing kpt #: 196 total cpu time spent up to now is 1584.0 secs Computing kpt #: 197 total cpu time spent up to now is 1590.8 secs Computing kpt #: 198 total cpu time spent up to now is 1597.0 secs Computing kpt #: 199 total cpu time spent up to now is 1604.0 secs Computing kpt #: 200 total cpu time spent up to now is 1611.1 secs Computing kpt #: 201 total cpu time spent up to now is 1618.0 secs Computing kpt #: 202 total cpu time spent up to now is 1624.7 secs Computing kpt #: 203 total cpu time spent up to now is 1631.5 secs Computing kpt #: 204 total cpu time spent up to now is 1638.1 secs Computing kpt #: 205 total cpu time spent up to now is 1644.9 secs Computing kpt #: 206 total cpu time spent up to now is 1651.5 secs Computing kpt #: 207 total cpu time spent up to now is 1658.4 secs Computing kpt #: 208 total cpu time spent up to now is 1665.1 secs Computing kpt #: 209 total cpu time spent up to now is 1670.6 secs Computing kpt #: 210 total cpu time spent up to now is 1676.4 secs ethr = 1.43E-11, avg # of iterations = 52.4 total cpu time spent up to now is 1676.5 secs End of band structure calculation k = 0.0000 0.0000 0.0000 ( 7689 PWs) bands (ev): -57.7700 -57.7700 -32.1729 -32.1729 -31.3455 -31.3455 -31.3455 -31.3455 -5.4400 -5.4400 -4.0185 -4.0185 -4.0165 -4.0165 -4.0165 -4.0165 1.4375 1.4375 1.4375 1.4375 1.8717 1.8717 3.1005 3.1005 3.2081 3.2081 3.2081 3.2081 3.4417 3.4417 3.5886 3.5886 3.5886 3.5886 3.8669 3.8669 3.8669 3.8669 3.9146 3.9146 3.9784 3.9784 3.9784 3.9784 4.2606 4.2606 4.2606 4.2606 4.2801 4.2801 4.6152 4.6152 4.6152 4.6152 4.7494 4.7494 4.8169 4.8169 5.0142 5.0142 5.2589 5.2589 5.2589 5.2589 6.2692 6.2692 6.3490 6.3490 6.3490 6.3490 7.4332 7.4332 7.4332 7.4332 7.9208 7.9208 8.4485 8.4485 8.4485 8.4485 9.4997 9.4997 10.3223 10.3223 k = 0.0000 0.0185-0.0000 ( 7617 PWs) bands (ev): -57.7700 -57.7700 -32.1729 -32.1729 -31.3455 -31.3455 -31.3455 -31.3455 -5.4391 -5.4391 -4.0193 -4.0193 -4.0173 -4.0173 -4.0165 -4.0165 1.4379 1.4379 1.4400 1.4400 1.8731 1.8731 3.1002 3.1002 3.2073 3.2073 3.2085 3.2085 3.4413 3.4413 3.5855 3.5855 3.5905 3.5905 3.8636 3.8636 3.8682 3.8682 3.9149 3.9149 3.9774 3.9774 3.9808 3.9808 4.2576 4.2576 4.2626 4.2626 4.2801 4.2801 4.6119 4.6119 4.6180 4.6180 4.7504 4.7504 4.8169 4.8169 5.0140 5.0140 5.2543 5.2543 5.2615 5.2615 6.2677 6.2677 6.3467 6.3467 6.3497 6.3497 7.4334 7.4334 7.4344 7.4344 7.9199 7.9199 8.4430 8.4430 8.4480 8.4480 9.5099 9.5099 10.3232 10.3232 k = 0.0000 0.0370-0.0000 ( 7609 PWs) bands (ev): -57.7700 -57.7700 -32.1729 -32.1729 -31.3455 -31.3455 -31.3455 -31.3455 -5.4363 -5.4363 -4.0236 -4.0236 -4.0176 -4.0176 -4.0164 -4.0164 1.4406 1.4406 1.4457 1.4457 1.8770 1.8770 3.0991 3.0991 3.2055 3.2055 3.2090 3.2090 3.4394 3.4394 3.5809 3.5809 3.5910 3.5910 3.8568 3.8568 3.8687 3.8687 3.9154 3.9154 3.9773 3.9773 3.9845 3.9845 4.2537 4.2537 4.2637 4.2637 4.2794 4.2794 4.6076 4.6076 4.6205 4.6205 4.7529 4.7529 4.8166 4.8166 5.0130 5.0130 5.2472 5.2472 5.2621 5.2621 6.2633 6.2633 6.3419 6.3419 6.3499 6.3499 7.4341 7.4341 7.4380 7.4380 7.9169 7.9169 8.4272 8.4272 8.4462 8.4462 9.5395 9.5395 10.3282 10.3282 k = 0.0000 0.0556-0.0000 ( 7625 PWs) bands (ev): -57.7700 -57.7700 -32.1729 -32.1729 -31.3455 -31.3455 -31.3455 -31.3455 -5.4318 -5.4318 -4.0313 -4.0313 -4.0175 -4.0175 -4.0163 -4.0163 1.4455 1.4455 1.4546 1.4546 1.8835 1.8835 3.0973 3.0973 3.2026 3.2026 3.2096 3.2096 3.4361 3.4361 3.5748 3.5748 3.5904 3.5904 3.8464 3.8464 3.8690 3.8690 3.9161 3.9161 3.9778 3.9778 3.9895 3.9895 4.2487 4.2487 4.2636 4.2636 4.2783 4.2783 4.6026 4.6026 4.6229 4.6229 4.7564 4.7564 4.8162 4.8162 5.0116 5.0116 5.2377 5.2377 5.2610 5.2610 6.2554 6.2554 6.3348 6.3348 6.3500 6.3500 7.4351 7.4351 7.4439 7.4439 7.9118 7.9118 8.4032 8.4032 8.4430 8.4430 9.5864 9.5864 10.3367 10.3367 k = 0.0000 0.0741-0.0000 ( 7633 PWs) bands (ev): -57.7700 -57.7700 -32.1729 -32.1729 -31.3455 -31.3455 -31.3455 -31.3455 -5.4253 -5.4253 -4.0421 -4.0421 -4.0173 -4.0173 -4.0161 -4.0161 1.4525 1.4525 1.4670 1.4670 1.8926 1.8926 3.0945 3.0945 3.1989 3.1989 3.2105 3.2105 3.4313 3.4313 3.5673 3.5673 3.5886 3.5886 3.8326 3.8326 3.8693 3.8693 3.9172 3.9172 3.9788 3.9788 3.9955 3.9955 4.2426 4.2426 4.2623 4.2623 4.2771 4.2771 4.5973 4.5973 4.6255 4.6255 4.7602 4.7602 4.8158 4.8158 5.0101 5.0101 5.2259 5.2259 5.2589 5.2589 6.2433 6.2433 6.3264 6.3264 6.3499 6.3499 7.4362 7.4362 7.4517 7.4517 7.9045 7.9045 8.3737 8.3737 8.4384 8.4384 9.6473 9.6473 10.3490 10.3490 k = 0.0000 0.0926-0.0000 ( 7633 PWs) bands (ev): -57.7700 -57.7700 -32.1729 -32.1729 -31.3455 -31.3455 -31.3455 -31.3455 -5.4171 -5.4171 -4.0558 -4.0558 -4.0171 -4.0171 -4.0158 -4.0158 1.4615 1.4615 1.4828 1.4828 1.9042 1.9042 3.0904 3.0904 3.1946 3.1946 3.2116 3.2116 3.4248 3.4248 3.5585 3.5585 3.5859 3.5859 3.8157 3.8157 3.8697 3.8697 3.9185 3.9185 3.9802 3.9802 4.0021 4.0021 4.2355 4.2355 4.2597 4.2597 4.2761 4.2761 4.5922 4.5922 4.6279 4.6279 4.7634 4.7634 4.8158 4.8158 5.0088 5.0088 5.2121 5.2121 5.2560 5.2560 6.2264 6.2264 6.3176 6.3176 6.3496 6.3496 7.4373 7.4373 7.4614 7.4614 7.8950 7.8950 8.3411 8.3411 8.4321 8.4321 9.7192 9.7192 10.3654 10.3654 k = 0.0000 0.1111-0.0000 ( 7641 PWs) bands (ev): -57.7700 -57.7700 -32.1729 -32.1729 -31.3455 -31.3455 -31.3455 -31.3455 -5.4071 -5.4071 -4.0724 -4.0724 -4.0168 -4.0168 -4.0155 -4.0155 1.4724 1.4724 1.5019 1.5019 1.9184 1.9184 3.0848 3.0848 3.1899 3.1899 3.2130 3.2130 3.4161 3.4161 3.5488 3.5488 3.5821 3.5821 3.7959 3.7959 3.8700 3.8700 3.9202 3.9202 3.9819 3.9819 4.0092 4.0092 4.2274 4.2274 4.2559 4.2559 4.2752 4.2752 4.5877 4.5877 4.6300 4.6300 4.7649 4.7649 4.8166 4.8166 5.0080 5.0080 5.1966 5.1966 5.2528 5.2528 6.2045 6.2045 6.3090 6.3090 6.3491 6.3491 7.4381 7.4381 7.4725 7.4725 7.8833 7.8833 8.3076 8.3076 8.4241 8.4241 9.7987 9.7987 10.3866 10.3866 k = 0.0000 0.1296-0.0000 ( 7641 PWs) bands (ev): -57.7700 -57.7700 -32.1729 -32.1729 -31.3455 -31.3455 -31.3455 -31.3455 -5.3953 -5.3953 -4.0917 -4.0917 -4.0164 -4.0164 -4.0151 -4.0151 1.4853 1.4853 1.5241 1.5241 1.9350 1.9350 3.0772 3.0772 3.1853 3.1853 3.2145 3.2145 3.4050 3.4050 3.5385 3.5385 3.5773 3.5773 3.7733 3.7733 3.8704 3.8704 3.9223 3.9223 3.9841 3.9841 4.0164 4.0164 4.2185 4.2185 4.2510 4.2510 4.2743 4.2743 4.5841 4.5841 4.6315 4.6315 4.7640 4.7640 4.8189 4.8189 5.0083 5.0083 5.1798 5.1798 5.2499 5.2499 6.1779 6.1779 6.3009 6.3009 6.3481 6.3481 7.4385 7.4385 7.4847 7.4847 7.8694 7.8694 8.2747 8.2747 8.4140 8.4140 9.8827 9.8827 10.4135 10.4135 k = 0.0000 0.1481-0.0000 ( 7633 PWs) bands (ev): -57.7700 -57.7700 -32.1729 -32.1729 -31.3455 -31.3455 -31.3455 -31.3455 -5.3818 -5.3818 -4.1135 -4.1135 -4.0160 -4.0160 -4.0147 -4.0147 1.4999 1.4999 1.5494 1.5494 1.9541 1.9541 3.0672 3.0672 3.1811 3.1811 3.2161 3.2161 3.3910 3.3910 3.5281 3.5281 3.5713 3.5713 3.7481 3.7481 3.8709 3.8709 3.9250 3.9250 3.9866 3.9866 4.0238 4.0238 4.2091 4.2091 4.2450 4.2450 4.2736 4.2736 4.5812 4.5812 4.6320 4.6320 4.7605 4.7605 4.8228 4.8228 5.0100 5.0100 5.1622 5.1622 5.2476 5.2476 6.1471 6.1471 6.2932 6.2932 6.3467 6.3467 7.4381 7.4381 7.4977 7.4977 7.8538 7.8538 8.2434 8.2434 8.4020 8.4020 9.9679 9.9679 10.4475 10.4475 k = 0.0000 0.1667-0.0000 ( 7637 PWs) bands (ev): -57.7700 -57.7700 -32.1729 -32.1729 -31.3455 -31.3455 -31.3455 -31.3455 -5.3665 -5.3665 -4.1378 -4.1378 -4.0156 -4.0156 -4.0143 -4.0143 1.5163 1.5163 1.5777 1.5777 1.9754 1.9754 3.0547 3.0547 3.1775 3.1775 3.2179 3.2179 3.3738 3.3738 3.5178 3.5178 3.5638 3.5638 3.7207 3.7207 3.8714 3.8714 3.9282 3.9282 3.9895 3.9895 4.0312 4.0312 4.1996 4.1996 4.2383 4.2383 4.2727 4.2727 4.5786 4.5786 4.6311 4.6311 4.7548 4.7548 4.8282 4.8282 5.0132 5.0132 5.1443 5.1443 5.2462 5.2462 6.1129 6.1129 6.2856 6.2856 6.3448 6.3448 7.4370 7.4370 7.5112 7.5112 7.8369 7.8369 8.2140 8.2140 8.3878 8.3878 10.0508 10.0508 10.4904 10.4904 k = 0.0000 0.1852-0.0000 ( 7621 PWs) bands (ev): -57.7700 -57.7700 -32.1729 -32.1729 -31.3455 -31.3455 -31.3455 -31.3455 -5.3496 -5.3496 -4.1644 -4.1644 -4.0151 -4.0151 -4.0138 -4.0138 1.5343 1.5343 1.6087 1.6087 1.9991 1.9991 3.0395 3.0395 3.1747 3.1747 3.2197 3.2197 3.3532 3.3532 3.5080 3.5080 3.5544 3.5544 3.6917 3.6917 3.8720 3.8720 3.9320 3.9320 3.9929 3.9929 4.0384 4.0384 4.1904 4.1904 4.2311 4.2311 4.2720 4.2720 4.5758 4.5758 4.6285 4.6285 4.7478 4.7478 4.8349 4.8349 5.0182 5.0182 5.1267 5.1267 5.2461 5.2461 6.0758 6.0758 6.2781 6.2781 6.3424 6.3424 7.4348 7.4348 7.5249 7.5249 7.8192 7.8192 8.1867 8.1867 8.3716 8.3716 10.1279 10.1279 10.5441 10.5441 k = 0.0000 0.2037-0.0000 ( 7605 PWs) bands (ev): -57.7700 -57.7700 -32.1729 -32.1729 -31.3456 -31.3456 -31.3455 -31.3455 -5.3310 -5.3310 -4.1930 -4.1930 -4.0146 -4.0146 -4.0133 -4.0133 1.5539 1.5539 1.6424 1.6424 2.0249 2.0249 3.0216 3.0216 3.1727 3.1727 3.2216 3.2216 3.3292 3.3292 3.4983 3.4983 3.5425 3.5425 3.6625 3.6625 3.8727 3.8727 3.9364 3.9364 3.9966 3.9966 4.0453 4.0453 4.1816 4.1816 4.2235 4.2235 4.2713 4.2713 4.5718 4.5718 4.6238 4.6238 4.7407 4.7407 4.8427 4.8427 5.0248 5.0248 5.1101 5.1101 5.2473 5.2473 6.0364 6.0364 6.2705 6.2705 6.3393 6.3393 7.4317 7.4317 7.5384 7.5384 7.8013 7.8013 8.1615 8.1615 8.3535 8.3535 10.1965 10.1965 10.6096 10.6096 k = 0.0000 0.2222-0.0000 ( 7608 PWs) bands (ev): -57.7700 -57.7700 -32.1729 -32.1729 -31.3456 -31.3456 -31.3455 -31.3455 -5.3108 -5.3108 -4.2235 -4.2235 -4.0141 -4.0141 -4.0128 -4.0128 1.5750 1.5750 1.6785 1.6785 2.0528 2.0528 3.0010 3.0010 3.1713 3.1713 3.2233 3.2233 3.3022 3.3022 3.4876 3.4876 3.5275 3.5275 3.6350 3.6350 3.8735 3.8735 3.9413 3.9413 4.0007 4.0007 4.0518 4.0518 4.1737 4.1737 4.2157 4.2157 4.2705 4.2705 4.5660 4.5660 4.6164 4.6164 4.7348 4.7348 4.8515 4.8515 5.0323 5.0323 5.0954 5.0954 5.2498 5.2498 5.9951 5.9951 6.2629 6.2629 6.3357 6.3357 7.4274 7.4274 7.5517 7.5517 7.7839 7.7839 8.1380 8.1380 8.3337 8.3337 10.2560 10.2560 10.6862 10.6862 k = 0.0000 0.2407-0.0000 ( 7604 PWs) bands (ev): -57.7700 -57.7700 -32.1729 -32.1729 -31.3456 -31.3456 -31.3455 -31.3455 -5.2890 -5.2890 -4.2557 -4.2557 -4.0136 -4.0136 -4.0123 -4.0123 1.5973 1.5973 1.7170 1.7170 2.0826 2.0826 2.9779 2.9779 3.1703 3.1703 3.2244 3.2244 3.2729 3.2729 3.4724 3.4724 3.5111 3.5111 3.6112 3.6112 3.8744 3.8744 3.9467 3.9467 4.0052 4.0052 4.0578 4.0578 4.1669 4.1669 4.2079 4.2079 4.2698 4.2698 4.5579 4.5579 4.6060 4.6060 4.7309 4.7309 4.8615 4.8615 5.0387 5.0387 5.0850 5.0850 5.2536 5.2536 5.9525 5.9525 6.2551 6.2551 6.3315 6.3315 7.4222 7.4222 7.5645 7.5645 7.7675 7.7675 8.1160 8.1160 8.3125 8.3125 10.3073 10.3073 10.7708 10.7708 k = 0.0000 0.2593-0.0000 ( 7620 PWs) bands (ev): -57.7700 -57.7700 -32.1729 -32.1729 -31.3456 -31.3456 -31.3455 -31.3455 -5.2658 -5.2658 -4.2894 -4.2894 -4.0131 -4.0131 -4.0117 -4.0117 1.6207 1.6207 1.7575 1.7575 2.1143 2.1143 2.9523 2.9523 3.1696 3.1696 3.2223 3.2223 3.2446 3.2446 3.4472 3.4472 3.4983 3.4983 3.5922 3.5922 3.8754 3.8754 3.9526 3.9526 4.0100 4.0100 4.0630 4.0630 4.1613 4.1613 4.2004 4.2004 4.2690 4.2690 4.5474 4.5474 4.5926 4.5926 4.7292 4.7292 4.8727 4.8727 5.0392 5.0392 5.0835 5.0835 5.2584 5.2584 5.9089 5.9089 6.2474 6.2474 6.3268 6.3268 7.4162 7.4162 7.5766 7.5766 7.7523 7.7523 8.0955 8.0955 8.2903 8.2903 10.3524 10.3524 10.8571 10.8571 k = 0.0000 0.2778-0.0000 ( 7620 PWs) bands (ev): -57.7700 -57.7700 -32.1729 -32.1729 -31.3456 -31.3456 -31.3455 -31.3455 -5.2411 -5.2411 -4.3243 -4.3243 -4.0125 -4.0125 -4.0112 -4.0112 1.6450 1.6450 1.8001 1.8001 2.1477 2.1477 2.9244 2.9244 3.1688 3.1688 3.2009 3.2009 3.2337 3.2337 3.4120 3.4120 3.4902 3.4902 3.5774 3.5774 3.8765 3.8765 3.9591 3.9591 4.0152 4.0152 4.0674 4.0674 4.1572 4.1572 4.1933 4.1933 4.2683 4.2683 4.5347 4.5347 4.5764 4.5764 4.7296 4.7296 4.8855 4.8855 5.0328 5.0328 5.0921 5.0921 5.2640 5.2640 5.8647 5.8647 6.2396 6.2396 6.3215 6.3215 7.4095 7.4095 7.5880 7.5880 7.7386 7.7386 8.0761 8.0761 8.2674 8.2674 10.3933 10.3933 10.9200 10.9200 k = 0.0000 0.2963-0.0000 ( 7636 PWs) bands (ev): -57.7700 -57.7700 -32.1729 -32.1729 -31.3456 -31.3456 -31.3455 -31.3455 -5.2152 -5.2152 -4.3603 -4.3603 -4.0120 -4.0120 -4.0107 -4.0107 1.6699 1.6699 1.8443 1.8443 2.1826 2.1826 2.8944 2.8944 3.1631 3.1631 3.1721 3.1721 3.2335 3.2335 3.3708 3.3708 3.4848 3.4848 3.5653 3.5653 3.8777 3.8777 3.9660 3.9660 4.0207 4.0207 4.0709 4.0709 4.1546 4.1546 4.1866 4.1866 4.2674 4.2674 4.5203 4.5203 4.5580 4.5580 4.7312 4.7312 4.8999 4.8999 5.0239 5.0239 5.1063 5.1063 5.2701 5.2701 5.8203 5.8203 6.2320 6.2320 6.3158 6.3158 7.4024 7.4024 7.5985 7.5985 7.7264 7.7264 8.0580 8.0580 8.2443 8.2443 10.4316 10.4316 10.9573 10.9573 k = 0.0000 0.3148-0.0000 ( 7632 PWs) bands (ev): -57.7700 -57.7700 -32.1730 -32.1730 -31.3456 -31.3456 -31.3455 -31.3455 -5.1879 -5.1879 -4.3971 -4.3971 -4.0115 -4.0115 -4.0102 -4.0102 1.6952 1.6952 1.8901 1.8901 2.2188 2.2188 2.8623 2.8623 3.1304 3.1304 3.1674 3.1674 3.2342 3.2342 3.3269 3.3269 3.4810 3.4810 3.5551 3.5551 3.8789 3.8789 3.9734 3.9734 4.0265 4.0265 4.0733 4.0733 4.1534 4.1534 4.1806 4.1806 4.2666 4.2666 4.5048 4.5048 4.5383 4.5383 4.7334 4.7334 4.9156 4.9156 5.0153 5.0153 5.1232 5.1232 5.2762 5.2762 5.7759 5.7759 6.2247 6.2247 6.3098 6.3098 7.3952 7.3952 7.6081 7.6081 7.7158 7.7158 8.0410 8.0410 8.2213 8.2213 10.4684 10.4684 10.9910 10.9910 k = 0.0000 0.3333-0.0000 ( 7624 PWs) bands (ev): -57.7700 -57.7700 -32.1730 -32.1730 -31.3456 -31.3456 -31.3455 -31.3455 -5.1596 -5.1596 -4.4345 -4.4345 -4.0111 -4.0111 -4.0097 -4.0097 1.7206 1.7206 1.9373 1.9373 2.2561 2.2561 2.8284 2.8284 3.0947 3.0947 3.1631 3.1631 3.2340 3.2340 3.2843 3.2843 3.4784 3.4784 3.5460 3.5460 3.8802 3.8802 3.9813 3.9813 4.0324 4.0324 4.0748 4.0748 4.1534 4.1534 4.1753 4.1753 4.2657 4.2657 4.4886 4.4886 4.5179 4.5179 4.7356 4.7356 4.9320 4.9320 5.0085 5.0085 5.1417 5.1417 5.2822 5.2822 5.7319 5.7319 6.2176 6.2176 6.3036 6.3036 7.3879 7.3879 7.6168 7.6168 7.7066 7.7066 8.0254 8.0254 8.1989 8.1989 10.5043 10.5043 11.0211 11.0211 k = 0.0000 0.3519-0.0000 ( 7648 PWs) bands (ev): -57.7700 -57.7700 -32.1730 -32.1730 -31.3456 -31.3456 -31.3455 -31.3455 -5.1304 -5.1304 -4.4722 -4.4722 -4.0106 -4.0106 -4.0093 -4.0093 1.7455 1.7455 1.9855 1.9855 2.2942 2.2942 2.7927 2.7927 3.0594 3.0594 3.1525 3.1525 3.2280 3.2280 3.2524 3.2524 3.4767 3.4767 3.5378 3.5378 3.8814 3.8814 3.9893 3.9893 4.0382 4.0382 4.0756 4.0756 4.1544 4.1544 4.1707 4.1707 4.2647 4.2647 4.4724 4.4724 4.4973 4.4973 4.7376 4.7376 4.9474 4.9474 5.0053 5.0053 5.1609 5.1609 5.2875 5.2875 5.6886 5.6886 6.2111 6.2111 6.2972 6.2972 7.3809 7.3809 7.6245 7.6245 7.6989 7.6989 8.0110 8.0110 8.1775 8.1775 10.5397 10.5397 11.0447 11.0447 k = 0.0000 0.3704-0.0000 ( 7628 PWs) bands (ev): -57.7700 -57.7700 -32.1730 -32.1730 -31.3456 -31.3456 -31.3455 -31.3455 -5.1004 -5.1004 -4.5098 -4.5098 -4.0102 -4.0102 -4.0089 -4.0089 1.7696 1.7696 2.0345 2.0345 2.3326 2.3326 2.7556 2.7556 3.0254 3.0254 3.1287 3.1287 3.2113 3.2113 3.2442 3.2442 3.4758 3.4758 3.5302 3.5302 3.8827 3.8827 3.9977 3.9977 4.0438 4.0438 4.0759 4.0759 4.1559 4.1559 4.1671 4.1671 4.2637 4.2637 4.4568 4.4568 4.4772 4.4772 4.7391 4.7391 4.9584 4.9584 5.0090 5.0090 5.1807 5.1807 5.2920 5.2920 5.6465 5.6465 6.2052 6.2052 6.2909 6.2909 7.3744 7.3744 7.6312 7.6312 7.6924 7.6924 7.9981 7.9981 8.1575 8.1575 10.5750 10.5750 11.0581 11.0581 k = 0.0000 0.3889-0.0000 ( 7628 PWs) bands (ev): -57.7700 -57.7700 -32.1730 -32.1730 -31.3456 -31.3456 -31.3455 -31.3455 -5.0700 -5.0700 -4.5471 -4.5471 -4.0098 -4.0098 -4.0085 -4.0085 1.7924 1.7924 2.0840 2.0840 2.3706 2.3706 2.7175 2.7175 2.9935 2.9935 3.0913 3.0913 3.2011 3.2011 3.2434 3.2434 3.4756 3.4756 3.5232 3.5232 3.8838 3.8838 4.0060 4.0060 4.0488 4.0488 4.0761 4.0761 4.1575 4.1575 4.1644 4.1644 4.2627 4.2627 4.4421 4.4421 4.4581 4.4581 4.7402 4.7402 4.9623 4.9623 5.0214 5.0214 5.2004 5.2004 5.2953 5.2953 5.6058 5.6058 6.1999 6.1999 6.2848 6.2848 7.3685 7.3685 7.6369 7.6369 7.6871 7.6871 7.9868 7.9868 8.1393 8.1393 10.6101 10.6101 11.0591 11.0591 k = 0.0000 0.4074-0.0000 ( 7620 PWs) bands (ev): -57.7700 -57.7700 -32.1730 -32.1730 -31.3456 -31.3456 -31.3455 -31.3455 -5.0396 -5.0396 -4.5834 -4.5834 -4.0095 -4.0095 -4.0082 -4.0082 1.8132 1.8132 2.1334 2.1334 2.4072 2.4072 2.6793 2.6793 2.9645 2.9645 3.0482 3.0482 3.1969 3.1969 3.2436 3.2436 3.4761 3.4761 3.5166 3.5166 3.8848 3.8848 4.0143 4.0143 4.0529 4.0529 4.0763 4.0763 4.1585 4.1585 4.1630 4.1630 4.2617 4.2617 4.4289 4.4289 4.4405 4.4405 4.7409 4.7409 4.9618 4.9618 5.0393 5.0393 5.2199 5.2199 5.2974 5.2974 5.5673 5.5673 6.1955 6.1955 6.2791 6.2791 7.3634 7.3634 7.6416 7.6416 7.6830 7.6830 7.9770 7.9770 8.1233 8.1233 10.6449 10.6449 11.0484 11.0484 k = 0.0000 0.4259-0.0000 ( 7632 PWs) bands (ev): -57.7700 -57.7700 -32.1730 -32.1730 -31.3456 -31.3456 -31.3455 -31.3455 -5.0100 -5.0100 -4.6180 -4.6180 -4.0093 -4.0093 -4.0079 -4.0079 1.8315 1.8315 2.1823 2.1823 2.4399 2.4399 2.6427 2.6427 2.9392 2.9392 3.0051 3.0051 3.1952 3.1952 3.2440 3.2440 3.4772 3.4772 3.5106 3.5106 3.8856 3.8856 4.0220 4.0220 4.0559 4.0559 4.0766 4.0766 4.1586 4.1586 4.1632 4.1632 4.2608 4.2608 4.4174 4.4174 4.4250 4.4250 4.7413 4.7413 4.9599 4.9599 5.0586 5.0586 5.2386 5.2386 5.2981 5.2981 5.5315 5.5315 6.1918 6.1918 6.2740 6.2740 7.3590 7.3590 7.6453 7.6453 7.6798 7.6798 7.9690 7.9690 8.1096 8.1096 10.6790 10.6790 11.0291 11.0291 k = 0.0000 0.4444-0.0000 ( 7632 PWs) bands (ev): -57.7700 -57.7700 -32.1730 -32.1730 -31.3456 -31.3456 -31.3455 -31.3455 -4.9823 -4.9823 -4.6496 -4.6496 -4.0091 -4.0091 -4.0077 -4.0077 1.8465 1.8465 2.2295 2.2295 2.4645 2.4645 2.6116 2.6116 2.9183 2.9183 2.9654 2.9654 3.1945 3.1945 3.2444 3.2444 3.4789 3.4789 3.5051 3.5051 3.8863 3.8863 4.0291 4.0291 4.0576 4.0576 4.0771 4.0771 4.1582 4.1582 4.1640 4.1640 4.2600 4.2600 4.4079 4.4079 4.4125 4.4125 4.7415 4.7415 4.9579 4.9579 5.0769 5.0769 5.2562 5.2562 5.2976 5.2976 5.4997 5.4997 6.1890 6.1890 6.2698 6.2698 7.3556 7.3556 7.6480 7.6480 7.6775 7.6775 7.9627 7.9627 8.0987 8.0987 10.7114 10.7114 11.0051 11.0051 k = 0.0000 0.4630-0.0000 ( 7636 PWs) bands (ev): -57.7700 -57.7700 -32.1730 -32.1730 -31.3456 -31.3456 -31.3455 -31.3455 -4.9584 -4.9584 -4.6763 -4.6763 -4.0089 -4.0089 -4.0075 -4.0075 1.8578 1.8578 2.2731 2.2731 2.4729 2.4729 2.5933 2.5933 2.9021 2.9021 2.9326 2.9326 3.1943 3.1943 3.2447 3.2447 3.4810 3.4810 3.5002 3.5002 3.8868 3.8868 4.0349 4.0349 4.0584 4.0584 4.0775 4.0775 4.1580 4.1580 4.1649 4.1649 4.2594 4.2594 4.3999 4.3999 4.4039 4.4039 4.7416 4.7416 4.9562 4.9562 5.0921 5.0921 5.2716 5.2716 5.2962 5.2962 5.4736 5.4736 6.1870 6.1870 6.2666 6.2666 7.3531 7.3531 7.6499 7.6499 7.6761 7.6761 7.9581 7.9581 8.0907 8.0907 10.7402 10.7402 10.9808 10.9808 k = 0.0000 0.4815-0.0000 ( 7632 PWs) bands (ev): -57.7700 -57.7700 -32.1730 -32.1730 -31.3456 -31.3456 -31.3455 -31.3455 -4.9415 -4.9415 -4.6949 -4.6949 -4.0088 -4.0088 -4.0074 -4.0074 1.8648 1.8648 2.3080 2.3080 2.4642 2.4642 2.5901 2.5901 2.8910 2.8910 2.9113 2.9113 3.1942 3.1942 3.2449 3.2449 3.4831 3.4831 3.4965 3.4965 3.8871 3.8871 4.0389 4.0389 4.0585 4.0585 4.0777 4.0777 4.1580 4.1580 4.1654 4.1654 4.2590 4.2590 4.3944 4.3944 4.3993 4.3993 4.7416 4.7416 4.9552 4.9552 5.1022 5.1022 5.2834 5.2834 5.2942 5.2942 5.4557 5.4557 6.1858 6.1858 6.2646 6.2646 7.3516 7.3516 7.6509 7.6509 7.6753 7.6753 7.9554 7.9554 8.0859 8.0859 10.7616 10.7616 10.9615 10.9615 k = 0.0000 0.5000-0.0000 ( 7624 PWs) bands (ev): -57.7700 -57.7700 -32.1730 -32.1730 -31.3456 -31.3456 -31.3455 -31.3455 -4.9352 -4.9352 -4.7018 -4.7018 -4.0088 -4.0088 -4.0074 -4.0074 1.8672 1.8672 2.3228 2.3228 2.4565 2.4565 2.5912 2.5912 2.8865 2.8865 2.9042 2.9042 3.1942 3.1942 3.2449 3.2449 3.4842 3.4842 3.4949 3.4949 3.8872 3.8872 4.0404 4.0404 4.0584 4.0584 4.0778 4.0778 4.1580 4.1580 4.1656 4.1656 4.2589 4.2589 4.3924 4.3924 4.3978 4.3978 4.7416 4.7416 4.9549 4.9549 5.1058 5.1058 5.2897 5.2897 5.2916 5.2916 5.4492 5.4492 6.1854 6.1854 6.2639 6.2639 7.3511 7.3511 7.6512 7.6512 7.6750 7.6750 7.9545 7.9545 8.0842 8.0842 10.7699 10.7699 10.9539 10.9539 k = 0.0000 0.5000-0.0000 ( 7624 PWs) bands (ev): -57.7700 -57.7700 -32.1730 -32.1730 -31.3456 -31.3456 -31.3455 -31.3455 -4.9352 -4.9352 -4.7018 -4.7018 -4.0088 -4.0088 -4.0074 -4.0074 1.8672 1.8672 2.3228 2.3228 2.4565 2.4565 2.5912 2.5912 2.8865 2.8865 2.9042 2.9042 3.1942 3.1942 3.2449 3.2449 3.4842 3.4842 3.4949 3.4949 3.8872 3.8872 4.0404 4.0404 4.0584 4.0584 4.0778 4.0778 4.1580 4.1580 4.1656 4.1656 4.2589 4.2589 4.3924 4.3924 4.3978 4.3978 4.7416 4.7416 4.9549 4.9549 5.1058 5.1058 5.2897 5.2897 5.2916 5.2916 5.4492 5.4492 6.1854 6.1854 6.2639 6.2639 7.3511 7.3511 7.6512 7.6512 7.6750 7.6750 7.9545 7.9545 8.0842 8.0842 10.7699 10.7699 10.9539 10.9539 k = 0.0185 0.5000-0.0000 ( 7636 PWs) bands (ev): -57.7700 -57.7700 -32.1730 -32.1730 -31.3456 -31.3456 -31.3455 -31.3455 -4.9345 -4.9345 -4.7012 -4.7012 -4.0095 -4.0095 -4.0081 -4.0081 1.8638 1.8715 2.3220 2.3228 2.4542 2.4591 2.5882 2.5931 2.8788 2.8936 2.8990 2.9096 3.1935 3.1949 3.2441 3.2456 3.4834 3.4836 3.4939 3.4958 3.8851 3.8877 4.0383 4.0397 4.0521 4.0616 4.0631 4.0880 4.1459 4.1507 4.1677 4.1829 4.2580 4.2623 4.3833 4.3926 4.3997 4.4136 4.7400 4.7473 4.9469 4.9676 5.1044 5.1046 5.2737 5.2848 5.2950 5.2980 5.4444 5.4631 6.1796 6.1886 6.2569 6.2683 7.3521 7.3526 7.6511 7.6515 7.6764 7.6765 7.9490 7.9594 8.0837 8.0838 10.7745 10.7765 10.9517 10.9650 k = 0.0370 0.5000-0.0000 ( 7640 PWs) bands (ev): -57.7700 -57.7700 -32.1730 -32.1730 -31.3456 -31.3456 -31.3455 -31.3455 -4.9324 -4.9324 -4.6996 -4.6996 -4.0118 -4.0117 -4.0101 -4.0101 1.8615 1.8767 2.3203 2.3221 2.4521 2.4618 2.5840 2.5939 2.8708 2.8930 2.9012 2.9150 3.1929 3.1956 3.2431 3.2462 3.4810 3.4822 3.4932 3.4961 3.8815 3.8864 4.0273 4.0355 4.0448 4.0470 4.0636 4.0939 4.1356 4.1388 4.1740 4.2011 4.2586 4.2674 4.3724 4.3978 4.4134 4.4311 4.7426 4.7573 4.9440 4.9841 5.1006 5.1012 5.2518 5.2763 5.2961 5.2969 5.4503 5.4828 6.1712 6.1890 6.2474 6.2700 7.3554 7.3565 7.6517 7.6521 7.6802 7.6810 7.9420 7.9642 8.0821 8.0833 10.7904 10.7942 10.9584 10.9851 k = 0.0556 0.5000-0.0000 ( 7634 PWs) bands (ev): -57.7700 -57.7700 -32.1730 -32.1730 -31.3456 -31.3456 -31.3455 -31.3455 -4.9288 -4.9288 -4.6970 -4.6969 -4.0158 -4.0157 -4.0132 -4.0131 1.8601 1.8828 2.3178 2.3206 2.4503 2.4647 2.5786 2.5937 2.8624 2.8875 2.9079 2.9206 3.1923 3.1963 3.2421 3.2466 3.4768 3.4802 3.4929 3.4955 3.8766 3.8832 4.0051 4.0158 4.0382 4.0454 4.0641 4.0963 4.1297 4.1304 4.1779 4.2185 4.2591 4.2720 4.3663 4.4066 4.4301 4.4507 4.7494 4.7716 4.9457 5.0023 5.0940 5.0976 5.2281 5.2655 5.2882 5.2967 5.4638 5.5050 6.1605 6.1870 6.2359 6.2689 7.3608 7.3628 7.6533 7.6535 7.6852 7.6886 7.9324 7.9687 8.0798 8.0838 10.8173 10.8228 10.9737 11.0140 k = 0.0741 0.5000-0.0000 ( 7630 PWs) bands (ev): -57.7700 -57.7700 -32.1730 -32.1730 -31.3456 -31.3456 -31.3455 -31.3455 -4.9239 -4.9238 -4.6933 -4.6932 -4.0215 -4.0213 -4.0173 -4.0172 1.8597 1.8897 2.3144 2.3184 2.4487 2.4676 2.5722 2.5927 2.8537 2.8818 2.9145 2.9263 3.1918 3.1971 3.2410 3.2468 3.4712 3.4779 3.4926 3.4940 3.8705 3.8780 3.9764 3.9901 4.0350 4.0448 4.0641 4.0958 4.1227 4.1307 4.1810 4.2342 4.2591 4.2739 4.3661 4.4176 4.4455 4.4733 4.7606 4.7903 4.9509 5.0172 5.0851 5.0958 5.2064 5.2534 5.2782 5.2945 5.4810 5.5278 6.1477 6.1827 6.2228 6.2654 7.3682 7.3714 7.6563 7.6566 7.6909 7.6989 7.9192 7.9721 8.0780 8.0866 10.8546 10.8618 10.9972 11.0511 k = 0.0926 0.5000-0.0000 ( 7630 PWs) bands (ev): -57.7700 -57.7700 -32.1730 -32.1730 -31.3456 -31.3456 -31.3455 -31.3455 -4.9175 -4.9174 -4.6885 -4.6884 -4.0289 -4.0286 -4.0226 -4.0224 1.8602 1.8973 2.3100 2.3155 2.4473 2.4703 2.5650 2.5912 2.8446 2.8761 2.9210 2.9322 3.1914 3.1980 3.2399 3.2467 3.4643 3.4751 3.4914 3.4923 3.8634 3.8705 3.9448 3.9638 4.0317 4.0446 4.0639 4.0935 4.1177 4.1345 4.1841 4.2480 4.2588 4.2724 4.3713 4.4295 4.4576 4.4979 4.7764 4.8133 4.9572 5.0228 5.0749 5.0954 5.1938 5.2424 5.2682 5.2906 5.4988 5.5497 6.1335 6.1764 6.2089 6.2598 7.3772 7.3820 7.6608 7.6619 7.6969 7.7115 7.9020 7.9735 8.0784 8.0921 10.9018 10.9106 11.0283 11.0960 k = 0.1111 0.5000-0.0000 ( 7634 PWs) bands (ev): -57.7700 -57.7700 -32.1730 -32.1730 -31.3456 -31.3456 -31.3455 -31.3455 -4.9098 -4.9097 -4.6827 -4.6826 -4.0378 -4.0375 -4.0289 -4.0287 1.8618 1.9055 2.3048 2.3120 2.4460 2.4727 2.5572 2.5895 2.8354 2.8702 2.9275 2.9383 3.1910 3.1989 3.2387 3.2465 3.4565 3.4720 3.4878 3.4918 3.8552 3.8607 3.9122 3.9383 4.0280 4.0446 4.0638 4.0906 4.1145 4.1402 4.1875 4.2584 4.2590 4.2696 4.3793 4.4418 4.4665 4.5222 4.7968 4.8403 4.9609 5.0177 5.0645 5.0878 5.2000 5.2347 5.2597 5.2857 5.5157 5.5697 6.1181 6.1684 6.1949 6.2527 7.3876 7.3945 7.6667 7.6697 7.7027 7.7263 7.8809 7.9721 8.0825 8.1006 10.9581 10.9682 11.0663 11.1478 k = 0.1296 0.5000-0.0000 ( 7628 PWs) bands (ev): -57.7700 -57.7700 -32.1730 -32.1730 -31.3456 -31.3456 -31.3455 -31.3455 -4.9007 -4.9006 -4.6760 -4.6758 -4.0483 -4.0479 -4.0363 -4.0361 1.8642 1.9143 2.2988 2.3078 2.4446 2.4742 2.5493 2.5880 2.8262 2.8644 2.9341 2.9447 3.1908 3.1999 3.2377 3.2460 3.4477 3.4686 3.4832 3.4912 3.8462 3.8481 3.8801 3.9148 4.0241 4.0449 4.0640 4.0877 4.1129 4.1466 4.1912 4.2584 4.2612 4.2737 4.3872 4.4546 4.4725 4.5449 4.8211 4.8705 4.9587 5.0058 5.0545 5.0693 5.2216 5.2292 5.2576 5.2829 5.5306 5.5869 6.1023 6.1591 6.1819 6.2450 7.3993 7.4084 7.6733 7.6800 7.7082 7.7431 7.8568 7.9685 8.0908 8.1118 11.0224 11.0336 11.1106 11.2056 k = 0.1481 0.5000-0.0000 ( 7628 PWs) bands (ev): -57.7700 -57.7700 -32.1730 -32.1730 -31.3456 -31.3456 -31.3455 -31.3455 -4.8903 -4.8901 -4.6682 -4.6681 -4.0602 -4.0598 -4.0447 -4.0445 1.8676 1.9235 2.2919 2.3030 2.4425 2.4745 2.5419 2.5875 2.8170 2.8588 2.9408 2.9513 3.1908 3.2011 3.2367 3.2453 3.4380 3.4649 3.4778 3.4904 3.8326 3.8363 3.8491 3.8939 4.0202 4.0454 4.0646 4.0850 4.1125 4.1532 4.1952 4.2576 4.2588 4.2828 4.3930 4.4682 4.4758 4.5657 4.8484 4.9024 4.9500 4.9905 5.0438 5.0459 5.2207 5.2378 5.2688 5.2940 5.5431 5.6007 6.0865 6.1486 6.1710 6.2376 7.4121 7.4237 7.6793 7.6926 7.7142 7.7616 7.8308 7.9643 8.1029 8.1252 11.0936 11.1046 11.1609 11.2678 k = 0.1667 0.5000-0.0000 ( 7616 PWs) bands (ev): -57.7700 -57.7700 -32.1730 -32.1730 -31.3456 -31.3456 -31.3455 -31.3455 -4.8785 -4.8784 -4.6595 -4.6593 -4.0737 -4.0732 -4.0542 -4.0539 1.8719 1.9330 2.2842 2.2976 2.4391 2.4730 2.5362 2.5884 2.8080 2.8535 2.9476 2.9583 3.1910 3.2024 3.2358 3.2442 3.4276 3.4605 3.4719 3.4894 3.8146 3.8198 3.8257 3.8756 4.0166 4.0462 4.0658 4.0828 4.1129 4.1595 4.1995 4.2546 4.2597 4.2917 4.3955 4.4768 4.4829 4.5846 4.8760 4.9228 4.9485 4.9745 5.0220 5.0314 5.2090 5.2351 5.2922 5.3262 5.5533 5.6109 6.0709 6.1369 6.1637 6.2317 7.4260 7.4399 7.6816 7.7066 7.7227 7.7810 7.8052 7.9615 8.1178 8.1404 11.1700 11.1761 11.2198 11.3326 k = 0.1852 0.5000-0.0000 ( 7620 PWs) bands (ev): -57.7700 -57.7700 -32.1730 -32.1730 -31.3456 -31.3456 -31.3455 -31.3455 -4.8655 -4.8654 -4.6498 -4.6497 -4.0885 -4.0880 -4.0646 -4.0643 1.8770 1.9427 2.2759 2.2917 2.4335 2.4694 2.5332 2.5910 2.7993 2.8488 2.9546 2.9655 3.1913 3.2039 3.2349 3.2429 3.4164 3.4549 3.4660 3.4883 3.7924 3.7949 3.8143 3.8594 4.0136 4.0473 4.0674 4.0811 4.1138 4.1650 4.2041 4.2530 4.2612 4.2999 4.3945 4.4758 4.4988 4.6018 4.8965 4.9086 4.9624 4.9763 5.0021 5.0193 5.1959 5.2242 5.3222 5.3651 5.5622 5.6182 6.0556 6.1240 6.1612 6.2286 7.4407 7.4567 7.6780 7.7183 7.7354 7.7794 7.8060 7.9617 8.1347 8.1569 11.2388 11.2491 11.2929 11.3975 k = 0.2037 0.5000-0.0000 ( 7618 PWs) bands (ev): -57.7700 -57.7700 -32.1730 -32.1730 -31.3456 -31.3456 -31.3455 -31.3455 -4.8513 -4.8511 -4.6393 -4.6391 -4.1046 -4.1041 -4.0760 -4.0757 1.8830 1.9526 2.2670 2.2852 2.4250 2.4633 2.5337 2.5957 2.7911 2.8450 2.9617 2.9730 3.1919 3.2056 3.2340 3.2413 3.4046 3.4475 3.4610 3.4870 3.7671 3.7746 3.8022 3.8444 4.0112 4.0486 4.0694 4.0800 4.1152 4.1696 4.2088 4.2533 4.2632 4.3073 4.3903 4.4730 4.5158 4.6176 4.8878 4.8965 4.9539 4.9863 5.0003 5.0286 5.1822 5.2104 5.3525 5.4011 5.5721 5.6248 6.0406 6.1099 6.1646 6.2293 7.4563 7.4740 7.6688 7.7159 7.7521 7.7734 7.8288 7.9658 8.1531 8.1744 11.2912 11.3269 11.3764 11.4584 k = 0.2222 0.5000-0.0000 ( 7618 PWs) bands (ev): -57.7700 -57.7700 -32.1730 -32.1730 -31.3456 -31.3456 -31.3455 -31.3455 -4.8359 -4.8357 -4.6279 -4.6277 -4.1220 -4.1214 -4.0882 -4.0879 1.8899 1.9625 2.2575 2.2783 2.4135 2.4550 2.5382 2.6021 2.7836 2.8424 2.9688 2.9806 3.1927 3.2075 3.2333 3.2392 3.3921 3.4381 3.4569 3.4856 3.7438 3.7544 3.7894 3.8299 4.0097 4.0502 4.0716 4.0795 4.1168 4.1728 4.2135 4.2556 4.2658 4.3141 4.3834 4.4687 4.5337 4.6324 4.8657 4.8801 4.9370 4.9711 5.0249 5.0623 5.1684 5.1951 5.3766 5.4278 5.5864 5.6345 6.0258 6.0947 6.1747 6.2344 7.4725 7.4913 7.6551 7.6953 7.7721 7.7871 7.8536 7.9739 8.1722 8.1925 11.3347 11.3965 11.4604 11.5092 k = 0.2407 0.5000-0.0000 ( 7618 PWs) bands (ev): -57.7700 -57.7700 -32.1730 -32.1730 -31.3456 -31.3456 -31.3455 -31.3455 -4.8194 -4.8191 -4.6157 -4.6155 -4.1406 -4.1400 -4.1012 -4.1009 1.8975 1.9724 2.2477 2.2711 2.3993 2.4447 2.5463 2.6099 2.7771 2.8415 2.9761 2.9885 3.1938 3.2097 3.2326 3.2368 3.3792 3.4271 3.4535 3.4841 3.7227 3.7348 3.7760 3.8155 4.0092 4.0519 4.0740 4.0797 4.1186 4.1748 4.2183 4.2599 4.2688 4.3198 4.3744 4.4633 4.5524 4.6463 4.8438 4.8580 4.9168 4.9519 5.0596 5.0981 5.1556 5.1794 5.3890 5.4402 5.6085 5.6513 6.0114 6.0787 6.1913 6.2444 7.4891 7.5082 7.6384 7.6692 7.7949 7.8088 7.8797 7.9855 8.1917 8.2109 11.3664 11.4467 11.5326 11.5412 k = 0.2593 0.5000-0.0000 ( 7618 PWs) bands (ev): -57.7700 -57.7700 -32.1730 -32.1730 -31.3456 -31.3456 -31.3455 -31.3455 -4.8017 -4.8015 -4.6028 -4.6026 -4.1602 -4.1596 -4.1151 -4.1147 1.9061 1.9823 2.2375 2.2637 2.3829 2.4326 2.5574 2.6186 2.7716 2.8426 2.9833 2.9965 3.1950 3.2120 3.2320 3.2337 3.3660 3.4147 3.4505 3.4825 3.7037 3.7159 3.7619 3.8010 4.0096 4.0539 4.0765 4.0806 4.1205 4.1756 4.2229 4.2658 4.2722 4.3241 4.3645 4.4570 4.5720 4.6592 4.8230 4.8345 4.8966 4.9320 5.0970 5.1250 5.1521 5.1635 5.3881 5.4371 5.6386 5.6759 5.9976 6.0623 6.2140 6.2592 7.5058 7.5244 7.6201 7.6425 7.8202 7.8338 7.9068 8.0000 8.2112 8.2291 11.3824 11.4661 11.5476 11.5730 k = 0.2778 0.5000-0.0000 ( 7610 PWs) bands (ev): -57.7700 -57.7700 -32.1730 -32.1730 -31.3456 -31.3456 -31.3456 -31.3456 -4.7831 -4.7828 -4.5892 -4.5889 -4.1809 -4.1803 -4.1296 -4.1292 1.9155 1.9922 2.2272 2.2563 2.3650 2.4192 2.5710 2.6274 2.7677 2.8463 2.9904 3.0045 3.1965 3.2145 3.2299 3.2315 3.3525 3.4011 3.4480 3.4809 3.6866 3.6981 3.7473 3.7863 4.0110 4.0560 4.0789 4.0820 4.1227 4.1757 4.2271 4.2730 4.2761 4.3252 4.3555 4.4499 4.5924 4.6709 4.8042 4.8108 4.8771 4.9122 5.1211 5.1348 5.1479 5.1788 5.3760 5.4218 5.6734 5.7051 5.9846 6.0458 6.2420 6.2785 7.5222 7.5389 7.6019 7.6169 7.8477 7.8606 7.9349 8.0168 8.2302 8.2469 11.3801 11.4534 11.5290 11.5671 k = 0.2963 0.5000-0.0000 ( 7618 PWs) bands (ev): -57.7700 -57.7700 -32.1730 -32.1730 -31.3456 -31.3456 -31.3456 -31.3456 -4.7635 -4.7632 -4.5749 -4.5747 -4.2025 -4.2019 -4.1446 -4.1443 1.9257 2.0021 2.2169 2.2489 2.3458 2.4047 2.5862 2.6358 2.7656 2.8530 2.9972 3.0125 3.1982 3.2169 3.2251 3.2311 3.3390 3.3861 3.4459 3.4792 3.6715 3.6814 3.7324 3.7714 4.0133 4.0583 4.0812 4.0840 4.1249 4.1751 4.2307 4.2805 4.2810 4.3201 4.3510 4.4426 4.6136 4.6803 4.7877 4.7887 4.8586 4.8932 5.1097 5.1330 5.1718 5.2122 5.3557 5.3982 5.7095 5.7351 5.9726 6.0296 6.2743 6.3020 7.5375 7.5491 7.5871 7.5935 7.8771 7.8887 7.9638 8.0351 8.2483 8.2638 11.3617 11.4195 11.4926 11.5281 k = 0.3148 0.5000-0.0000 ( 7620 PWs) bands (ev): -57.7700 -57.7700 -32.1730 -32.1730 -31.3457 -31.3457 -31.3456 -31.3456 -4.7430 -4.7427 -4.5601 -4.5599 -4.2249 -4.2243 -4.1603 -4.1599 1.9369 2.0120 2.2065 2.2416 2.3259 2.3894 2.6022 2.6433 2.7661 2.8631 3.0036 3.0205 3.1999 3.2192 3.2192 3.2310 3.3258 3.3698 3.4441 3.4773 3.6583 3.6659 3.7172 3.7564 4.0165 4.0607 4.0834 4.0862 4.1273 4.1743 4.2336 4.2852 4.2896 4.3090 4.3512 4.4350 4.6355 4.6859 4.7657 4.7781 4.8414 4.8757 5.0982 5.1189 5.2070 5.2447 5.3298 5.3696 5.7441 5.7634 5.9619 6.0140 6.3096 6.3289 7.5472 7.5486 7.5755 7.5840 7.9079 7.9175 7.9932 8.0545 8.2653 8.2794 11.3322 11.3754 11.4465 11.4751 k = 0.3333 0.5000-0.0000 ( 7634 PWs) bands (ev): -57.7700 -57.7700 -32.1730 -32.1730 -31.3457 -31.3457 -31.3456 -31.3456 -4.7217 -4.7214 -4.5449 -4.5447 -4.2481 -4.2474 -4.1763 -4.1759 1.9489 2.0219 2.1963 2.2345 2.3056 2.3735 2.6177 2.6496 2.7698 2.8767 3.0094 3.0282 3.2012 3.2119 3.2210 3.2313 3.3134 3.3522 3.4428 3.4754 3.6470 3.6516 3.7020 3.7414 4.0206 4.0632 4.0852 4.0887 4.1299 4.1732 4.2354 4.2904 4.2951 4.2986 4.3532 4.4276 4.6579 4.6862 4.7449 4.7736 4.8259 4.8606 5.0874 5.1059 5.2394 5.2752 5.2999 5.3386 5.7753 5.7883 5.9529 5.9994 6.3465 6.3584 7.5346 7.5427 7.5757 7.5916 7.9396 7.9464 8.0230 8.0746 8.2805 8.2933 11.2968 11.3281 11.3964 11.4182 k = 0.3519 0.5000-0.0000 ( 7626 PWs) bands (ev): -57.7700 -57.7700 -32.1730 -32.1730 -31.3457 -31.3457 -31.3456 -31.3456 -4.6997 -4.6994 -4.5294 -4.5291 -4.2718 -4.2711 -4.1926 -4.1922 1.9618 2.0319 2.1863 2.2275 2.2855 2.3573 2.6317 2.6546 2.7778 2.8939 3.0145 3.0358 3.1986 3.2066 3.2218 3.2324 3.3023 3.3333 3.4419 3.4733 3.6373 3.6386 3.6872 3.7265 4.0256 4.0658 4.0868 4.0912 4.1326 4.1721 4.2363 4.2806 4.2961 4.3074 4.3556 4.4204 4.6805 4.6813 4.7257 4.7738 4.8127 4.8495 5.0775 5.0940 5.2643 5.2675 5.3033 5.3108 5.8023 5.8092 5.9460 5.9861 6.3837 6.3894 7.5201 7.5274 7.5865 7.6012 7.9715 7.9749 8.0531 8.0950 8.2937 8.3052 11.2593 11.2815 11.3459 11.3621 k = 0.3704 0.5000-0.0000 ( 7620 PWs) bands (ev): -57.7700 -57.7700 -32.1730 -32.1730 -31.3457 -31.3457 -31.3456 -31.3456 -4.6772 -4.6768 -4.5137 -4.5134 -4.2959 -4.2953 -4.2089 -4.2086 1.9757 2.0420 2.1765 2.2200 2.2667 2.3411 2.6430 2.6583 2.7906 2.9142 3.0185 3.0431 3.1876 3.2073 3.2217 3.2338 3.2927 3.3134 3.4415 3.4711 3.6272 3.6293 3.6731 3.7121 4.0313 4.0685 4.0880 4.0935 4.1354 4.1709 4.2360 4.2663 4.3020 4.3160 4.3578 4.4138 4.6735 4.7008 4.7096 4.7744 4.8027 4.8451 5.0689 5.0834 5.2334 5.2561 5.3123 5.3286 5.8245 5.8256 5.9415 5.9745 6.4198 6.4206 7.5066 7.5126 7.5977 7.6104 8.0022 8.0026 8.0834 8.1156 8.3045 8.3145 11.2225 11.2378 11.2973 11.3091 k = 0.3889 0.5000-0.0000 ( 7632 PWs) bands (ev): -57.7700 -57.7700 -32.1730 -32.1730 -31.3457 -31.3457 -31.3456 -31.3456 -4.6542 -4.6539 -4.4980 -4.4977 -4.3202 -4.3196 -4.2252 -4.2249 1.9904 2.0520 2.1671 2.2104 2.2509 2.3251 2.6514 2.6610 2.8083 2.9373 3.0209 3.0500 3.1733 3.2091 3.2204 3.2350 3.2848 3.2931 3.4415 3.4687 3.6172 3.6226 3.6601 3.6983 4.0376 4.0712 4.0888 4.0953 4.1383 4.1697 4.2346 4.2528 4.3081 4.3241 4.3596 4.4076 4.6647 4.6913 4.7223 4.7715 4.7982 4.8492 5.0613 5.0742 5.1986 5.2246 5.3339 5.3509 5.8374 5.8414 5.9396 5.9651 6.4508 6.4534 7.4950 7.4999 7.6078 7.6185 8.0276 8.0317 8.1135 8.1364 8.3124 8.3210 11.1883 11.1986 11.2519 11.2605 k = 0.4074 0.5000-0.0000 ( 7628 PWs) bands (ev): -57.7700 -57.7700 -32.1730 -32.1730 -31.3457 -31.3457 -31.3456 -31.3456 -4.6311 -4.6307 -4.4826 -4.4824 -4.3446 -4.3440 -4.2411 -4.2408 2.0060 2.0621 2.1579 2.1968 2.2405 2.3095 2.6570 2.6628 2.8301 2.9626 3.0214 3.0565 3.1572 3.2110 3.2177 3.2345 3.2744 3.2785 3.4420 3.4661 3.6088 3.6169 3.6491 3.6853 4.0445 4.0739 4.0892 4.0963 4.1413 4.1684 4.2323 4.2408 4.3142 4.3313 4.3614 4.4020 4.6564 4.6775 4.7343 4.7653 4.8031 4.8604 5.0550 5.0663 5.1640 5.1905 5.3553 5.3700 5.8451 5.8531 5.9401 5.9584 6.4789 6.4834 7.4854 7.4894 7.6166 7.6252 8.0503 8.0574 8.1429 8.1577 8.3174 8.3243 11.1581 11.1649 11.2110 11.2173 k = 0.4259 0.5000-0.0000 ( 7636 PWs) bands (ev): -57.7700 -57.7700 -32.1730 -32.1730 -31.3457 -31.3457 -31.3456 -31.3456 -4.6082 -4.6078 -4.4680 -4.4677 -4.3685 -4.3680 -4.2562 -4.2559 2.0224 2.0720 2.1491 2.1796 2.2356 2.2947 2.6606 2.6640 2.8550 2.9893 3.0192 3.0626 3.1406 3.2103 3.2128 3.2304 3.2621 3.2736 3.4431 3.4633 3.6022 3.6117 3.6407 3.6733 4.0517 4.0764 4.0892 4.0962 4.1443 4.1669 4.2293 4.2309 4.3202 4.3371 4.3632 4.3968 4.6494 4.6656 4.7382 4.7578 4.8188 4.8755 5.0500 5.0599 5.1306 5.1567 5.3739 5.3857 5.8498 5.8598 5.9423 5.9544 6.5037 6.5089 7.4778 7.4811 7.6239 7.6307 8.0700 8.0786 8.1709 8.1794 8.3191 8.3245 11.1330 11.1374 11.1754 11.1801 k = 0.4444 0.5000-0.0000 ( 7632 PWs) bands (ev): -57.7700 -57.7700 -32.1730 -32.1730 -31.3457 -31.3457 -31.3456 -31.3456 -4.5861 -4.5858 -4.4547 -4.4545 -4.3914 -4.3909 -4.2698 -4.2695 2.0396 2.0815 2.1405 2.1606 2.2347 2.2809 2.6628 2.6647 2.8816 3.0087 3.0214 3.0683 3.1250 3.1935 3.2146 3.2258 3.2582 3.2697 3.4446 3.4605 3.5975 3.6066 3.6357 3.6626 4.0593 4.0789 4.0889 4.0948 4.1474 4.1650 4.2236 4.2260 4.3260 4.3410 4.3657 4.3919 4.6440 4.6559 4.7377 4.7505 4.8410 4.8916 5.0462 5.0549 5.1001 5.1246 5.3891 5.3979 5.8526 5.8624 5.9452 5.9527 6.5242 6.5291 7.4723 7.4748 7.6297 7.6347 8.0861 8.0945 8.1967 8.2007 8.3177 8.3215 11.1138 11.1168 11.1457 11.1494 k = 0.4630 0.5000-0.0000 ( 7644 PWs) bands (ev): -57.7700 -57.7700 -32.1730 -32.1730 -31.3457 -31.3457 -31.3456 -31.3456 -4.5661 -4.5658 -4.4437 -4.4435 -4.4119 -4.4115 -4.2810 -4.2808 2.0573 2.0902 2.1322 2.1415 2.2368 2.2684 2.6641 2.6650 2.9089 2.9992 3.0474 3.0736 3.1123 3.1698 3.2162 3.2230 3.2583 3.2666 3.4466 3.4575 3.5947 3.6017 3.6342 3.6533 4.0668 4.0810 4.0882 4.0919 4.1504 4.1626 4.2191 4.2226 4.3311 4.3424 4.3691 4.3872 4.6405 4.6483 4.7364 4.7444 4.8652 4.9052 5.0440 5.0514 5.0750 5.0952 5.4005 5.4063 5.8547 5.8622 5.9480 5.9523 6.5398 6.5435 7.4686 7.4703 7.6341 7.6373 8.0985 8.1050 8.2187 8.2202 8.3137 8.3161 11.1011 11.1034 11.1226 11.1256 k = 0.4815 0.5000-0.0000 ( 7660 PWs) bands (ev): -57.7700 -57.7700 -32.1730 -32.1730 -31.3457 -31.3457 -31.3456 -31.3456 -4.5508 -4.5506 -4.4362 -4.4361 -4.4274 -4.4271 -4.2886 -4.2884 2.0751 2.0961 2.1245 2.1248 2.2415 2.2575 2.6648 2.6652 2.9357 2.9823 3.0724 3.0786 3.1060 3.1433 3.2178 3.2211 3.2597 3.2639 3.4489 3.4545 3.5938 3.5975 3.6357 3.6455 4.0739 4.0824 4.0872 4.0880 4.1536 4.1598 4.2173 4.2197 4.3356 4.3417 4.3733 4.3825 4.6391 4.6429 4.7360 4.7398 4.8880 4.9112 5.0449 5.0499 5.0586 5.0704 5.4079 5.4108 5.8566 5.8607 5.9502 5.9521 6.5498 6.5518 7.4667 7.4675 7.6370 7.6386 8.1068 8.1103 8.2348 8.2352 8.3089 8.3100 11.0954 11.0974 11.1066 11.1090 k = 0.5000 0.5000-0.0000 ( 7660 PWs) bands (ev): -57.7700 -57.7700 -32.1730 -32.1730 -31.3457 -31.3457 -31.3456 -31.3456 -4.5447 -4.5447 -4.4338 -4.4338 -4.4331 -4.4331 -4.2912 -4.2912 2.0909 2.0909 2.1192 2.1192 2.2484 2.2484 2.6651 2.6651 2.9606 2.9606 3.0817 3.0817 3.1179 3.1179 3.2194 3.2194 3.2617 3.2617 3.4516 3.4516 3.5948 3.5948 3.6396 3.6396 4.0801 4.0801 4.0863 4.0863 4.1567 4.1567 4.2177 4.2177 4.3393 4.3393 4.3779 4.3779 4.6399 4.6399 4.7370 4.7370 4.9051 4.9051 5.0513 5.0513 5.0529 5.0529 5.4114 5.4114 5.8586 5.8586 5.9515 5.9515 6.5539 6.5539 7.4663 7.4663 7.6385 7.6385 8.1108 8.1108 8.2411 8.2411 8.3068 8.3068 11.0962 11.0962 11.1005 11.1005 k = 0.5000 0.5000-0.0000 ( 7660 PWs) bands (ev): -57.7700 -57.7700 -32.1730 -32.1730 -31.3457 -31.3457 -31.3456 -31.3456 -4.5447 -4.5447 -4.4338 -4.4338 -4.4331 -4.4331 -4.2912 -4.2912 2.0909 2.0909 2.1192 2.1192 2.2484 2.2484 2.6651 2.6651 2.9606 2.9606 3.0817 3.0817 3.1179 3.1179 3.2194 3.2194 3.2617 3.2617 3.4516 3.4516 3.5948 3.5948 3.6396 3.6396 4.0801 4.0801 4.0863 4.0863 4.1567 4.1567 4.2177 4.2177 4.3393 4.3393 4.3779 4.3779 4.6399 4.6399 4.7370 4.7370 4.9051 4.9051 5.0513 5.0513 5.0529 5.0529 5.4114 5.4114 5.8586 5.8586 5.9515 5.9515 6.5539 6.5539 7.4663 7.4663 7.6385 7.6385 8.1108 8.1108 8.2411 8.2411 8.3068 8.3068 11.0962 11.0962 11.1005 11.1005 k = 0.4868 0.4868-0.0000 ( 7660 PWs) bands (ev): -57.7700 -57.7700 -32.1730 -32.1730 -31.3457 -31.3457 -31.3456 -31.3456 -4.5510 -4.5508 -4.4329 -4.4329 -4.4305 -4.4303 -4.2885 -4.2884 2.0750 2.0967 2.1204 2.1283 2.2414 2.2576 2.6647 2.6652 2.9353 2.9827 3.0717 3.0791 3.1062 3.1433 3.2178 3.2210 3.2597 3.2640 3.4489 3.4545 3.5938 3.5975 3.6356 3.6456 4.0737 4.0828 4.0866 4.0884 4.1536 4.1598 4.2171 4.2199 4.3356 4.3417 4.3733 4.3825 4.6391 4.6429 4.7360 4.7399 4.8880 4.9111 5.0448 5.0529 5.0543 5.0718 5.4079 5.4108 5.8565 5.8607 5.9502 5.9521 6.5498 6.5518 7.4666 7.4675 7.6370 7.6386 8.1067 8.1104 8.2348 8.2349 8.3090 8.3101 11.0935 11.0967 11.1020 11.1164 k = 0.4737 0.4737-0.0000 ( 7638 PWs) bands (ev): -57.7700 -57.7700 -32.1730 -32.1730 -31.3457 -31.3457 -31.3456 -31.3456 -4.5678 -4.5674 -4.4310 -4.4310 -4.4233 -4.4230 -4.2805 -4.2803 2.0576 2.0925 2.1229 2.1476 2.2363 2.2695 2.6639 2.6652 2.9071 3.0014 3.0454 3.0759 3.1123 3.1695 3.2168 3.2226 3.2580 3.2666 3.4464 3.4577 3.5948 3.6017 3.6336 3.6538 4.0661 4.0824 4.0874 4.0921 4.1506 4.1624 4.2175 4.2243 4.3306 4.3431 4.3689 4.3872 4.6403 4.6482 4.7364 4.7446 4.8655 4.9049 5.0410 5.0579 5.0671 5.0997 5.4006 5.4062 5.8544 5.8628 5.9479 5.9520 6.5397 6.5436 7.4685 7.4703 7.6340 7.6373 8.0981 8.1053 8.2184 8.2184 8.3149 8.3172 11.0839 11.0911 11.1240 11.1542 k = 0.4605 0.4605-0.0000 ( 7626 PWs) bands (ev): -57.7700 -57.7700 -32.1730 -32.1730 -31.3457 -31.3457 -31.3456 -31.3456 -4.5913 -4.5909 -4.4279 -4.4278 -4.4144 -4.4141 -4.2682 -4.2678 2.0409 2.0858 2.1238 2.1683 2.2342 2.2844 2.6621 2.6652 2.8767 3.0156 3.0177 3.0739 3.1236 3.1924 3.2180 3.2241 3.2567 3.2694 3.4442 3.4611 3.5977 3.6069 3.6337 3.6641 4.0578 4.0814 4.0882 4.0950 4.1479 4.1643 4.2183 4.2309 4.3245 4.3434 4.3649 4.3918 4.6433 4.6553 4.7381 4.7514 4.8417 4.8921 5.0372 5.0616 5.0929 5.1330 5.3895 5.3978 5.8519 5.8644 5.9446 5.9513 6.5243 6.5297 7.4719 7.4748 7.6297 7.6347 8.0850 8.0954 8.1947 8.1956 8.3222 8.3257 11.0698 11.0799 11.1655 11.2114 k = 0.4474 0.4474-0.0000 ( 7634 PWs) bands (ev): -57.7700 -57.7700 -32.1730 -32.1730 -31.3457 -31.3457 -31.3456 -31.3456 -4.6192 -4.6188 -4.4235 -4.4235 -4.4052 -4.4050 -4.2527 -4.2522 2.0253 2.0784 2.1222 2.1837 2.2396 2.3025 2.6590 2.6648 2.8449 2.9867 3.0311 3.0735 3.1369 3.2041 3.2254 3.2288 3.2557 3.2726 3.4422 3.4647 3.6021 3.6126 3.6360 3.6764 4.0493 4.0799 4.0890 4.0968 4.1452 4.1655 4.2193 4.2397 4.3173 4.3426 4.3614 4.3964 4.6475 4.6636 4.7400 4.7592 4.8196 4.8790 5.0333 5.0654 5.1251 5.1694 5.3751 5.3858 5.8487 5.8651 5.9403 5.9500 6.5044 6.5107 7.4768 7.4808 7.6239 7.6308 8.0677 8.0809 8.1659 8.1685 8.3301 8.3348 11.0519 11.0642 11.2237 11.2861 k = 0.4342 0.4342-0.0000 ( 7630 PWs) bands (ev): -57.7700 -57.7700 -32.1730 -32.1730 -31.3457 -31.3457 -31.3456 -31.3456 -4.6498 -4.6494 -4.4180 -4.4179 -4.3961 -4.3959 -4.2351 -4.2345 2.0108 2.0707 2.1181 2.1878 2.2577 2.3236 2.6539 2.6635 2.8136 2.9596 3.0433 3.0746 3.1511 3.2056 3.2269 3.2483 3.2551 3.2761 3.4405 3.4688 3.6074 3.6188 3.6410 3.6904 4.0410 4.0781 4.0899 4.0978 4.1426 4.1662 4.2202 4.2500 4.3094 4.3410 4.3583 4.4011 4.6524 4.6723 4.7410 4.7635 4.8050 4.8698 5.0294 5.0692 5.1606 5.2077 5.3580 5.3707 5.8446 5.8645 5.9346 5.9480 6.4812 6.4878 7.4832 7.4885 7.6169 7.6256 8.0467 8.0619 8.1333 8.1390 8.3386 8.3445 11.0310 11.0450 11.2953 11.3760 k = 0.4211 0.4211-0.0000 ( 7632 PWs) bands (ev): -57.7700 -57.7700 -32.1730 -32.1730 -31.3457 -31.3457 -31.3456 -31.3456 -4.6823 -4.6819 -4.4113 -4.4112 -4.3869 -4.3868 -4.2166 -4.2159 1.9971 2.0627 2.1113 2.1831 2.2851 2.3475 2.6461 2.6592 2.7855 2.9360 3.0548 3.0773 3.1653 3.2049 3.2289 3.2549 3.2678 3.2805 3.4392 3.4732 3.6128 3.6254 3.6489 3.7056 4.0330 4.0759 4.0908 4.0981 4.1400 4.1665 4.2208 4.2606 4.3015 4.3385 4.3557 4.4060 4.6577 4.6810 4.7391 4.7544 4.8090 4.8676 5.0254 5.0731 5.1976 5.2462 5.3391 5.3528 5.8397 5.8621 5.9274 5.9448 6.4564 6.4621 7.4910 7.4979 7.6086 7.6193 8.0228 8.0385 8.0981 8.1087 8.3478 8.3548 11.0077 11.0229 11.3756 11.4779 k = 0.4079 0.4079-0.0000 ( 7624 PWs) bands (ev): -57.7700 -57.7700 -32.1730 -32.1730 -31.3457 -31.3457 -31.3456 -31.3456 -4.7160 -4.7157 -4.4034 -4.4033 -4.3774 -4.3774 -4.1977 -4.1969 1.9839 2.0542 2.1021 2.1739 2.3174 2.3736 2.6349 2.6484 2.7652 2.9175 3.0659 3.0813 3.1785 3.2040 3.2321 3.2549 3.2805 3.2910 3.4383 3.4780 3.6180 3.6323 3.6598 3.7218 4.0255 4.0733 4.0917 4.0981 4.1371 4.1669 4.2212 4.2693 4.2957 4.3355 4.3537 4.4110 4.6630 4.6886 4.7336 4.7374 4.8264 4.8739 5.0215 5.0770 5.2348 5.2803 5.3225 5.3326 5.8343 5.8578 5.9179 5.9394 6.4314 6.4354 7.5000 7.5090 7.5995 7.6121 7.9966 8.0111 8.0615 8.0792 8.3577 8.3657 10.9825 10.9987 11.4567 11.5876 k = 0.3947 0.3947-0.0000 ( 7622 PWs) bands (ev): -57.7700 -57.7700 -32.1730 -32.1730 -31.3457 -31.3457 -31.3456 -31.3456 -4.7507 -4.7504 -4.3945 -4.3944 -4.3674 -4.3674 -4.1792 -4.1783 1.9708 2.0448 2.0907 2.1616 2.3524 2.4011 2.6202 2.6279 2.7566 2.9050 3.0771 3.0866 3.1894 3.2031 3.2376 3.2554 3.2858 3.3083 3.4379 3.4834 3.6231 3.6394 3.6730 3.7385 4.0187 4.0703 4.0926 4.0979 4.1339 4.1674 4.2214 4.2706 4.2965 4.3318 4.3524 4.4163 4.6682 4.6934 4.7215 4.7251 4.8499 4.8880 5.0176 5.0809 5.2710 5.2820 5.3105 5.3357 5.8292 5.8517 5.9061 5.9309 6.4080 6.4092 7.5100 7.5218 7.5901 7.6041 7.9689 7.9804 8.0243 8.0514 8.3681 8.3770 10.9559 10.9729 11.5214 11.5790 k = 0.3816 0.3816-0.0000 ( 7604 PWs) bands (ev): -57.7700 -57.7700 -32.1730 -32.1730 -31.3457 -31.3457 -31.3456 -31.3456 -4.7859 -4.7856 -4.3844 -4.3843 -4.3570 -4.3568 -4.1613 -4.1603 1.9575 2.0342 2.0770 2.1467 2.3894 2.4286 2.5991 2.6029 2.7594 2.8993 3.0884 3.0932 3.1969 3.2023 3.2460 3.2568 3.2902 3.3256 3.4381 3.4892 3.6282 3.6468 3.6880 3.7555 4.0126 4.0668 4.0936 4.0976 4.1303 4.1681 4.2215 4.2646 4.3035 4.3277 4.3525 4.4217 4.6731 4.6887 4.7151 4.7152 4.8772 4.9084 5.0138 5.0849 5.2596 5.2867 5.3050 5.3695 5.8256 5.8429 5.8926 5.9184 6.3852 6.3878 7.5201 7.5359 7.5815 7.5961 7.9402 7.9474 7.9879 8.0262 8.3788 8.3885 10.9284 10.9461 11.5380 11.5407 k = 0.3684 0.3684-0.0000 ( 7606 PWs) bands (ev): -57.7700 -57.7700 -32.1730 -32.1730 -31.3456 -31.3456 -31.3456 -31.3456 -4.8214 -4.8212 -4.3734 -4.3732 -4.3458 -4.3456 -4.1443 -4.1432 1.9436 2.0220 2.0613 2.1292 2.4280 2.4535 2.5653 2.5859 2.7707 2.9001 3.1001 3.1008 3.2011 3.2019 3.2529 3.2636 3.2948 3.3421 3.4390 3.4957 3.6335 3.6543 3.7042 3.7725 4.0072 4.0628 4.0946 4.0974 4.1262 4.1691 4.2215 4.2563 4.3105 4.3231 4.3546 4.4272 4.6749 4.6773 4.7054 4.7186 4.9072 4.9331 5.0102 5.0890 5.2333 5.2618 5.3356 5.4030 5.8243 5.8290 5.8809 5.9011 6.3649 6.3716 7.5281 7.5503 7.5761 7.5895 7.9105 7.9131 7.9532 8.0035 8.3894 8.3999 10.9002 10.9186 11.4911 11.5190 k = 0.3553 0.3553-0.0000 ( 7609 PWs) bands (ev): -57.7700 -57.7700 -32.1730 -32.1730 -31.3456 -31.3456 -31.3456 -31.3456 -4.8571 -4.8569 -4.3614 -4.3612 -4.3340 -4.3338 -4.1283 -4.1272 1.9287 2.0079 2.0437 2.1093 2.4677 2.4687 2.5295 2.5767 2.7884 2.9071 3.1094 3.1121 3.2017 3.2031 3.2552 3.2779 3.2996 3.3578 3.4409 3.5028 3.6391 3.6620 3.7211 3.7893 4.0026 4.0584 4.0955 4.0973 4.1217 4.1703 4.2215 4.2476 4.3149 4.3181 4.3596 4.4329 4.6598 4.6793 4.6983 4.7244 4.9390 4.9604 5.0068 5.0932 5.2053 5.2359 5.3617 5.4330 5.8069 5.8259 5.8754 5.8799 6.3491 6.3601 7.5303 7.5595 7.5782 7.5901 7.8785 7.8798 7.9214 7.9836 8.3997 8.4110 10.8718 10.8909 11.4393 11.4791 k = 0.3421 0.3421-0.0000 ( 7607 PWs) bands (ev): -57.7700 -57.7700 -32.1730 -32.1730 -31.3456 -31.3456 -31.3456 -31.3456 -4.8926 -4.8924 -4.3485 -4.3483 -4.3215 -4.3212 -4.1134 -4.1123 1.9127 1.9917 2.0241 2.0870 2.4652 2.4928 2.5085 2.5850 2.8113 2.9195 3.1186 3.1244 3.2019 3.2040 3.2567 3.2949 3.3048 3.3727 3.4442 3.5107 3.6450 3.6699 3.7383 3.8058 3.9990 4.0536 4.0964 4.0973 4.1167 4.1718 4.2217 4.2391 4.3127 4.3163 4.3673 4.4388 4.6454 4.6764 4.6971 4.7306 4.9717 4.9881 5.0044 5.0976 5.1763 5.2097 5.3830 5.4583 5.7769 5.8245 5.8619 5.8778 6.3381 6.3531 7.5260 7.5577 7.5884 7.6042 7.8443 7.8482 7.8931 7.9666 8.4095 8.4215 10.8435 10.8633 11.3835 11.4297 k = 0.3289 0.3289-0.0000 ( 7607 PWs) bands (ev): -57.7700 -57.7700 -32.1730 -32.1730 -31.3456 -31.3456 -31.3456 -31.3456 -4.9279 -4.9278 -4.3347 -4.3345 -4.3084 -4.3081 -4.0998 -4.0986 1.8952 1.9733 2.0028 2.0625 2.4456 2.4564 2.5496 2.6088 2.8387 2.9366 3.1281 3.1366 3.2026 3.2043 3.2586 3.3105 3.3132 3.3865 3.4493 3.5195 3.6513 3.6779 3.7556 3.8218 3.9964 4.0484 4.0971 4.0974 4.1114 4.1735 4.2220 4.2309 4.3070 4.3153 4.3767 4.4447 4.6322 4.6704 4.7006 4.7369 4.9992 5.0041 5.0180 5.1022 5.1469 5.1836 5.3999 5.4788 5.7415 5.8032 5.8654 5.8875 6.3316 6.3500 7.5189 7.5514 7.6031 7.6255 7.8109 7.8161 7.8680 7.9527 8.4184 8.4311 10.8153 10.8361 11.3243 11.3737 k = 0.3158 0.3158-0.0000 ( 7607 PWs) bands (ev): -57.7700 -57.7700 -32.1730 -32.1730 -31.3456 -31.3456 -31.3456 -31.3456 -4.9628 -4.9627 -4.3202 -4.3200 -4.2947 -4.2943 -4.0874 -4.0862 1.8762 1.9527 1.9797 2.0358 2.4182 2.4204 2.5911 2.6397 2.8704 2.9579 3.1376 3.1484 3.2037 3.2047 3.2613 3.3169 3.3323 3.3988 3.4565 3.5292 3.6578 3.6859 3.7725 3.8374 3.9947 4.0428 4.0975 4.0979 4.1061 4.1755 4.2225 4.2232 4.3009 4.3130 4.3869 4.4506 4.6204 4.6645 4.7057 4.7431 4.9974 5.0345 5.0412 5.1064 5.1182 5.1586 5.4144 5.4952 5.7031 5.7692 5.8842 5.9035 6.3287 6.3500 7.5118 7.5448 7.6198 7.6501 7.7788 7.7846 7.8457 7.9422 8.4262 8.4397 10.7876 10.8095 11.2623 11.3125 k = 0.3026 0.3026-0.0000 ( 7619 PWs) bands (ev): -57.7700 -57.7700 -32.1730 -32.1730 -31.3456 -31.3456 -31.3455 -31.3455 -4.9972 -4.9971 -4.3050 -4.3048 -4.2804 -4.2800 -4.0762 -4.0750 1.8557 1.9298 1.9551 2.0074 2.3851 2.3876 2.6324 2.6736 2.9057 2.9827 3.1466 3.1592 3.2053 3.2056 3.2652 3.3241 3.3518 3.4096 3.4664 3.5400 3.6647 3.6941 3.7889 3.8523 3.9942 4.0367 4.0964 4.0985 4.1018 4.1776 4.2163 4.2232 4.2945 4.3096 4.3971 4.4567 4.6100 4.6599 4.7114 4.7492 4.9955 5.0568 5.0583 5.0901 5.1138 5.1371 5.4293 5.5093 5.6634 5.7311 5.9098 5.9249 6.3288 6.3523 7.5057 7.5392 7.6366 7.6766 7.7481 7.7545 7.8257 7.9356 8.4329 8.4471 10.7604 10.7836 11.1979 11.2473 k = 0.2895 0.2895-0.0000 ( 7623 PWs) bands (ev): -57.7700 -57.7700 -32.1730 -32.1730 -31.3456 -31.3456 -31.3455 -31.3455 -5.0309 -5.0308 -4.2893 -4.2890 -4.2657 -4.2652 -4.0663 -4.0650 1.8337 1.9048 1.9290 1.9775 2.3504 2.3556 2.6733 2.7086 2.9441 3.0102 3.1545 3.1684 3.2066 3.2083 3.2710 3.3324 3.3714 3.4191 3.4788 3.5522 3.6718 3.7022 3.8045 3.8666 3.9949 4.0302 4.0921 4.0996 4.1004 4.1796 4.2101 4.2241 4.2879 4.3057 4.4071 4.4628 4.6011 4.6571 4.7175 4.7552 4.9941 5.0499 5.0580 5.0905 5.1206 5.1234 5.4478 5.5232 5.6244 5.6912 5.9398 5.9502 6.3309 6.3562 7.5013 7.5350 7.6523 7.7003 7.7192 7.7302 7.8081 7.9335 8.4382 8.4533 10.7338 10.7587 11.1316 11.1787 k = 0.2763 0.2763-0.0000 ( 7627 PWs) bands (ev): -57.7700 -57.7700 -32.1730 -32.1730 -31.3456 -31.3456 -31.3455 -31.3455 -5.0638 -5.0637 -4.2730 -4.2728 -4.2505 -4.2501 -4.0575 -4.0562 1.8104 1.8780 1.9016 1.9464 2.3165 2.3230 2.7133 2.7437 2.9851 3.0397 3.1611 3.1756 3.2084 3.2118 3.2792 3.3419 3.3909 3.4277 3.4935 3.5660 3.6793 3.7105 3.8191 3.8802 3.9968 4.0233 4.0867 4.1002 4.1010 4.1814 4.2051 4.2250 4.2812 4.3014 4.4166 4.4689 4.5936 4.6563 4.7240 4.7610 4.9932 5.0221 5.0441 5.1028 5.1171 5.1293 5.4726 5.5359 5.5908 5.6511 5.9723 5.9780 6.3343 6.3611 7.4987 7.5324 7.6647 7.6905 7.6932 7.7411 7.7940 7.9366 8.4422 8.4581 10.7075 10.7346 11.0636 11.1072 k = 0.2632 0.2632-0.0000 ( 7623 PWs) bands (ev): -57.7700 -57.7700 -32.1730 -32.1730 -31.3456 -31.3456 -31.3455 -31.3455 -5.0959 -5.0958 -4.2563 -4.2561 -4.2351 -4.2346 -4.0497 -4.0485 1.7861 1.8497 1.8730 1.9144 2.2832 2.2903 2.7523 2.7784 3.0277 3.0703 3.1662 3.1810 3.2106 3.2163 3.2901 3.3529 3.4100 3.4361 3.5099 3.5816 3.6872 3.7187 3.8324 3.8931 3.9998 4.0161 4.0815 4.0998 4.1028 4.1822 4.2018 4.2258 4.2746 4.2969 4.4255 4.4752 4.5877 4.6576 4.7308 4.7668 4.9925 4.9932 5.0231 5.1101 5.1106 5.1379 5.5047 5.5281 5.5846 5.6114 6.0061 6.0072 6.3384 6.3664 7.4981 7.5315 7.6599 7.6657 7.6833 7.7588 7.7930 7.9455 8.4449 8.4616 10.6815 10.7114 10.9946 11.0336 k = 0.2500 0.2500-0.0000 ( 7609 PWs) bands (ev): -57.7700 -57.7700 -32.1730 -32.1730 -31.3456 -31.3456 -31.3455 -31.3455 -5.1269 -5.1269 -4.2394 -4.2391 -4.2194 -4.2189 -4.0431 -4.0418 1.7610 1.8202 1.8436 1.8818 2.2506 2.2577 2.7899 2.8124 3.0707 3.1004 3.1699 3.1859 3.2126 3.2215 3.3037 3.3654 3.4282 3.4447 3.5278 3.5993 3.6954 3.7270 3.8443 3.9053 4.0037 4.0085 4.0771 4.0990 4.1050 4.1815 4.2009 4.2264 4.2686 4.2923 4.4338 4.4815 4.5833 4.6611 4.7380 4.7724 4.9649 4.9879 5.0044 5.1004 5.1131 5.1442 5.4976 5.5436 5.5728 5.6097 6.0367 6.0402 6.3428 6.3718 7.4994 7.5321 7.6378 7.6411 7.6893 7.7543 7.8186 7.9600 8.4463 8.4638 10.6549 10.6889 10.9252 10.9583 k = 0.2368 0.2368-0.0000 ( 7627 PWs) bands (ev): -57.7700 -57.7700 -32.1730 -32.1730 -31.3456 -31.3456 -31.3455 -31.3455 -5.1569 -5.1569 -4.2222 -4.2220 -4.2036 -4.2031 -4.0374 -4.0362 1.7352 1.7899 1.8134 1.8487 2.2186 2.2255 2.8259 2.8451 3.1125 3.1276 3.1727 3.1924 3.2144 3.2277 3.3196 3.3794 3.4454 3.4539 3.5468 3.6189 3.7040 3.7353 3.8548 3.9165 4.0007 4.0078 4.0743 4.0977 4.1071 4.1795 4.2022 4.2263 4.2634 4.2879 4.4413 4.4880 4.5803 4.6666 4.7455 4.7779 4.9375 4.9687 5.0003 5.0864 5.1118 5.1489 5.4645 5.5356 5.5883 5.6459 6.0659 6.0738 6.3470 6.3768 7.5022 7.5339 7.6153 7.6179 7.6944 7.7448 7.8528 7.9796 8.4466 8.4648 10.6268 10.6664 10.8568 10.8822 k = 0.2237 0.2237-0.0000 ( 7615 PWs) bands (ev): -57.7700 -57.7700 -32.1730 -32.1730 -31.3456 -31.3456 -31.3455 -31.3455 -5.1857 -5.1857 -4.2050 -4.2047 -4.1877 -4.1872 -4.0326 -4.0314 1.7092 1.7593 1.7827 1.8154 2.1873 2.1937 2.8601 2.8765 3.1479 3.1497 3.1756 3.2034 3.2169 3.2359 3.3371 3.3949 3.4613 3.4639 3.5669 3.6405 3.7131 3.7436 3.8638 3.9269 3.9928 4.0112 4.0738 4.0961 4.1090 4.1777 4.2050 4.2254 4.2597 4.2839 4.4483 4.4945 4.5789 4.6740 4.7534 4.7832 4.9114 4.9451 5.0014 5.0706 5.1061 5.1534 5.4330 5.5004 5.6371 5.6885 6.0941 6.1062 6.3509 6.3812 7.5061 7.5363 7.5942 7.5963 7.6982 7.7366 7.8890 8.0033 8.4460 8.4649 10.5947 10.6424 10.7916 10.8069 k = 0.2105 0.2105-0.0000 ( 7627 PWs) bands (ev): -57.7700 -57.7700 -32.1730 -32.1730 -31.3456 -31.3456 -31.3455 -31.3455 -5.2133 -5.2133 -4.1878 -4.1875 -4.1720 -4.1715 -4.0286 -4.0275 1.6832 1.7287 1.7517 1.7821 2.1567 2.1625 2.8925 2.9063 3.1591 3.1705 3.1864 3.2115 3.2296 3.2493 3.3560 3.4115 3.4746 3.4758 3.5881 3.6636 3.7228 3.7521 3.8715 3.9363 3.9848 4.0129 4.0756 4.0949 4.1096 4.1773 4.2084 4.2236 4.2577 4.2803 4.4550 4.5012 4.5789 4.6826 4.7618 4.7882 4.8868 4.9218 5.0022 5.0554 5.0968 5.1585 5.4037 5.4672 5.6887 5.7356 6.1211 6.1371 6.3541 6.3848 7.5103 7.5381 7.5746 7.5765 7.7018 7.7314 7.9259 8.0299 8.4447 8.4641 10.5551 10.6127 10.7332 10.7366 k = 0.1974 0.1974-0.0000 ( 7629 PWs) bands (ev): -57.7700 -57.7700 -32.1730 -32.1730 -31.3456 -31.3456 -31.3455 -31.3455 -5.2396 -5.2395 -4.1708 -4.1705 -4.1564 -4.1559 -4.0254 -4.0243 1.6575 1.6985 1.7208 1.7489 2.1269 2.1320 2.9226 2.9343 3.1643 3.1737 3.2025 3.2126 3.2531 3.2705 3.3756 3.4292 3.4862 3.4891 3.6102 3.6878 3.7331 3.7606 3.8781 3.9447 3.9769 4.0124 4.0771 4.0969 4.1082 4.1795 4.2124 4.2214 4.2571 4.2772 4.4618 4.5081 4.5802 4.6918 4.7709 4.7929 4.8641 4.8997 4.9991 5.0453 5.0851 5.1643 5.3770 5.4362 5.7421 5.7856 6.1465 6.1660 6.3567 6.3875 7.5137 7.5380 7.5566 7.5590 7.7066 7.7305 7.9628 8.0580 8.4431 8.4628 10.5040 10.5680 10.6803 10.6856 k = 0.1842 0.1842-0.0000 ( 7625 PWs) bands (ev): -57.7700 -57.7700 -32.1729 -32.1729 -31.3456 -31.3456 -31.3455 -31.3455 -5.2644 -5.2644 -4.1541 -4.1538 -4.1411 -4.1406 -4.0228 -4.0217 1.6323 1.6690 1.6902 1.7162 2.0981 2.1025 2.9506 2.9604 3.1671 3.1748 3.2110 3.2125 3.2783 3.2964 3.3957 3.4477 3.4983 3.5011 3.6330 3.7121 3.7440 3.7693 3.8838 3.9522 3.9692 4.0101 4.0744 4.1043 4.1054 4.1848 4.2168 4.2193 4.2577 4.2749 4.4689 4.5151 4.5829 4.7004 4.7804 4.7970 4.8437 4.8795 4.9893 5.0441 5.0723 5.1707 5.3532 5.4074 5.7965 5.8374 6.1702 6.1927 6.3584 6.3892 7.5153 7.5329 7.5405 7.5458 7.7141 7.7346 7.9993 8.0866 8.4414 8.4612 10.4408 10.5024 10.6437 10.6493 k = 0.1711 0.1711-0.0000 ( 7627 PWs) bands (ev): -57.7700 -57.7700 -32.1729 -32.1729 -31.3456 -31.3456 -31.3455 -31.3455 -5.2878 -5.2878 -4.1378 -4.1375 -4.1263 -4.1258 -4.0208 -4.0198 1.6079 1.6405 1.6601 1.6841 2.0703 2.0740 2.9763 2.9844 3.1689 3.1758 3.2120 3.2151 3.3025 3.3217 3.4159 3.4666 3.5109 3.5121 3.6563 3.7359 3.7555 3.7782 3.8888 3.9582 3.9619 4.0066 4.0686 4.0979 4.1185 4.1927 4.2179 4.2216 4.2590 4.2732 4.4768 4.5224 4.5865 4.7072 4.7901 4.7999 4.8263 4.8620 4.9758 5.0498 5.0594 5.1774 5.3324 5.3809 5.8508 5.8898 6.1921 6.2170 6.3593 6.3899 7.5131 7.5211 7.5272 7.5380 7.7253 7.7442 8.0351 8.1148 8.4401 8.4595 10.3682 10.4234 10.6184 10.6212 k = 0.1579 0.1579-0.0000 ( 7621 PWs) bands (ev): -57.7700 -57.7700 -32.1729 -32.1729 -31.3456 -31.3456 -31.3455 -31.3455 -5.3097 -5.3097 -4.1220 -4.1218 -4.1119 -4.1115 -4.0193 -4.0183 1.5844 1.6133 1.6309 1.6530 2.0437 2.0467 2.9995 3.0062 3.1705 3.1768 3.2112 3.2169 3.3251 3.3441 3.4359 3.4853 3.5221 3.5234 3.6798 3.7583 3.7677 3.7874 3.8933 3.9542 3.9642 4.0026 4.0609 4.0896 4.1339 4.2023 4.2175 4.2269 4.2607 4.2721 4.4859 4.5298 4.5910 4.7112 4.7980 4.7986 4.8156 4.8482 4.9631 5.0473 5.0595 5.1843 5.3145 5.3568 5.9045 5.9418 6.2121 6.2388 6.3594 6.3895 7.5052 7.5079 7.5184 7.5303 7.7407 7.7587 8.0700 8.1421 8.4394 8.4580 10.2897 10.3381 10.5960 10.5978 k = 0.1447 0.1447-0.0000 ( 7617 PWs) bands (ev): -57.7700 -57.7700 -32.1729 -32.1729 -31.3455 -31.3455 -31.3455 -31.3455 -5.3301 -5.3301 -4.1069 -4.1067 -4.0982 -4.0978 -4.0182 -4.0173 1.5621 1.5874 1.6028 1.6230 2.0184 2.0209 3.0202 3.0256 3.1724 3.1782 3.2105 3.2176 3.3455 3.3631 3.4554 3.5033 3.5313 3.5356 3.7029 3.7785 3.7803 3.7971 3.8973 3.9474 3.9685 3.9984 4.0521 4.0799 4.1504 4.2125 4.2183 4.2326 4.2627 4.2715 4.4964 4.5375 4.5958 4.7113 4.7888 4.8042 4.8142 4.8386 4.9546 5.0365 5.0718 5.1915 5.2997 5.3352 5.9570 5.9926 6.2301 6.2578 6.3588 6.3881 7.4943 7.4955 7.5113 7.5211 7.7600 7.7772 8.1043 8.1684 8.4395 8.4569 10.2076 10.2495 10.5703 10.5763 k = 0.1316 0.1316-0.0000 ( 7619 PWs) bands (ev): -57.7700 -57.7700 -32.1729 -32.1729 -31.3455 -31.3455 -31.3455 -31.3455 -5.3488 -5.3488 -4.0927 -4.0925 -4.0853 -4.0849 -4.0175 -4.0166 1.5412 1.5632 1.5762 1.5944 1.9947 1.9966 3.0383 3.0425 3.1748 3.1801 3.2097 3.2176 3.3639 3.3790 3.4742 3.5200 3.5398 3.5470 3.7253 3.7929 3.7954 3.8080 3.9010 3.9410 3.9721 3.9942 4.0425 4.0693 4.1671 4.2202 4.2223 4.2388 4.2647 4.2713 4.5085 4.5453 4.6005 4.7071 4.7786 4.8064 4.8157 4.8316 4.9523 5.0275 5.0864 5.1988 5.2879 5.3161 6.0075 6.0413 6.2464 6.2741 6.3577 6.3859 7.4835 7.4842 7.5033 7.5106 7.7822 7.7983 8.1383 8.1939 8.4404 8.4561 10.1233 10.1591 10.5364 10.5541 k = 0.1184 0.1184-0.0000 ( 7623 PWs) bands (ev): -57.7700 -57.7700 -32.1729 -32.1729 -31.3455 -31.3455 -31.3455 -31.3455 -5.3659 -5.3659 -4.0793 -4.0791 -4.0731 -4.0728 -4.0170 -4.0162 1.5218 1.5408 1.5512 1.5676 1.9726 1.9741 3.0536 3.0568 3.1778 3.1826 3.2089 3.2171 3.3800 3.3923 3.4920 3.5350 3.5475 3.5574 3.7467 3.8054 3.8084 3.8206 3.9044 3.9353 3.9748 3.9902 4.0326 4.0582 4.1831 4.2234 4.2308 4.2454 4.2668 4.2715 4.5221 4.5534 4.6046 4.6994 4.7704 4.8070 4.8173 4.8241 4.9568 5.0205 5.1029 5.2063 5.2789 5.2997 6.0557 6.0872 6.2608 6.2878 6.3561 6.3829 7.4737 7.4741 7.4941 7.4993 7.8060 7.8205 8.1728 8.2192 8.4418 8.4556 10.0382 10.0680 10.4983 10.5261 k = 0.1053 0.1053-0.0000 ( 7623 PWs) bands (ev): -57.7700 -57.7700 -32.1729 -32.1729 -31.3455 -31.3455 -31.3455 -31.3455 -5.3813 -5.3813 -4.0670 -4.0669 -4.0620 -4.0617 -4.0168 -4.0161 1.5041 1.5203 1.5281 1.5427 1.9524 1.9534 3.0663 3.0686 3.1815 3.1857 3.2083 3.2163 3.3941 3.4034 3.5088 3.5482 3.5547 3.5666 3.7669 3.8171 3.8188 3.8332 3.9075 3.9302 3.9769 3.9866 4.0227 4.0469 4.1979 4.2276 4.2380 4.2519 4.2688 4.2720 4.5367 4.5616 4.6076 4.6892 4.7646 4.8075 4.8147 4.8182 4.9662 5.0156 5.1214 5.2141 5.2725 5.2860 6.1007 6.1295 6.2738 6.2989 6.3543 6.3792 7.4650 7.4652 7.4843 7.4879 7.8299 7.8421 8.2082 8.2453 8.4436 8.4553 9.9533 9.9773 10.4617 10.4888 k = 0.0921 0.0921-0.0000 ( 7633 PWs) bands (ev): -57.7700 -57.7700 -32.1729 -32.1729 -31.3455 -31.3455 -31.3455 -31.3455 -5.3949 -5.3949 -4.0558 -4.0557 -4.0519 -4.0516 -4.0167 -4.0161 1.4883 1.5018 1.5072 1.5200 1.9341 1.9348 3.0764 3.0780 3.1856 3.1893 3.2077 3.2152 3.4061 3.4127 3.5242 3.5594 3.5613 3.5744 3.7858 3.8279 3.8281 3.8442 3.9102 3.9258 3.9784 3.9834 4.0130 4.0356 4.2110 4.2325 4.2440 4.2576 4.2708 4.2727 4.5519 4.5698 4.6094 4.6777 4.7609 4.8019 4.8102 4.8185 4.9775 5.0127 5.1416 5.2224 5.2684 5.2751 6.1419 6.1671 6.2857 6.3077 6.3524 6.3751 7.4574 7.4575 7.4743 7.4766 7.8525 7.8620 8.2452 8.2730 8.4454 8.4549 9.8698 9.8882 10.4285 10.4521 k = 0.0789 0.0789-0.0000 ( 7637 PWs) bands (ev): -57.7700 -57.7700 -32.1729 -32.1729 -31.3455 -31.3455 -31.3455 -31.3455 -5.4068 -5.4068 -4.0460 -4.0459 -4.0429 -4.0427 -4.0167 -4.0162 1.4743 1.4856 1.4888 1.4997 1.9180 1.9184 3.0842 3.0853 3.1902 3.1933 3.2073 3.2141 3.4162 3.4206 3.5382 3.5673 3.5687 3.5808 3.8033 3.8369 3.8375 3.8531 3.9124 3.9222 3.9794 3.9808 4.0040 4.0245 4.2221 4.2381 4.2492 4.2620 4.2728 4.2736 4.5670 4.5781 4.6100 4.6660 4.7587 4.7903 4.8115 4.8183 4.9884 5.0113 5.1631 5.2311 5.2658 5.2670 6.1785 6.1992 6.2972 6.3148 6.3507 6.3706 7.4508 7.4509 7.4647 7.4661 7.8725 7.8792 8.2837 8.3030 8.4468 8.4544 9.7891 9.8024 10.3994 10.4194 k = 0.0658 0.0658-0.0000 ( 7627 PWs) bands (ev): -57.7700 -57.7700 -32.1729 -32.1729 -31.3455 -31.3455 -31.3455 -31.3455 -5.4169 -5.4169 -4.0375 -4.0374 -4.0351 -4.0350 -4.0168 -4.0164 1.4624 1.4715 1.4729 1.4820 1.9041 1.9044 3.0901 3.0907 3.1947 3.1972 3.2070 3.2130 3.4244 3.4271 3.5507 3.5727 3.5762 3.5859 3.8193 3.8451 3.8457 3.8599 3.9140 3.9195 3.9789 3.9799 3.9958 4.0139 4.2315 4.2439 4.2535 4.2649 4.2747 4.2749 4.5812 4.5863 4.6100 4.6546 4.7572 4.7788 4.8131 4.8178 4.9977 5.0111 5.1848 5.2399 5.2614 5.2643 6.2096 6.2248 6.3088 6.3210 6.3493 6.3661 7.4454 7.4455 7.4558 7.4567 7.8889 7.8931 8.3229 8.3349 8.4477 8.4536 9.7132 9.7220 10.3747 10.3912 k = 0.0526 0.0526-0.0000 ( 7629 PWs) bands (ev): -57.7700 -57.7700 -32.1729 -32.1729 -31.3455 -31.3455 -31.3455 -31.3455 -5.4252 -5.4252 -4.0305 -4.0304 -4.0286 -4.0285 -4.0169 -4.0165 1.4527 1.4598 1.4599 1.4671 1.8926 1.8927 3.0943 3.0946 3.1990 3.2009 3.2069 3.2118 3.4310 3.4324 3.5617 3.5775 3.5818 3.5894 3.8336 3.8525 3.8526 3.8646 3.9150 3.9176 3.9778 3.9801 3.9887 4.0040 4.2393 4.2491 4.2568 4.2663 4.2764 4.2765 4.5938 4.5941 4.6096 4.6440 4.7558 4.7685 4.8145 4.8172 5.0047 5.0116 5.2057 5.2483 5.2582 5.2633 6.2342 6.2435 6.3208 6.3272 6.3482 6.3617 7.4409 7.4410 7.4481 7.4485 7.9016 7.9039 8.3611 8.3675 8.4482 8.4526 9.6443 9.6494 10.3546 10.3677 k = 0.0395 0.0395-0.0000 ( 7619 PWs) bands (ev): -57.7700 -57.7700 -32.1729 -32.1729 -31.3455 -31.3455 -31.3455 -31.3455 -5.4317 -5.4317 -4.0250 -4.0249 -4.0234 -4.0234 -4.0170 -4.0167 1.4453 1.4498 1.4505 1.4552 1.8835 1.8836 3.0972 3.0974 3.2026 3.2041 3.2070 3.2108 3.4359 3.4365 3.5710 3.5816 3.5858 3.5916 3.8459 3.8581 3.8589 3.8675 3.9154 3.9163 3.9773 3.9800 3.9831 3.9951 4.2461 4.2535 4.2592 4.2664 4.2780 4.2781 4.6014 4.6040 4.6097 4.6346 4.7540 4.7601 4.8157 4.8169 5.0095 5.0124 5.2245 5.2554 5.2569 5.2625 6.2516 6.2559 6.3323 6.3341 6.3475 6.3576 7.4375 7.4376 7.4418 7.4420 7.9107 7.9117 8.3958 8.3984 8.4483 8.4514 9.5853 9.5877 10.3392 10.3489 k = 0.0263 0.0263-0.0000 ( 7621 PWs) bands (ev): -57.7700 -57.7700 -32.1729 -32.1729 -31.3455 -31.3455 -31.3455 -31.3455 -5.4363 -5.4363 -4.0212 -4.0211 -4.0196 -4.0196 -4.0170 -4.0168 1.4402 1.4427 1.4436 1.4462 1.8770 1.8770 3.0991 3.0991 3.2054 3.2064 3.2072 3.2098 3.4393 3.4394 3.5786 3.5848 3.5881 3.5922 3.8559 3.8624 3.8638 3.8688 3.9152 3.9154 3.9772 3.9793 3.9796 3.9876 4.2519 4.2569 4.2606 4.2655 4.2793 4.2793 4.6075 4.6105 4.6111 4.6266 4.7521 4.7540 4.8164 4.8168 5.0125 5.0133 5.2402 5.2569 5.2600 5.2617 6.2623 6.2636 6.3410 6.3416 6.3473 6.3540 7.4351 7.4352 7.4371 7.4371 7.9166 7.9169 8.4239 8.4244 8.4482 8.4502 9.5394 9.5401 10.3286 10.3350 k = 0.0132 0.0132-0.0000 ( 7625 PWs) bands (ev): -57.7700 -57.7700 -32.1729 -32.1729 -31.3455 -31.3455 -31.3455 -31.3455 -5.4391 -5.4391 -4.0191 -4.0191 -4.0173 -4.0173 -4.0167 -4.0167 1.4376 1.4386 1.4393 1.4404 1.8731 1.8731 3.1002 3.1002 3.2073 3.2076 3.2078 3.2089 3.4412 3.4412 3.5845 3.5872 3.5890 3.5912 3.8629 3.8654 3.8666 3.8687 3.9149 3.9149 3.9774 3.9780 3.9791 3.9819 4.2567 4.2592 4.2611 4.2635 4.2801 4.2801 4.6117 4.6130 4.6148 4.6201 4.7503 4.7505 4.8168 4.8169 5.0139 5.0140 5.2518 5.2577 5.2602 5.2617 6.2676 6.2678 6.3466 6.3474 6.3478 6.3511 7.4337 7.4337 7.4342 7.4342 7.9198 7.9199 8.4421 8.4423 8.4482 8.4492 9.5099 9.5100 10.3229 10.3260 k = 0.0000 0.0000 0.0000 ( 7689 PWs) bands (ev): -57.7700 -57.7700 -32.1729 -32.1729 -31.3455 -31.3455 -31.3455 -31.3455 -5.4400 -5.4400 -4.0185 -4.0185 -4.0165 -4.0165 -4.0165 -4.0165 1.4375 1.4375 1.4375 1.4375 1.8717 1.8717 3.1005 3.1005 3.2081 3.2081 3.2081 3.2081 3.4417 3.4417 3.5886 3.5886 3.5886 3.5886 3.8669 3.8669 3.8669 3.8669 3.9146 3.9146 3.9784 3.9784 3.9784 3.9784 4.2606 4.2606 4.2606 4.2606 4.2801 4.2801 4.6152 4.6152 4.6152 4.6152 4.7494 4.7494 4.8169 4.8169 5.0142 5.0142 5.2589 5.2589 5.2589 5.2589 6.2692 6.2692 6.3490 6.3490 6.3490 6.3490 7.4332 7.4332 7.4332 7.4332 7.9208 7.9208 8.4485 8.4485 8.4485 8.4485 9.4997 9.4997 10.3223 10.3223 k = 0.0000 0.0000 0.0000 ( 7689 PWs) bands (ev): -57.7700 -57.7700 -32.1729 -32.1729 -31.3455 -31.3455 -31.3455 -31.3455 -5.4400 -5.4400 -4.0185 -4.0185 -4.0165 -4.0165 -4.0165 -4.0165 1.4375 1.4375 1.4375 1.4375 1.8717 1.8717 3.1005 3.1005 3.2081 3.2081 3.2081 3.2081 3.4417 3.4417 3.5886 3.5886 3.5886 3.5886 3.8669 3.8669 3.8669 3.8669 3.9146 3.9146 3.9784 3.9784 3.9784 3.9784 4.2606 4.2606 4.2606 4.2606 4.2801 4.2801 4.6152 4.6152 4.6152 4.6152 4.7494 4.7494 4.8169 4.8169 5.0142 5.0142 5.2589 5.2589 5.2589 5.2589 6.2692 6.2692 6.3490 6.3490 6.3490 6.3490 7.4332 7.4332 7.4332 7.4332 7.9208 7.9208 8.4485 8.4485 8.4485 8.4485 9.4997 9.4997 10.3223 10.3223 k = 0.0106 0.0106 0.0106 ( 7623 PWs) bands (ev): -57.7700 -57.7700 -32.1729 -32.1729 -31.3455 -31.3455 -31.3455 -31.3455 -5.4391 -5.4391 -4.0190 -4.0190 -4.0171 -4.0170 -4.0170 -4.0170 1.4375 1.4389 1.4389 1.4404 1.8730 1.8730 3.1002 3.1002 3.2075 3.2076 3.2076 3.2089 3.4412 3.4412 3.5844 3.5881 3.5881 3.5913 3.8630 3.8660 3.8660 3.8686 3.9149 3.9149 3.9775 3.9785 3.9785 3.9820 4.2566 4.2601 4.2601 4.2636 4.2801 4.2801 4.6119 4.6137 4.6137 4.6203 4.7504 4.7504 4.8169 4.8169 5.0140 5.0140 5.2516 5.2592 5.2592 5.2617 6.2677 6.2677 6.3470 6.3470 6.3478 6.3513 7.4339 7.4339 7.4340 7.4340 7.9199 7.9199 8.4421 8.4421 8.4484 8.4494 9.5097 9.5097 10.3230 10.3256 k = 0.0213 0.0213 0.0213 ( 7611 PWs) bands (ev): -57.7700 -57.7700 -32.1729 -32.1729 -31.3455 -31.3455 -31.3455 -31.3455 -5.4364 -5.4364 -4.0205 -4.0205 -4.0187 -4.0186 -4.0184 -4.0184 1.4403 1.4430 1.4430 1.4460 1.8769 1.8769 3.0992 3.0992 3.2061 3.2061 3.2070 3.2098 3.4394 3.4394 3.5785 3.5866 3.5866 3.5922 3.8567 3.8632 3.8632 3.8683 3.9153 3.9153 3.9785 3.9785 3.9790 3.9878 4.2517 4.2588 4.2588 4.2657 4.2793 4.2793 4.6092 4.6092 4.6102 4.6271 4.7530 4.7530 4.8167 4.8167 5.0129 5.0129 5.2395 5.2599 5.2599 5.2599 6.2630 6.2630 6.3412 6.3412 6.3475 6.3544 7.4359 7.4359 7.4362 7.4363 7.9168 7.9168 8.4238 8.4238 8.4491 8.4511 9.5389 9.5389 10.3299 10.3354 k = 0.0319 0.0319 0.0319 ( 7632 PWs) bands (ev): -57.7700 -57.7700 -32.1729 -32.1729 -31.3455 -31.3455 -31.3455 -31.3455 -5.4318 -5.4318 -4.0230 -4.0230 -4.0213 -4.0212 -4.0207 -4.0207 1.4458 1.4498 1.4498 1.4543 1.8833 1.8833 3.0973 3.0973 3.2036 3.2036 3.2066 3.2107 3.4363 3.4363 3.5709 3.5840 3.5840 3.5912 3.8481 3.8585 3.8585 3.8663 3.9155 3.9155 3.9786 3.9786 3.9828 3.9954 4.2459 4.2564 4.2564 4.2668 4.2780 4.2780 4.6018 4.6018 4.6102 4.6355 4.7571 4.7571 4.8164 4.8164 5.0109 5.0109 5.2229 5.2541 5.2618 5.2618 6.2535 6.2535 6.3332 6.3332 6.3481 6.3583 7.4393 7.4393 7.4399 7.4401 7.9112 7.9112 8.3965 8.3965 8.4503 8.4532 9.5846 9.5846 10.3427 10.3511 k = 0.0426 0.0426 0.0426 ( 7626 PWs) bands (ev): -57.7700 -57.7700 -32.1729 -32.1729 -31.3455 -31.3455 -31.3455 -31.3455 -5.4255 -5.4255 -4.0265 -4.0265 -4.0250 -4.0248 -4.0239 -4.0239 1.4539 1.4592 1.4592 1.4654 1.8922 1.8922 3.0946 3.0946 3.2004 3.2004 3.2063 3.2117 3.4320 3.4320 3.5618 3.5804 3.5804 3.5884 3.8379 3.8524 3.8524 3.8632 3.9150 3.9150 3.9791 3.9791 3.9883 4.0045 4.2394 4.2532 4.2532 4.2672 4.2762 4.2762 4.5917 4.5917 4.6118 4.6453 4.7623 4.7623 4.8162 4.8162 5.0078 5.0078 5.2024 5.2450 5.2655 5.2655 6.2374 6.2374 6.3250 6.3250 6.3494 6.3625 7.4440 7.4440 7.4450 7.4455 7.9024 7.9024 8.3635 8.3635 8.4520 8.4557 9.6434 9.6434 10.3609 10.3720 k = 0.0532 0.0532 0.0532 ( 7631 PWs) bands (ev): -57.7700 -57.7700 -32.1729 -32.1729 -31.3455 -31.3455 -31.3455 -31.3455 -5.4174 -5.4174 -4.0310 -4.0310 -4.0296 -4.0293 -4.0278 -4.0278 1.4645 1.4711 1.4711 1.4791 1.9035 1.9035 3.0906 3.0906 3.1966 3.1966 3.2062 3.2127 3.4264 3.4264 3.5511 3.5757 3.5757 3.5836 3.8265 3.8449 3.8449 3.8594 3.9134 3.9134 3.9804 3.9804 3.9953 4.0146 4.2323 4.2489 4.2489 4.2667 4.2741 4.2741 4.5792 4.5792 4.6148 4.6563 4.7681 4.7681 4.8164 4.8164 5.0037 5.0037 5.1787 5.2334 5.2719 5.2719 6.2135 6.2135 6.3180 6.3180 6.3511 6.3669 7.4500 7.4500 7.4515 7.4525 7.8899 7.8899 8.3285 8.3285 8.4538 8.4582 9.7116 9.7116 10.3837 10.3971 k = 0.0638 0.0638 0.0638 ( 7625 PWs) bands (ev): -57.7700 -57.7700 -32.1729 -32.1729 -31.3455 -31.3455 -31.3455 -31.3455 -5.4075 -5.4075 -4.0365 -4.0365 -4.0352 -4.0349 -4.0326 -4.0326 1.4775 1.4854 1.4854 1.4954 1.9171 1.9171 3.0851 3.0851 3.1926 3.1926 3.2063 3.2137 3.4196 3.4196 3.5389 3.5700 3.5700 3.5765 3.8143 3.8361 3.8361 3.8550 3.9102 3.9102 3.9826 3.9826 4.0032 4.0254 4.2248 4.2437 4.2437 4.2656 4.2716 4.2716 4.5645 4.5645 4.6191 4.6685 4.7737 4.7737 4.8175 4.8175 4.9987 4.9987 5.1526 5.2201 5.2816 5.2816 6.1818 6.1818 6.3123 6.3123 6.3528 6.3710 7.4574 7.4574 7.4594 7.4609 7.8729 7.8729 8.2945 8.2945 8.4555 8.4605 9.7859 9.7859 10.4100 10.4249 k = 0.0745 0.0745 0.0745 ( 7625 PWs) bands (ev): -57.7700 -57.7700 -32.1729 -32.1729 -31.3455 -31.3455 -31.3455 -31.3455 -5.3958 -5.3958 -4.0429 -4.0429 -4.0417 -4.0413 -4.0381 -4.0381 1.4928 1.5020 1.5020 1.5140 1.9329 1.9329 3.0777 3.0777 3.1886 3.1886 3.2065 3.2146 3.4115 3.4115 3.5253 3.5633 3.5633 3.5671 3.8017 3.8263 3.8263 3.8504 3.9050 3.9050 3.9858 3.9858 4.0117 4.0369 4.2170 4.2374 4.2374 4.2638 4.2688 4.2688 4.5482 4.5482 4.6247 4.6816 4.7779 4.7779 4.8203 4.8203 4.9935 4.9935 5.1250 5.2061 5.2950 5.2950 6.1430 6.1430 6.3075 6.3075 6.3544 6.3747 7.4660 7.4660 7.4686 7.4709 7.8512 7.8512 8.2638 8.2638 8.4568 8.4621 9.8630 9.8630 10.4386 10.4542 k = 0.0851 0.0851 0.0851 ( 7607 PWs) bands (ev): -57.7700 -57.7700 -32.1729 -32.1729 -31.3455 -31.3455 -31.3455 -31.3455 -5.3824 -5.3824 -4.0502 -4.0502 -4.0490 -4.0486 -4.0443 -4.0443 1.5101 1.5205 1.5205 1.5348 1.9506 1.9506 3.0681 3.0681 3.1849 3.1849 3.2068 3.2152 3.4021 3.4021 3.5103 3.5552 3.5557 3.5557 3.7891 3.8154 3.8154 3.8455 3.8977 3.8977 3.9900 3.9900 4.0204 4.0489 4.2093 4.2302 4.2302 4.2614 4.2658 4.2658 4.5306 4.5306 4.6314 4.6953 4.7797 4.7797 4.8256 4.8256 4.9889 4.9889 5.0970 5.1921 5.3123 5.3123 6.0980 6.0980 6.3030 6.3030 6.3555 6.3776 7.4759 7.4759 7.4791 7.4823 7.8251 7.8251 8.2376 8.2376 8.4574 8.4630 9.9399 9.9399 10.4683 10.4838 k = 0.0957 0.0957 0.0957 ( 7604 PWs) bands (ev): -57.7700 -57.7700 -32.1729 -32.1729 -31.3455 -31.3455 -31.3455 -31.3455 -5.3673 -5.3673 -4.0583 -4.0583 -4.0572 -4.0567 -4.0512 -4.0512 1.5292 1.5409 1.5409 1.5576 1.9702 1.9702 3.0560 3.0560 3.1818 3.1818 3.2072 3.2156 3.3915 3.3915 3.4941 3.5407 3.5471 3.5471 3.7769 3.8034 3.8034 3.8405 3.8883 3.8883 3.9950 3.9950 4.0289 4.0611 4.2020 4.2220 4.2220 4.2584 4.2625 4.2625 4.5123 4.5123 4.6391 4.7094 4.7789 4.7789 4.8333 4.8333 4.9855 4.9855 5.0695 5.1790 5.3334 5.3334 6.0477 6.0477 6.2981 6.2981 6.3560 6.3796 7.4870 7.4870 7.4909 7.4952 7.7957 7.7957 8.2161 8.2161 8.4571 8.4628 10.0134 10.0134 10.4979 10.5128 k = 0.1064 0.1064 0.1064 ( 7607 PWs) bands (ev): -57.7700 -57.7700 -32.1729 -32.1729 -31.3455 -31.3455 -31.3455 -31.3455 -5.3506 -5.3506 -4.0672 -4.0672 -4.0661 -4.0656 -4.0588 -4.0588 1.5498 1.5629 1.5629 1.5822 1.9913 1.9913 3.0413 3.0413 3.1794 3.1794 3.2077 3.2156 3.3795 3.3795 3.4766 3.5237 3.5376 3.5376 3.7653 3.7903 3.7903 3.8353 3.8770 3.8770 4.0006 4.0006 4.0369 4.0735 4.1955 4.2129 4.2129 4.2550 4.2589 4.2589 4.4938 4.4938 4.6479 4.7237 4.7761 4.7761 4.8430 4.8430 4.9841 4.9841 5.0437 5.1672 5.3582 5.3582 5.9927 5.9927 6.2928 6.2928 6.3556 6.3805 7.4992 7.4992 7.5039 7.5096 7.7642 7.7642 8.1989 8.1989 8.4558 8.4615 10.0809 10.0809 10.5269 10.5410 k = 0.1170 0.1170 0.1170 ( 7604 PWs) bands (ev): -57.7700 -57.7700 -32.1729 -32.1729 -31.3455 -31.3455 -31.3455 -31.3455 -5.3323 -5.3323 -4.0767 -4.0767 -4.0757 -4.0752 -4.0669 -4.0669 1.5717 1.5862 1.5862 1.6083 2.0138 2.0138 3.0238 3.0238 3.1777 3.1777 3.2083 3.2150 3.3664 3.3664 3.4582 3.5044 3.5273 3.5273 3.7545 3.7760 3.7760 3.8299 3.8640 3.8640 4.0065 4.0065 4.0438 4.0859 4.1901 4.2030 4.2030 4.2511 4.2551 4.2551 4.4757 4.4757 4.6577 4.7379 4.7725 4.7725 4.8538 4.8538 4.9850 4.9850 5.0205 5.1574 5.3862 5.3862 5.9338 5.9338 6.2868 6.2868 6.3542 6.3803 7.5127 7.5127 7.5180 7.5254 7.7323 7.7323 8.1853 8.1853 8.4536 8.4590 10.1402 10.1402 10.5549 10.5682 k = 0.1277 0.1277 0.1277 ( 7607 PWs) bands (ev): -57.7700 -57.7700 -32.1729 -32.1729 -31.3455 -31.3455 -31.3455 -31.3455 -5.3123 -5.3123 -4.0869 -4.0869 -4.0860 -4.0854 -4.0756 -4.0756 1.5945 1.6104 1.6104 1.6356 2.0373 2.0373 3.0037 3.0037 3.1765 3.1765 3.2088 3.2134 3.3522 3.3522 3.4391 3.4833 3.5162 3.5162 3.7446 3.7602 3.7602 3.8243 3.8500 3.8500 4.0125 4.0125 4.0494 4.0981 4.1863 4.1923 4.1923 4.2467 4.2513 4.2513 4.4583 4.4583 4.6686 4.7517 4.7689 4.7689 4.8653 4.8653 4.9885 4.9885 5.0007 5.1500 5.4174 5.4174 5.8714 5.8714 6.2800 6.2800 6.3519 6.3789 7.5271 7.5271 7.5333 7.5425 7.7015 7.7015 8.1743 8.1743 8.4502 8.4554 10.1898 10.1898 10.5821 10.5948 k = 0.1383 0.1383 0.1383 ( 7619 PWs) bands (ev): -57.7700 -57.7700 -32.1729 -32.1729 -31.3455 -31.3455 -31.3455 -31.3455 -5.2909 -5.2909 -4.0977 -4.0977 -4.0968 -4.0962 -4.0848 -4.0848 1.6179 1.6353 1.6353 1.6638 2.0615 2.0615 2.9808 2.9808 3.1757 3.1757 3.2093 3.2106 3.3371 3.3371 3.4195 3.4610 3.5044 3.5044 3.7354 3.7427 3.7427 3.8184 3.8352 3.8352 4.0184 4.0184 4.0533 4.1101 4.1809 4.1809 4.1845 4.2421 4.2475 4.2475 4.4421 4.4421 4.6807 4.7650 4.7664 4.7664 4.8770 4.8770 4.9852 4.9942 4.9942 5.1450 5.4513 5.4513 5.8065 5.8065 6.2723 6.2723 6.3484 6.3763 7.5424 7.5424 7.5497 7.5610 7.6731 7.6731 8.1654 8.1654 8.4460 8.4506 10.2292 10.2292 10.6087 10.6211 k = 0.1489 0.1489 0.1489 ( 7616 PWs) bands (ev): -57.7700 -57.7700 -32.1729 -32.1729 -31.3455 -31.3455 -31.3455 -31.3455 -5.2679 -5.2679 -4.1089 -4.1089 -4.1081 -4.1074 -4.0944 -4.0944 1.6416 1.6604 1.6604 1.6925 2.0860 2.0860 2.9554 2.9554 3.1752 3.1752 3.2063 3.2097 3.3215 3.3215 3.3998 3.4386 3.4920 3.4920 3.7232 3.7232 3.7271 3.8123 3.8206 3.8206 4.0242 4.0242 4.0555 4.1217 4.1690 4.1690 4.1846 4.2373 4.2440 4.2440 4.4272 4.4272 4.6941 4.7656 4.7656 4.7777 4.8886 4.8886 4.9746 5.0020 5.0020 5.1427 5.4878 5.4878 5.7395 5.7395 6.2639 6.2639 6.3441 6.3727 7.5581 7.5581 7.5672 7.5809 7.6483 7.6483 8.1580 8.1580 8.4409 8.4450 10.2590 10.2590 10.6351 10.6473 k = 0.1596 0.1596 0.1596 ( 7607 PWs) bands (ev): -57.7700 -57.7700 -32.1730 -32.1730 -31.3456 -31.3456 -31.3456 -31.3456 -5.2436 -5.2436 -4.1206 -4.1206 -4.1198 -4.1191 -4.1043 -4.1043 1.6652 1.6854 1.6854 1.7213 2.1104 2.1104 2.9276 2.9276 3.1747 3.1747 3.1997 3.2098 3.3057 3.3057 3.3804 3.4169 3.4792 3.4792 3.7017 3.7017 3.7194 3.8060 3.8064 3.8064 4.0295 4.0295 4.0560 4.1325 4.1569 4.1569 4.1865 4.2325 4.2408 4.2408 4.4138 4.4138 4.7090 4.7672 4.7672 4.7900 4.9000 4.9000 4.9690 5.0116 5.0116 5.1430 5.5266 5.5266 5.6714 5.6714 6.2548 6.2548 6.3387 6.3680 7.5727 7.5727 7.5856 7.6020 7.6292 7.6292 8.1519 8.1519 8.4351 8.4385 10.2803 10.2803 10.6614 10.6738 k = 0.1702 0.1702 0.1702 ( 7607 PWs) bands (ev): -57.7700 -57.7700 -32.1730 -32.1730 -31.3456 -31.3456 -31.3456 -31.3456 -5.2179 -5.2179 -4.1327 -4.1327 -4.1319 -4.1312 -4.1146 -4.1146 1.6881 1.7098 1.7098 1.7497 2.1342 2.1342 2.8976 2.8976 3.1737 3.1737 3.1905 3.2093 3.2904 3.2904 3.3619 3.3972 3.4660 3.4660 3.6783 3.6783 3.7123 3.7932 3.7932 3.7992 4.0344 4.0344 4.0552 4.1425 4.1447 4.1447 4.1900 4.2279 4.2378 4.2378 4.4017 4.4017 4.7255 4.7715 4.7715 4.8022 4.9109 4.9109 4.9682 5.0227 5.0227 5.1458 5.5671 5.5671 5.6035 5.6035 6.2450 6.2450 6.3325 6.3624 7.5811 7.5811 7.6051 7.6213 7.6213 7.6243 8.1467 8.1467 8.4288 8.4315 10.2942 10.2942 10.6880 10.7009 k = 0.1809 0.1809 0.1809 ( 7607 PWs) bands (ev): -57.7700 -57.7700 -32.1730 -32.1730 -31.3456 -31.3456 -31.3456 -31.3456 -5.1909 -5.1909 -4.1450 -4.1450 -4.1442 -4.1435 -4.1251 -4.1251 1.7101 1.7332 1.7332 1.7774 2.1569 2.1569 2.8655 2.8655 3.1720 3.1720 3.1785 3.2083 3.2763 3.2763 3.3447 3.3804 3.4526 3.4526 3.6534 3.6534 3.7056 3.7810 3.7810 3.7922 4.0387 4.0387 4.0536 4.1327 4.1327 4.1514 4.1945 4.2239 4.2352 4.2352 4.3909 4.3909 4.7436 4.7788 4.7788 4.8149 4.9209 4.9209 4.9718 5.0349 5.0349 5.1511 5.5349 5.5349 5.6110 5.6110 6.2348 6.2348 6.3256 6.3561 7.5779 7.5779 7.6254 7.6301 7.6301 7.6477 8.1424 8.1424 8.4221 8.4241 10.3022 10.3022 10.7150 10.7287 k = 0.1915 0.1915 0.1915 ( 7625 PWs) bands (ev): -57.7700 -57.7700 -32.1730 -32.1730 -31.3456 -31.3456 -31.3456 -31.3456 -5.1628 -5.1628 -4.1576 -4.1576 -4.1568 -4.1561 -4.1359 -4.1359 1.7307 1.7550 1.7550 1.8036 2.1778 2.1778 2.8315 2.8315 3.1637 3.1691 3.1691 3.2062 3.2641 3.2641 3.3296 3.3670 3.4390 3.4390 3.6277 3.6277 3.6993 3.7697 3.7697 3.7847 4.0423 4.0423 4.0516 4.1212 4.1212 4.1589 4.1996 4.2205 4.2330 4.2330 4.3813 4.3813 4.7632 4.7887 4.7887 4.8289 4.9298 4.9298 4.9790 5.0481 5.0481 5.1587 5.4693 5.4693 5.6554 5.6554 6.2242 6.2242 6.3181 6.3491 7.5713 7.5713 7.6464 7.6474 7.6474 7.6721 8.1389 8.1389 8.4154 8.4165 10.3052 10.3052 10.7424 10.7572 k = 0.2021 0.2021 0.2021 ( 7619 PWs) bands (ev): -57.7700 -57.7700 -32.1730 -32.1730 -31.3456 -31.3456 -31.3456 -31.3456 -5.1335 -5.1335 -4.1703 -4.1703 -4.1696 -4.1689 -4.1467 -4.1467 1.7494 1.7749 1.7749 1.8279 2.1963 2.1963 2.7959 2.7959 3.1469 3.1647 3.1647 3.2031 3.2547 3.2547 3.3171 3.3570 3.4254 3.4254 3.6021 3.6021 3.6932 3.7594 3.7594 3.7769 4.0452 4.0452 4.0496 4.1105 4.1105 4.1649 4.2050 4.2184 4.2310 4.2310 4.3728 4.3728 4.7845 4.8010 4.8010 4.8448 4.9372 4.9372 4.9891 5.0619 5.0619 5.1685 5.4068 5.4068 5.7015 5.7015 6.2136 6.2136 6.3104 6.3418 7.5669 7.5669 7.6675 7.6675 7.6683 7.6976 8.1364 8.1364 8.4087 8.4089 10.3043 10.3043 10.7703 10.7864 k = 0.2128 0.2128 0.2128 ( 7607 PWs) bands (ev): -57.7700 -57.7700 -32.1730 -32.1730 -31.3456 -31.3456 -31.3456 -31.3456 -5.1032 -5.1032 -4.1831 -4.1831 -4.1824 -4.1817 -4.1577 -4.1577 1.7660 1.7924 1.7924 1.8498 2.2116 2.2116 2.7590 2.7590 3.1292 3.1590 3.1590 3.1989 3.2485 3.2485 3.3076 3.3501 3.4120 3.4120 3.5771 3.5771 3.6874 3.7498 3.7498 3.7687 4.0473 4.0473 4.0479 4.1008 4.1008 4.1693 4.2105 4.2177 4.2294 4.2294 4.3652 4.3652 4.8072 4.8147 4.8147 4.8630 4.9429 4.9429 5.0013 5.0762 5.0762 5.1804 5.3492 5.3492 5.7488 5.7488 6.2032 6.2032 6.3025 6.3344 7.5659 7.5659 7.6889 7.6889 7.6907 7.7238 8.1350 8.1350 8.4016 8.4023 10.3002 10.3002 10.7985 10.8163 k = 0.2234 0.2234 0.2234 ( 7607 PWs) bands (ev): -57.7700 -57.7700 -32.1730 -32.1730 -31.3456 -31.3456 -31.3456 -31.3456 -5.0719 -5.0719 -4.1959 -4.1959 -4.1953 -4.1946 -4.1687 -4.1687 1.7799 1.8070 1.8070 1.8687 2.2231 2.2231 2.7209 2.7209 3.1118 3.1525 3.1525 3.1939 3.2451 3.2451 3.3010 3.3457 3.3992 3.3992 3.5534 3.5534 3.6817 3.7408 3.7408 3.7603 4.0466 4.0485 4.0485 4.0925 4.0925 4.1722 4.2157 4.2182 4.2279 4.2279 4.3584 4.3584 4.8279 4.8279 4.8312 4.8836 4.9468 4.9468 5.0151 5.0907 5.0907 5.1942 5.2987 5.2987 5.7973 5.7973 6.1931 6.1931 6.2947 6.3272 7.5688 7.5688 7.7109 7.7109 7.7136 7.7507 8.1347 8.1347 8.3947 8.3963 10.2935 10.2935 10.8267 10.8465 k = 0.2340 0.2340 0.2340 ( 7619 PWs) bands (ev): -57.7700 -57.7700 -32.1730 -32.1730 -31.3456 -31.3456 -31.3456 -31.3456 -5.0398 -5.0398 -4.2088 -4.2088 -4.2081 -4.2074 -4.1797 -4.1797 1.7910 1.8186 1.8186 1.8841 2.2299 2.2299 2.6821 2.6821 3.0959 3.1463 3.1463 3.1887 3.2441 3.2441 3.2973 3.3431 3.3871 3.3871 3.5315 3.5315 3.6761 3.7323 3.7323 3.7515 4.0460 4.0484 4.0484 4.0857 4.0857 4.1740 4.2198 4.2207 4.2266 4.2266 4.3522 4.3522 4.8372 4.8372 4.8560 4.9066 4.9505 4.9505 5.0302 5.1053 5.1053 5.2098 5.2575 5.2575 5.8465 5.8465 6.1840 6.1840 6.2874 6.3204 7.5755 7.5755 7.7333 7.7333 7.7368 7.7782 8.1358 8.1358 8.3885 8.3910 10.2847 10.2847 10.8547 10.8767 k = 0.2447 0.2447 0.2447 ( 7625 PWs) bands (ev): -57.7700 -57.7700 -32.1730 -32.1730 -31.3456 -31.3456 -31.3456 -31.3456 -5.0071 -5.0071 -4.2215 -4.2215 -4.2209 -4.2202 -4.1906 -4.1906 1.7991 1.8267 1.8267 1.8957 2.2314 2.2314 2.6429 2.6429 3.0824 3.1412 3.1412 3.1839 3.2450 3.2450 3.2958 3.3419 3.3764 3.3764 3.5116 3.5116 3.6707 3.7242 3.7242 3.7425 4.0460 4.0471 4.0471 4.0808 4.0808 4.1753 4.2221 4.2254 4.2254 4.2254 4.3468 4.3468 4.8374 4.8374 4.8816 4.9316 4.9573 4.9573 5.0463 5.1196 5.1196 5.2271 5.2276 5.2276 5.8963 5.8963 6.1762 6.1762 6.2809 6.3144 7.5860 7.5860 7.7556 7.7556 7.7603 7.8059 8.1385 8.1385 8.3832 8.3865 10.2743 10.2743 10.8819 10.9065 k = 0.2553 0.2553 0.2553 ( 7625 PWs) bands (ev): -57.7700 -57.7700 -32.1730 -32.1730 -31.3456 -31.3456 -31.3456 -31.3456 -4.9737 -4.9737 -4.2341 -4.2341 -4.2335 -4.2328 -4.2014 -4.2014 1.8039 1.8312 1.8312 1.9030 2.2271 2.2271 2.6036 2.6036 3.0721 3.1378 3.1378 3.1802 3.2473 3.2473 3.2961 3.3417 3.3674 3.3674 3.4941 3.4941 3.6654 3.7165 3.7165 3.7334 4.0445 4.0445 4.0469 4.0779 4.0779 4.1765 4.2243 4.2243 4.2246 4.2297 4.3418 4.3418 4.8246 4.8246 4.9073 4.9583 4.9705 4.9705 5.0635 5.1333 5.1333 5.2099 5.2099 5.2460 5.9459 5.9459 6.1705 6.1705 6.2756 6.3098 7.6002 7.6002 7.7777 7.7777 7.7838 7.8337 8.1429 8.1429 8.3790 8.3829 10.2627 10.2627 10.9077 10.9352 k = 0.2660 0.2660 0.2660 ( 7625 PWs) bands (ev): -57.7700 -57.7700 -32.1730 -32.1730 -31.3456 -31.3456 -31.3456 -31.3456 -4.9398 -4.9398 -4.2465 -4.2465 -4.2459 -4.2452 -4.2120 -4.2120 1.8056 1.8321 1.8321 1.9060 2.2166 2.2166 2.5643 2.5643 3.0655 3.1366 3.1366 3.1780 3.2507 3.2507 3.2977 3.3422 3.3606 3.3606 3.4788 3.4788 3.6602 3.7090 3.7090 3.7242 4.0411 4.0411 4.0486 4.0763 4.0763 4.1779 4.2233 4.2233 4.2271 4.2337 4.3372 4.3372 4.8004 4.8004 4.9329 4.9858 4.9896 4.9896 5.0819 5.1457 5.1457 5.2037 5.2037 5.2663 5.9946 5.9946 6.1680 6.1680 6.2720 6.3068 7.6178 7.6178 7.7992 7.7992 7.8071 7.8613 8.1493 8.1493 8.3761 8.3804 10.2501 10.2501 10.9310 10.9620 k = 0.2766 0.2766 0.2766 ( 7613 PWs) bands (ev): -57.7700 -57.7700 -32.1730 -32.1730 -31.3456 -31.3456 -31.3456 -31.3456 -4.9057 -4.9057 -4.2586 -4.2586 -4.2580 -4.2574 -4.2225 -4.2225 1.8041 1.8296 1.8296 1.9046 2.2001 2.2001 2.5253 2.5253 3.0628 3.1378 3.1378 3.1777 3.2550 3.2550 3.3005 3.3432 3.3560 3.3560 3.4661 3.4661 3.6552 3.7018 3.7018 3.7151 4.0374 4.0374 4.0512 4.0758 4.0758 4.1798 4.2223 4.2223 4.2295 4.2374 4.3329 4.3329 4.7687 4.7687 4.9580 5.0120 5.0120 5.0132 5.1017 5.1567 5.1567 5.2072 5.2072 5.2877 6.0404 6.0404 6.1709 6.1709 6.2704 6.3061 7.6387 7.6387 7.8199 7.8199 7.8301 7.8885 8.1578 8.1578 8.3748 8.3792 10.2369 10.2369 10.9508 10.9857 k = 0.2872 0.2872 0.2872 ( 7625 PWs) bands (ev): -57.7700 -57.7700 -32.1730 -32.1730 -31.3456 -31.3456 -31.3456 -31.3456 -4.8713 -4.8713 -4.2705 -4.2705 -4.2699 -4.2692 -4.2327 -4.2327 1.7997 1.8237 1.8237 1.8992 2.1777 2.1777 2.4865 2.4865 3.0638 3.1414 3.1414 3.1790 3.2600 3.2600 3.3040 3.3445 3.3535 3.3535 3.4558 3.4558 3.6503 3.6947 3.6947 3.7059 4.0336 4.0336 4.0545 4.0758 4.0758 4.1821 4.2213 4.2213 4.2316 4.2408 4.3289 4.3289 4.7335 4.7335 4.9823 5.0355 5.0355 5.0396 5.1233 5.1666 5.1666 5.2178 5.2178 5.3098 6.0796 6.0796 6.1833 6.1833 6.2714 6.3081 7.6628 7.6628 7.8397 7.8397 7.8526 7.9148 8.1685 8.1685 8.3752 8.3793 10.2233 10.2233 10.9656 11.0050 k = 0.2979 0.2979 0.2979 ( 7634 PWs) bands (ev): -57.7700 -57.7700 -32.1730 -32.1730 -31.3456 -31.3456 -31.3456 -31.3456 -4.8369 -4.8369 -4.2820 -4.2820 -4.2814 -4.2808 -4.2427 -4.2427 1.7927 1.8149 1.8149 1.8900 2.1502 2.1502 2.4480 2.4480 3.0685 3.1471 3.1471 3.1822 3.2657 3.2657 3.3081 3.3460 3.3527 3.3527 3.4483 3.4483 3.6456 3.6879 3.6879 3.6969 4.0300 4.0300 4.0587 4.0762 4.0762 4.1851 4.2203 4.2203 4.2335 4.2438 4.3250 4.3250 4.6974 4.6974 5.0054 5.0585 5.0585 5.0639 5.1468 5.1765 5.1765 5.2329 5.2329 5.3322 6.1079 6.1079 6.2100 6.2100 6.2756 6.3136 7.6896 7.6896 7.8584 7.8584 7.8744 7.9401 8.1815 8.1815 8.3776 8.3807 10.2094 10.2094 10.9737 11.0181 k = 0.3085 0.3085 0.3085 ( 7637 PWs) bands (ev): -57.7700 -57.7700 -32.1730 -32.1730 -31.3456 -31.3456 -31.3456 -31.3456 -4.8026 -4.8026 -4.2931 -4.2931 -4.2926 -4.2920 -4.2523 -4.2523 1.7833 1.8035 1.8035 1.8775 2.1182 2.1182 2.4097 2.4097 3.0764 3.1547 3.1547 3.1869 3.2719 3.2719 3.3127 3.3475 3.3528 3.3528 3.4441 3.4441 3.6410 3.6813 3.6813 3.6880 4.0268 4.0268 4.0636 4.0768 4.0768 4.1885 4.2193 4.2193 4.2351 4.2467 4.3212 4.3212 4.6620 4.6620 5.0273 5.0802 5.0802 5.0860 5.1718 5.1868 5.1868 5.2507 5.2507 5.3542 6.1269 6.1269 6.2494 6.2494 6.2836 6.3231 7.7190 7.7190 7.8762 7.8762 7.8954 7.9639 8.1966 8.1966 8.3822 8.3836 10.1955 10.1955 10.9730 11.0229 k = 0.3191 0.3191 0.3191 ( 7634 PWs) bands (ev): -57.7700 -57.7700 -32.1730 -32.1730 -31.3456 -31.3456 -31.3456 -31.3456 -4.7686 -4.7686 -4.3039 -4.3039 -4.3033 -4.3027 -4.2616 -4.2616 1.7720 1.7898 1.7898 1.8622 2.0828 2.0828 2.3719 2.3719 3.0871 3.1641 3.1641 3.1930 3.2783 3.2783 3.3177 3.3490 3.3530 3.3530 3.4436 3.4436 3.6367 3.6748 3.6748 3.6794 4.0238 4.0238 4.0693 4.0775 4.0775 4.1924 4.2183 4.2183 4.2364 4.2493 4.3173 4.3173 4.6285 4.6285 5.0479 5.0999 5.0999 5.1058 5.1974 5.1974 5.1976 5.2699 5.2699 5.3752 6.1432 6.1432 6.2954 6.2954 6.2958 6.3371 7.7505 7.7505 7.8933 7.8933 7.9155 7.9861 8.2136 8.2136 8.3877 8.3888 10.1817 10.1817 10.9614 11.0172 k = 0.3298 0.3298 0.3298 ( 7643 PWs) bands (ev): -57.7700 -57.7700 -32.1730 -32.1730 -31.3456 -31.3456 -31.3456 -31.3456 -4.7350 -4.7350 -4.3142 -4.3142 -4.3136 -4.3130 -4.2706 -4.2706 1.7591 1.7745 1.7745 1.8447 2.0447 2.0447 2.3344 2.3344 3.1001 3.1747 3.1747 3.2001 3.2848 3.2848 3.3229 3.3504 3.3525 3.3525 3.4471 3.4471 3.6325 3.6686 3.6686 3.6711 4.0212 4.0212 4.0756 4.0781 4.0781 4.1966 4.2173 4.2173 4.2374 4.2517 4.3133 4.3133 4.5976 4.5976 5.0672 5.1176 5.1176 5.1237 5.2081 5.2081 5.2229 5.2893 5.2893 5.3945 6.1610 6.1610 6.3128 6.3441 6.3441 6.3562 7.7836 7.7836 7.9101 7.9101 7.9346 8.0064 8.2322 8.2322 8.3931 8.3977 10.1681 10.1681 10.9373 10.9988 k = 0.3404 0.3404 0.3404 ( 7643 PWs) bands (ev): -57.7700 -57.7700 -32.1730 -32.1730 -31.3456 -31.3456 -31.3456 -31.3456 -4.7021 -4.7021 -4.3240 -4.3240 -4.3234 -4.3229 -4.2792 -4.2792 1.7450 1.7578 1.7578 1.8257 2.0049 2.0049 2.2976 2.2976 3.1148 3.1864 3.1864 3.2080 3.2912 3.2912 3.3282 3.3509 3.3509 3.3516 3.4544 3.4544 3.6287 3.6626 3.6626 3.6631 4.0188 4.0188 4.0788 4.0788 4.0825 4.2012 4.2162 4.2162 4.2382 4.2539 4.3092 4.3092 4.5697 4.5697 5.0851 5.1335 5.1335 5.1403 5.2186 5.2186 5.2467 5.3079 5.3079 5.4114 6.1821 6.1821 6.3350 6.3805 6.3936 6.3936 7.8174 7.8174 7.9276 7.9276 7.9527 8.0247 8.2520 8.2520 8.3995 8.4085 10.1549 10.1549 10.8995 10.9664 k = 0.3511 0.3511 0.3511 ( 7634 PWs) bands (ev): -57.7700 -57.7700 -32.1730 -32.1730 -31.3456 -31.3456 -31.3456 -31.3456 -4.6700 -4.6700 -4.3333 -4.3333 -4.3327 -4.3322 -4.2874 -4.2874 1.7302 1.7403 1.7403 1.8055 1.9640 1.9640 2.2617 2.2617 3.1308 3.1987 3.1987 3.2164 3.2975 3.2975 3.3335 3.3484 3.3484 3.3527 3.4647 3.4647 3.6251 3.6555 3.6569 3.6569 4.0166 4.0166 4.0795 4.0795 4.0899 4.2059 4.2151 4.2151 4.2388 4.2561 4.3049 4.3049 4.5449 4.5449 5.1019 5.1478 5.1478 5.1558 5.2287 5.2287 5.2682 5.3249 5.3249 5.4255 6.2073 6.2073 6.3624 6.4103 6.4431 6.4431 7.8507 7.8507 7.9470 7.9470 7.9699 8.0412 8.2724 8.2724 8.4066 8.4209 10.1422 10.1422 10.8482 10.9195 k = 0.3617 0.3617 0.3617 ( 7640 PWs) bands (ev): -57.7700 -57.7700 -32.1730 -32.1730 -31.3456 -31.3456 -31.3456 -31.3456 -4.6388 -4.6388 -4.3420 -4.3420 -4.3415 -4.3410 -4.2952 -4.2952 1.7150 1.7224 1.7224 1.7847 1.9229 1.9229 2.2270 2.2270 3.1475 3.2113 3.2113 3.2252 3.3036 3.3036 3.3387 3.3453 3.3453 3.3534 3.4773 3.4773 3.6217 3.6483 3.6514 3.6514 4.0145 4.0145 4.0800 4.0800 4.0978 4.2107 4.2139 4.2139 4.2392 4.2580 4.3004 4.3004 4.5233 4.5233 5.1176 5.1609 5.1609 5.1705 5.2383 5.2383 5.2868 5.3397 5.3397 5.4364 6.2368 6.2368 6.3950 6.4452 6.4918 6.4918 7.8817 7.8817 7.9698 7.9698 7.9864 8.0559 8.2928 8.2928 8.4142 8.4344 10.1300 10.1300 10.7845 10.8591 k = 0.3723 0.3723 0.3723 ( 7643 PWs) bands (ev): -57.7700 -57.7700 -32.1730 -32.1730 -31.3456 -31.3456 -31.3456 -31.3456 -4.6089 -4.6089 -4.3502 -4.3502 -4.3497 -4.3492 -4.3026 -4.3026 1.6998 1.7044 1.7044 1.7639 1.8822 1.8822 2.1939 2.1939 3.1647 3.2240 3.2240 3.2340 3.3093 3.3093 3.3419 3.3419 3.3436 3.3539 3.4912 3.4912 3.6186 3.6416 3.6462 3.6462 4.0125 4.0125 4.0805 4.0805 4.1060 4.2126 4.2126 4.2154 4.2394 4.2597 4.2957 4.2957 4.5050 4.5050 5.1323 5.1728 5.1728 5.1845 5.2473 5.2473 5.3022 5.3519 5.3519 5.4440 6.2703 6.2703 6.4326 6.4848 6.5395 6.5395 7.9090 7.9090 7.9975 7.9975 8.0022 8.0692 8.3129 8.3129 8.4218 8.4484 10.1184 10.1184 10.7107 10.7874 k = 0.3830 0.3830 0.3830 ( 7646 PWs) bands (ev): -57.7700 -57.7700 -32.1730 -32.1730 -31.3457 -31.3457 -31.3457 -31.3457 -4.5803 -4.5803 -4.3578 -4.3578 -4.3573 -4.3569 -4.3096 -4.3096 1.6848 1.6866 1.6866 1.7433 1.8425 1.8425 2.1625 2.1625 3.1820 3.2364 3.2364 3.2428 3.3145 3.3145 3.3386 3.3386 3.3481 3.3540 3.5059 3.5059 3.6158 3.6353 3.6413 3.6413 4.0105 4.0105 4.0809 4.0809 4.1145 4.2112 4.2112 4.2197 4.2398 4.2613 4.2910 4.2910 4.4896 4.4896 5.1462 5.1839 5.1839 5.1980 5.2554 5.2554 5.3143 5.3613 5.3613 5.4484 6.3069 6.3069 6.4745 6.5282 6.5858 6.5858 7.9324 7.9324 8.0178 8.0299 8.0299 8.0813 8.3321 8.3321 8.4291 8.4622 10.1074 10.1074 10.6298 10.7075 k = 0.3936 0.3936 0.3936 ( 7640 PWs) bands (ev): -57.7700 -57.7700 -32.1730 -32.1730 -31.3457 -31.3457 -31.3457 -31.3457 -4.5531 -4.5531 -4.3649 -4.3649 -4.3643 -4.3639 -4.3162 -4.3162 1.6694 1.6694 1.6705 1.7233 1.8043 1.8043 2.1331 2.1331 3.1991 3.2484 3.2484 3.2514 3.3190 3.3190 3.3358 3.3358 3.3521 3.3538 3.5206 3.5206 3.6133 3.6297 3.6368 3.6368 4.0086 4.0086 4.0812 4.0812 4.1232 4.2099 4.2099 4.2232 4.2405 4.2628 4.2865 4.2865 4.4771 4.4771 5.1593 5.1943 5.1943 5.2109 5.2628 5.2628 5.3234 5.3682 5.3682 5.4498 6.3459 6.3459 6.5200 6.5745 6.6303 6.6303 7.9533 7.9533 8.0333 8.0653 8.0653 8.0927 8.3499 8.3499 8.4354 8.4750 10.0972 10.0972 10.5449 10.6224 k = 0.4043 0.4043 0.4043 ( 7640 PWs) bands (ev): -57.7700 -57.7700 -32.1730 -32.1730 -31.3457 -31.3457 -31.3457 -31.3457 -4.5277 -4.5277 -4.3713 -4.3713 -4.3707 -4.3703 -4.3224 -4.3224 1.6530 1.6530 1.6570 1.7042 1.7682 1.7682 2.1060 2.1060 3.2157 3.2597 3.2597 3.2597 3.3219 3.3219 3.3343 3.3343 3.3532 3.3553 3.5349 3.5349 3.6110 3.6246 3.6326 3.6326 4.0066 4.0066 4.0813 4.0813 4.1320 4.2085 4.2085 4.2255 4.2418 4.2641 4.2823 4.2823 4.4669 4.4669 5.1717 5.2040 5.2040 5.2232 5.2693 5.2693 5.3297 5.3727 5.3727 5.4484 6.3860 6.3860 6.5679 6.6224 6.6728 6.6728 7.9733 7.9733 8.0490 8.1016 8.1016 8.1037 8.3660 8.3660 8.4406 8.4859 10.0877 10.0877 10.4590 10.5356 k = 0.4149 0.4149 0.4149 ( 7628 PWs) bands (ev): -57.7700 -57.7700 -32.1730 -32.1730 -31.3457 -31.3457 -31.3457 -31.3457 -4.5041 -4.5041 -4.3770 -4.3770 -4.3765 -4.3761 -4.3283 -4.3283 1.6376 1.6376 1.6447 1.6863 1.7348 1.7348 2.0813 2.0813 3.2317 3.2677 3.2703 3.2703 3.3225 3.3225 3.3349 3.3349 3.3523 3.3578 3.5485 3.5485 3.6091 3.6200 3.6289 3.6289 4.0047 4.0047 4.0814 4.0814 4.1407 4.2070 4.2070 4.2263 4.2442 4.2652 4.2784 4.2784 4.4589 4.4589 5.1835 5.2131 5.2131 5.2349 5.2749 5.2749 5.3338 5.3754 5.3754 5.4447 6.4260 6.4260 6.6172 6.6706 6.7128 6.7128 7.9934 7.9934 8.0652 8.1145 8.1366 8.1366 8.3802 8.3802 8.4441 8.4942 10.0790 10.0790 10.3751 10.4498 k = 0.4255 0.4255 0.4255 ( 7616 PWs) bands (ev): -57.7700 -57.7700 -32.1730 -32.1730 -31.3457 -31.3457 -31.3457 -31.3457 -4.4825 -4.4825 -4.3822 -4.3822 -4.3816 -4.3813 -4.3338 -4.3338 1.6234 1.6234 1.6336 1.6698 1.7044 1.7044 2.0593 2.0593 3.2468 3.2752 3.2800 3.2800 3.3214 3.3214 3.3371 3.3371 3.3511 3.3593 3.5610 3.5610 3.6074 3.6161 3.6256 3.6256 4.0028 4.0028 4.0814 4.0814 4.1494 4.2057 4.2057 4.2257 4.2472 4.2661 4.2750 4.2750 4.4526 4.4526 5.1949 5.2217 5.2217 5.2457 5.2794 5.2794 5.3362 5.3764 5.3764 5.4391 6.4646 6.4646 6.6664 6.7176 6.7501 6.7501 8.0145 8.0145 8.0820 8.1254 8.1684 8.1684 8.3927 8.3927 8.4459 8.4991 10.0711 10.0711 10.2960 10.3679 k = 0.4362 0.4362 0.4362 ( 7631 PWs) bands (ev): -57.7700 -57.7700 -32.1731 -32.1731 -31.3457 -31.3457 -31.3457 -31.3457 -4.4630 -4.4630 -4.3866 -4.3866 -4.3860 -4.3858 -4.3390 -4.3390 1.6104 1.6104 1.6240 1.6548 1.6775 1.6775 2.0399 2.0399 3.2608 3.2823 3.2886 3.2886 3.3198 3.3198 3.3396 3.3396 3.3495 3.3598 3.5721 3.5721 3.6060 3.6127 3.6227 3.6227 4.0009 4.0009 4.0812 4.0812 4.1577 4.2044 4.2044 4.2240 4.2504 4.2668 4.2721 4.2721 4.4476 4.4476 5.2057 5.2298 5.2298 5.2552 5.2829 5.2829 5.3377 5.3764 5.3764 5.4317 6.5006 6.5006 6.7141 6.7618 6.7841 6.7841 8.0369 8.0369 8.0996 8.1364 8.1951 8.1951 8.4038 8.4038 8.4458 8.5003 10.0641 10.0641 10.2240 10.2921 k = 0.4468 0.4468 0.4468 ( 7637 PWs) bands (ev): -57.7700 -57.7700 -32.1731 -32.1731 -31.3457 -31.3457 -31.3457 -31.3457 -4.4457 -4.4457 -4.3904 -4.3904 -4.3898 -4.3896 -4.3439 -4.3439 1.5989 1.5989 1.6159 1.6415 1.6545 1.6545 2.0234 2.0234 3.2737 3.2889 3.2960 3.2960 3.3183 3.3183 3.3417 3.3417 3.3478 3.3594 3.5818 3.5818 3.6048 3.6099 3.6204 3.6204 3.9991 3.9991 4.0810 4.0810 4.1659 4.2032 4.2032 4.2216 4.2536 4.2672 4.2698 4.2698 4.4439 4.4439 5.2161 5.2373 5.2373 5.2628 5.2853 5.2853 5.3394 5.3757 5.3757 5.4232 6.5329 6.5329 6.7588 6.8016 6.8144 6.8144 8.0608 8.0608 8.1176 8.1475 8.2148 8.2148 8.4140 8.4140 8.4443 8.4974 10.0578 10.0578 10.1612 10.2246 k = 0.4574 0.4574 0.4574 ( 7637 PWs) bands (ev): -57.7700 -57.7700 -32.1731 -32.1731 -31.3457 -31.3457 -31.3457 -31.3457 -4.4306 -4.4306 -4.3935 -4.3935 -4.3929 -4.3927 -4.3487 -4.3487 1.5888 1.5888 1.6097 1.6300 1.6358 1.6358 2.0097 2.0097 3.2852 3.2949 3.3020 3.3020 3.3175 3.3175 3.3435 3.3435 3.3460 3.3579 3.5898 3.5898 3.6039 3.6076 3.6186 3.6186 3.9976 3.9976 4.0809 4.0809 4.1737 4.2023 4.2023 4.2186 4.2566 4.2674 4.2680 4.2680 4.4412 4.4412 5.2261 5.2441 5.2441 5.2679 5.2867 5.2867 5.3421 5.3746 5.3746 5.4136 6.5604 6.5604 6.7991 6.8355 6.8403 6.8403 8.0860 8.0860 8.1355 8.1583 8.2259 8.2259 8.4237 8.4237 8.4419 8.4907 10.0523 10.0523 10.1095 10.1673 k = 0.4681 0.4681 0.4681 ( 7634 PWs) bands (ev): -57.7700 -57.7700 -32.1731 -32.1731 -31.3457 -31.3457 -31.3457 -31.3457 -4.4179 -4.4179 -4.3959 -4.3959 -4.3953 -4.3952 -4.3532 -4.3532 1.5804 1.5804 1.6053 1.6205 1.6215 1.6215 1.9991 1.9991 3.2950 3.3002 3.3060 3.3060 3.3175 3.3175 3.3444 3.3447 3.3447 3.3555 3.5959 3.5959 3.6033 3.6058 3.6175 3.6175 3.9963 3.9963 4.0807 4.0807 4.1811 4.2015 4.2015 4.2149 4.2593 4.2666 4.2666 4.2673 4.4392 4.4392 5.2355 5.2501 5.2501 5.2700 5.2871 5.2871 5.3467 5.3735 5.3735 5.4034 6.5826 6.5826 6.8335 6.8612 6.8612 6.8621 8.1121 8.1121 8.1523 8.1683 8.2279 8.2279 8.4329 8.4329 8.4397 8.4808 10.0473 10.0473 10.0702 10.1218 k = 0.4787 0.4787 0.4787 ( 7640 PWs) bands (ev): -57.7700 -57.7700 -32.1731 -32.1731 -31.3457 -31.3457 -31.3457 -31.3457 -4.4080 -4.4080 -4.3977 -4.3977 -4.3970 -4.3969 -4.3573 -4.3573 1.5739 1.5739 1.6028 1.6115 1.6115 1.6129 1.9914 1.9914 3.3026 3.3046 3.3081 3.3081 3.3186 3.3186 3.3435 3.3454 3.3454 3.3524 3.6000 3.6000 3.6029 3.6045 3.6169 3.6169 3.9953 3.9953 4.0806 4.0806 4.1881 4.2009 4.2009 4.2107 4.2616 4.2657 4.2657 4.2669 4.4379 4.4379 5.2443 5.2550 5.2550 5.2689 5.2868 5.2868 5.3534 5.3725 5.3725 5.3927 6.5988 6.5988 6.8606 6.8767 6.8767 6.8805 8.1383 8.1383 8.1666 8.1765 8.2212 8.2212 8.4391 8.4407 8.4407 8.4691 10.0423 10.0423 10.0445 10.0813 k = 0.4894 0.4894 0.4894 ( 7646 PWs) bands (ev): -57.7700 -57.7700 -32.1731 -32.1731 -31.3457 -31.3457 -31.3457 -31.3457 -4.4013 -4.4013 -4.3986 -4.3986 -4.3981 -4.3980 -4.3605 -4.3605 1.5697 1.5697 1.6022 1.6057 1.6057 1.6073 1.9868 1.9868 3.3074 3.3077 3.3088 3.3088 3.3198 3.3198 3.3439 3.3457 3.3457 3.3490 3.6023 3.6023 3.6028 3.6036 3.6168 3.6168 3.9947 3.9947 4.0805 4.0805 4.1945 4.2006 4.2006 4.2058 4.2634 4.2652 4.2652 4.2661 4.4371 4.4371 5.2524 5.2583 5.2583 5.2651 5.2863 5.2863 5.3619 5.3719 5.3719 5.3821 6.6086 6.6086 6.8795 6.8861 6.8861 6.8897 8.1634 8.1634 8.1769 8.1814 8.2076 8.2076 8.4415 8.4459 8.4459 8.4575 10.0327 10.0375 10.0375 10.0515 k = 0.5000 0.5000 0.5000 ( 7664 PWs) bands (ev): -57.7700 -57.7700 -32.1731 -32.1731 -31.3457 -31.3457 -31.3457 -31.3457 -4.3994 -4.3994 -4.3984 -4.3984 -4.3984 -4.3984 -4.3618 -4.3618 1.5683 1.5683 1.6037 1.6037 1.6037 1.6037 1.9853 1.9853 3.3089 3.3089 3.3089 3.3089 3.3203 3.3203 3.3458 3.3458 3.3458 3.3458 3.6030 3.6030 3.6030 3.6030 3.6168 3.6168 3.9945 3.9945 4.0805 4.0805 4.2004 4.2004 4.2004 4.2004 4.2649 4.2649 4.2649 4.2649 4.4368 4.4368 5.2595 5.2595 5.2595 5.2595 5.2860 5.2860 5.3717 5.3717 5.3717 5.3717 6.6119 6.6119 6.8893 6.8893 6.8893 6.8893 8.1818 8.1818 8.1818 8.1818 8.1930 8.1930 8.4478 8.4478 8.4478 8.4478 10.0351 10.0351 10.0351 10.0351 k = 0.5000 0.5000 0.5000 ( 7664 PWs) bands (ev): -57.7700 -57.7700 -32.1731 -32.1731 -31.3457 -31.3457 -31.3457 -31.3457 -4.3994 -4.3994 -4.3984 -4.3984 -4.3984 -4.3984 -4.3618 -4.3618 1.5683 1.5683 1.6037 1.6037 1.6037 1.6037 1.9853 1.9853 3.3089 3.3089 3.3089 3.3089 3.3203 3.3203 3.3458 3.3458 3.3458 3.3458 3.6030 3.6030 3.6030 3.6030 3.6168 3.6168 3.9945 3.9945 4.0805 4.0805 4.2004 4.2004 4.2004 4.2004 4.2649 4.2649 4.2649 4.2649 4.4368 4.4368 5.2595 5.2595 5.2595 5.2595 5.2860 5.2860 5.3717 5.3717 5.3717 5.3717 6.6119 6.6119 6.8893 6.8893 6.8893 6.8893 8.1818 8.1818 8.1818 8.1818 8.1930 8.1930 8.4478 8.4478 8.4478 8.4478 10.0351 10.0351 10.0351 10.0351 k = 0.4868 0.5000 0.4868 ( 7652 PWs) bands (ev): -57.7700 -57.7700 -32.1731 -32.1731 -31.3457 -31.3457 -31.3457 -31.3457 -4.4012 -4.4011 -4.3989 -4.3989 -4.3980 -4.3980 -4.3605 -4.3605 1.5698 1.5698 1.6024 1.6050 1.6063 1.6073 1.9868 1.9869 3.3074 3.3078 3.3086 3.3088 3.3198 3.3198 3.3438 3.3452 3.3464 3.3489 3.6021 3.6026 3.6028 3.6035 3.6167 3.6169 3.9947 3.9947 4.0805 4.0805 4.1947 4.1990 4.2020 4.2057 4.2635 4.2648 4.2655 4.2661 4.4371 4.4371 5.2525 5.2566 5.2600 5.2650 5.2862 5.2864 5.3622 5.3693 5.3745 5.3818 6.6085 6.6085 6.8796 6.8848 6.8871 6.8898 8.1621 8.1631 8.1778 8.1819 8.2074 8.2079 8.4415 8.4440 8.4482 8.4571 10.0327 10.0355 10.0405 10.0509 k = 0.4737 0.5000 0.4737 ( 7636 PWs) bands (ev): -57.7700 -57.7700 -32.1731 -32.1731 -31.3457 -31.3457 -31.3457 -31.3457 -4.4072 -4.4071 -4.3994 -4.3992 -4.3963 -4.3963 -4.3572 -4.3572 1.5740 1.5740 1.6033 1.6100 1.6126 1.6131 1.9915 1.9916 3.3029 3.3047 3.3076 3.3083 3.3183 3.3184 3.3427 3.3451 3.3466 3.3525 3.5993 3.6013 3.6028 3.6040 3.6163 3.6175 3.9954 3.9954 4.0806 4.0806 4.1884 4.1979 4.2038 4.2105 4.2617 4.2649 4.2663 4.2669 4.4379 4.4379 5.2441 5.2515 5.2582 5.2690 5.2860 5.2879 5.3540 5.3676 5.3775 5.3922 6.5984 6.5985 6.8603 6.8740 6.8765 6.8825 8.1342 8.1364 8.1697 8.1782 8.2207 8.2222 8.4371 8.4389 8.4453 8.4679 10.0400 10.0438 10.0510 10.0751 k = 0.4605 0.5000 0.4605 ( 7632 PWs) bands (ev): -57.7700 -57.7700 -32.1731 -32.1731 -31.3457 -31.3457 -31.3457 -31.3457 -4.4162 -4.4160 -4.4002 -4.4000 -4.3934 -4.3933 -4.3529 -4.3528 1.5806 1.5807 1.6066 1.6189 1.6213 1.6228 1.9993 1.9994 3.2956 3.3001 3.3051 3.3075 3.3161 3.3165 3.3420 3.3460 3.3462 3.3558 3.5943 3.5991 3.6032 3.6043 3.6158 3.6189 3.9964 3.9964 4.0807 4.0808 4.1817 4.1969 4.2056 4.2148 4.2596 4.2654 4.2674 4.2676 4.4392 4.4393 5.2344 5.2446 5.2541 5.2717 5.2844 5.2904 5.3476 5.3668 5.3803 5.4023 6.5816 6.5820 6.8324 6.8566 6.8576 6.8692 8.1039 8.1076 8.1576 8.1710 8.2285 8.2312 8.4276 8.4391 8.4392 8.4786 10.0486 10.0650 10.0657 10.1011 k = 0.4474 0.5000 0.4474 ( 7630 PWs) bands (ev): -57.7700 -57.7700 -32.1731 -32.1731 -31.3457 -31.3457 -31.3457 -31.3457 -4.4271 -4.4269 -4.4016 -4.4015 -4.3893 -4.3892 -4.3480 -4.3479 1.5889 1.5895 1.6128 1.6317 1.6319 1.6369 2.0100 2.0104 3.2862 3.2945 3.3008 3.3063 3.3133 3.3145 3.3419 3.3453 3.3474 3.3586 3.5871 3.5957 3.6038 3.6040 3.6162 3.6211 3.9977 3.9978 4.0808 4.0810 4.1745 4.1962 4.2076 4.2185 4.2572 4.2661 4.2676 4.2691 4.4411 4.4414 5.2237 5.2364 5.2476 5.2730 5.2808 5.2936 5.3436 5.3664 5.3827 5.4120 6.5584 6.5592 6.7969 6.8280 6.8362 6.8509 8.0725 8.0779 8.1419 8.1604 8.2305 8.2349 8.4158 8.4300 8.4410 8.4874 10.0607 10.0823 10.0974 10.1341 k = 0.4342 0.5000 0.4342 ( 7642 PWs) bands (ev): -57.7700 -57.7700 -32.1731 -32.1731 -31.3457 -31.3457 -31.3457 -31.3457 -4.4397 -4.4395 -4.4039 -4.4037 -4.3841 -4.3840 -4.3426 -4.3425 1.5980 1.6001 1.6224 1.6450 1.6486 1.6549 2.0237 2.0244 3.2750 3.2882 3.2944 3.3039 3.3103 3.3123 3.3423 3.3441 3.3490 3.3606 3.5780 3.5904 3.6035 3.6046 3.6178 3.6240 3.9993 3.9994 4.0809 4.0813 4.1669 4.1956 4.2097 4.2218 4.2545 4.2672 4.2676 4.2710 4.4435 4.4442 5.2119 5.2271 5.2390 5.2729 5.2751 5.2972 5.3423 5.3660 5.3845 5.4209 6.5292 6.5306 6.7553 6.7920 6.8104 6.8278 8.0412 8.0484 8.1230 8.1468 8.2267 8.2332 8.4026 8.4186 8.4430 8.4930 10.0769 10.1032 10.1375 10.1751 k = 0.4211 0.5000 0.4211 ( 7630 PWs) bands (ev): -57.7700 -57.7700 -32.1731 -32.1731 -31.3457 -31.3457 -31.3457 -31.3457 -4.4538 -4.4535 -4.4071 -4.4070 -4.3777 -4.3776 -4.3366 -4.3366 1.6073 1.6120 1.6357 1.6606 1.6694 1.6768 2.0402 2.0415 3.2624 3.2812 3.2861 3.2998 3.3078 3.3097 3.3429 3.3434 3.3505 3.3618 3.5670 3.5829 3.6032 3.6058 3.6204 3.6277 4.0012 4.0013 4.0810 4.0816 4.1590 4.1954 4.2118 4.2247 4.2517 4.2675 4.2687 4.2735 4.4469 4.4479 5.1994 5.2169 5.2283 5.2656 5.2732 5.3010 5.3434 5.3651 5.3854 5.4288 6.4947 6.4969 6.7092 6.7500 6.7807 6.8006 8.0110 8.0196 8.1018 8.1306 8.2172 8.2261 8.3884 8.4054 8.4437 8.4948 10.0976 10.1285 10.1854 10.2233 k = 0.4079 0.5000 0.4079 ( 7622 PWs) bands (ev): -57.7700 -57.7700 -32.1730 -32.1730 -31.3457 -31.3457 -31.3457 -31.3457 -4.4691 -4.4688 -4.4115 -4.4114 -4.3703 -4.3701 -4.3299 -4.3299 1.6170 1.6250 1.6522 1.6786 1.6939 1.7025 2.0594 2.0615 3.2483 3.2737 3.2763 3.2937 3.3055 3.3067 3.3418 3.3451 3.3521 3.3621 3.5543 3.5735 3.6034 3.6072 3.6239 3.6319 4.0032 4.0033 4.0811 4.0819 4.1509 4.1954 4.2138 4.2270 4.2488 4.2672 4.2708 4.2766 4.4511 4.4528 5.1861 5.2057 5.2161 5.2546 5.2716 5.3046 5.3464 5.3631 5.3852 5.4356 6.4559 6.4588 6.6602 6.7037 6.7477 6.7697 7.9822 7.9920 8.0788 8.1120 8.2020 8.2136 8.3737 8.3907 8.4422 8.4925 10.1231 10.1585 10.2401 10.2781 k = 0.3947 0.5000 0.3947 ( 7628 PWs) bands (ev): -57.7700 -57.7700 -32.1730 -32.1730 -31.3457 -31.3457 -31.3457 -31.3457 -4.4856 -4.4853 -4.4171 -4.4170 -4.3618 -4.3616 -4.3224 -4.3224 1.6274 1.6392 1.6714 1.6990 1.7219 1.7315 2.0812 2.0842 3.2329 3.2652 3.2657 3.2860 3.3029 3.3031 3.3412 3.3470 3.3537 3.3614 3.5399 3.5623 3.6042 3.6091 3.6279 3.6369 4.0052 4.0053 4.0810 4.0821 4.1427 4.1955 4.2158 4.2287 4.2461 4.2669 4.2733 4.2803 4.4563 4.4589 5.1719 5.1938 5.2024 5.2415 5.2689 5.3077 5.3502 5.3603 5.3837 5.4414 6.4141 6.4174 6.6098 6.6544 6.7118 6.7354 7.9550 7.9656 8.0547 8.0915 8.1814 8.1961 8.3582 8.3749 8.4382 8.4861 10.1533 10.1931 10.3011 10.3385 k = 0.3816 0.5000 0.3816 ( 7640 PWs) bands (ev): -57.7700 -57.7700 -32.1730 -32.1730 -31.3457 -31.3457 -31.3457 -31.3457 -4.5032 -4.5028 -4.4239 -4.4238 -4.3523 -4.3521 -4.3141 -4.3141 1.6385 1.6544 1.6928 1.7214 1.7532 1.7637 2.1052 2.1095 3.2161 3.2528 3.2574 3.2768 3.2990 3.2998 3.3412 3.3487 3.3557 3.3599 3.5240 3.5494 3.6058 3.6114 3.6325 3.6425 4.0072 4.0072 4.0809 4.0821 4.1345 4.1958 4.2177 4.2298 4.2437 4.2665 4.2764 4.2848 4.4627 4.4665 5.1568 5.1810 5.1875 5.2265 5.2647 5.3098 5.3495 5.3612 5.3804 5.4463 6.3705 6.3740 6.5594 6.6035 6.6732 6.6982 7.9296 7.9406 8.0301 8.0694 8.1562 8.1743 8.3419 8.3580 8.4315 8.4759 10.1883 10.2321 10.3673 10.4038 k = 0.3684 0.5000 0.3684 ( 7634 PWs) bands (ev): -57.7700 -57.7700 -32.1730 -32.1730 -31.3457 -31.3457 -31.3456 -31.3456 -4.5216 -4.5213 -4.4319 -4.4318 -4.3419 -4.3416 -4.3050 -4.3049 1.6506 1.6705 1.7162 1.7457 1.7873 1.7986 2.1313 2.1370 3.1980 3.2395 3.2487 3.2660 3.2945 3.2961 3.3420 3.3501 3.3576 3.3584 3.5068 3.5351 3.6080 3.6143 3.6375 3.6488 4.0090 4.0091 4.0807 4.0818 4.1266 4.1962 4.2193 4.2301 4.2421 4.2661 4.2802 4.2903 4.4705 4.4758 5.1406 5.1674 5.1714 5.2099 5.2589 5.3106 5.3420 5.3676 5.3750 5.4507 6.3266 6.3297 6.5100 6.5520 6.6324 6.6583 7.9059 7.9168 8.0054 8.0459 8.1271 8.1493 8.3243 8.3398 8.4222 8.4623 10.2275 10.2754 10.4380 10.4734 k = 0.3553 0.5000 0.3553 ( 7622 PWs) bands (ev): -57.7700 -57.7700 -32.1730 -32.1730 -31.3457 -31.3457 -31.3456 -31.3456 -4.5408 -4.5405 -4.4410 -4.4409 -4.3305 -4.3302 -4.2950 -4.2949 1.6635 1.6874 1.7414 1.7716 1.8238 1.8360 2.1590 2.1666 3.1785 3.2252 3.2398 3.2538 3.2898 3.2917 3.3435 3.3510 3.3546 3.3617 3.4885 3.5197 3.6111 3.6178 3.6431 3.6558 4.0103 4.0107 4.0804 4.0808 4.1195 4.1968 4.2207 4.2298 4.2412 4.2658 4.2847 4.2969 4.4799 4.4870 5.1231 5.1532 5.1537 5.1918 5.2515 5.3096 5.3312 5.3672 5.3759 5.4550 6.2838 6.2857 6.4626 6.5010 6.5896 6.6160 7.8837 7.8942 7.9810 8.0212 8.0950 8.1219 8.3048 8.3203 8.4104 8.4456 10.2706 10.3222 10.5124 10.5465 k = 0.3421 0.5000 0.3421 ( 7622 PWs) bands (ev): -57.7700 -57.7700 -32.1730 -32.1730 -31.3457 -31.3457 -31.3456 -31.3456 -4.5607 -4.5604 -4.4511 -4.4511 -4.3183 -4.3180 -4.2842 -4.2841 1.6772 1.7052 1.7681 1.7991 1.8624 1.8754 2.1881 2.1978 3.1578 3.2100 3.2306 3.2401 3.2848 3.2869 3.3457 3.3509 3.3515 3.3656 3.4693 3.5036 3.6149 3.6220 3.6490 3.6636 4.0113 4.0120 4.0787 4.0799 4.1135 4.1972 4.2216 4.2292 4.2410 4.2654 4.2898 4.3047 4.4909 4.5002 5.1040 5.1342 5.1382 5.1721 5.2423 5.3065 5.3182 5.3568 5.3852 5.4595 6.2430 6.2432 6.4178 6.4510 6.5452 6.5719 7.8630 7.8725 7.9570 7.9952 8.0609 8.0933 8.2834 8.2995 8.3963 8.4262 10.3171 10.3720 10.5897 10.6223 k = 0.3289 0.5000 0.3289 ( 7626 PWs) bands (ev): -57.7700 -57.7700 -32.1730 -32.1730 -31.3457 -31.3457 -31.3456 -31.3456 -4.5811 -4.5808 -4.4620 -4.4620 -4.3053 -4.3050 -4.2727 -4.2725 1.6914 1.7235 1.7960 1.8278 1.9027 1.9164 2.2181 2.2301 3.1358 3.1940 3.2210 3.2253 3.2797 3.2815 3.3459 3.3489 3.3518 3.3696 3.4499 3.4872 3.6196 3.6269 3.6554 3.6720 4.0117 4.0129 4.0753 4.0792 4.1090 4.1977 4.2223 4.2287 4.2411 4.2652 4.2957 4.3138 4.5038 4.5156 5.0830 5.1128 5.1226 5.1508 5.2314 5.3012 5.3033 5.3437 5.3952 5.4645 6.2021 6.2054 6.3758 6.4023 6.4999 6.5265 7.8435 7.8516 7.9335 7.9679 8.0257 8.0647 8.2599 8.2773 8.3804 8.4046 10.3661 10.4241 10.6688 10.7002 k = 0.3158 0.5000 0.3158 ( 7622 PWs) bands (ev): -57.7700 -57.7700 -32.1730 -32.1730 -31.3457 -31.3457 -31.3456 -31.3456 -4.6019 -4.6015 -4.4738 -4.4738 -4.2916 -4.2913 -4.2605 -4.2603 1.7062 1.7424 1.8251 1.8575 1.9443 1.9585 2.2486 2.2630 3.1127 3.1771 3.2082 3.2121 3.2747 3.2757 3.3404 3.3517 3.3522 3.3733 3.4311 3.4715 3.6251 3.6327 3.6622 3.6813 4.0115 4.0132 4.0706 4.0783 4.1060 4.1981 4.2227 4.2285 4.2416 4.2649 4.3024 4.3243 4.5187 4.5332 5.0598 5.0891 5.1066 5.1280 5.2192 5.2872 5.2936 5.3282 5.4059 5.4703 6.1630 6.1711 6.3370 6.3547 6.4544 6.4810 7.8251 7.8313 7.9102 7.9394 7.9906 8.0368 8.2343 8.2541 8.3628 8.3812 10.4171 10.4775 10.7491 10.7794 k = 0.3026 0.5000 0.3026 ( 7624 PWs) bands (ev): -57.7700 -57.7700 -32.1730 -32.1730 -31.3457 -31.3457 -31.3456 -31.3456 -4.6229 -4.6226 -4.4862 -4.4861 -4.2773 -4.2769 -4.2478 -4.2475 1.7212 1.7615 1.8551 1.8882 1.9867 2.0014 2.2789 2.2961 3.0887 3.1593 3.1911 3.2016 3.2695 3.2699 3.3333 3.3508 3.3562 3.3757 3.4149 3.4571 3.6315 3.6393 3.6695 3.6915 4.0107 4.0131 4.0653 4.0771 4.1043 4.1985 4.2230 4.2287 4.2422 4.2647 4.3100 4.3363 4.5356 4.5532 5.0344 5.0629 5.0902 5.1036 5.2061 5.2702 5.2839 5.3107 5.4170 5.4767 6.1254 6.1404 6.3012 6.3074 6.4099 6.4369 7.8077 7.8110 7.8864 7.9100 7.9571 8.0103 8.2068 8.2300 8.3440 8.3564 10.4692 10.5315 10.8295 10.8591 k = 0.2895 0.5000 0.2895 ( 7626 PWs) bands (ev): -57.7700 -57.7700 -32.1730 -32.1730 -31.3457 -31.3457 -31.3456 -31.3456 -4.6441 -4.6437 -4.4990 -4.4990 -4.2624 -4.2620 -4.2345 -4.2342 1.7364 1.7807 1.8859 1.9196 2.0294 2.0446 2.3087 2.3288 3.0639 3.1405 3.1729 3.1908 3.2628 3.2653 3.3246 3.3475 3.3608 3.3747 3.4055 3.4452 3.6387 3.6468 3.6772 3.7025 4.0091 4.0125 4.0599 4.0756 4.1032 4.1987 4.2235 4.2292 4.2430 4.2646 4.3186 4.3499 4.5546 4.5754 5.0066 5.0342 5.0737 5.0781 5.1926 5.2527 5.2721 5.2919 5.4285 5.4837 6.0883 6.1131 6.2591 6.2681 6.3679 6.3961 7.7904 7.7910 7.8608 7.8803 7.9270 7.9855 8.1776 8.2054 8.3242 8.3306 10.5215 10.5850 10.9091 10.9383 k = 0.2763 0.5000 0.2763 ( 7618 PWs) bands (ev): -57.7700 -57.7700 -32.1730 -32.1730 -31.3457 -31.3457 -31.3456 -31.3456 -4.6652 -4.6649 -4.5123 -4.5122 -4.2471 -4.2467 -4.2208 -4.2205 1.7514 1.7998 1.9172 1.9515 2.0722 2.0876 2.3373 2.3605 3.0388 3.1207 3.1539 3.1792 3.2557 3.2609 3.3142 3.3389 3.3659 3.3719 3.4046 3.4366 3.6469 3.6551 3.6855 3.7145 4.0066 4.0114 4.0550 4.0738 4.1024 4.1988 4.2239 4.2299 4.2441 4.2645 4.3282 4.3649 4.5755 4.6000 4.9767 5.0027 5.0524 5.0572 5.1791 5.2347 5.2572 5.2733 5.4404 5.4911 6.0503 6.0888 6.2086 6.2375 6.3301 6.3603 7.7687 7.7745 7.8328 7.8515 7.9020 7.9624 8.1470 8.1807 8.3039 8.3043 10.5733 10.6371 10.9867 11.0160 k = 0.2632 0.5000 0.2632 ( 7612 PWs) bands (ev): -57.7700 -57.7700 -32.1730 -32.1730 -31.3456 -31.3456 -31.3456 -31.3456 -4.6863 -4.6860 -4.5258 -4.5257 -4.2314 -4.2310 -4.2068 -4.2065 1.7662 1.8184 1.9489 1.9837 2.1145 2.1301 2.3645 2.3906 3.0134 3.0999 3.1344 3.1665 3.2480 3.2569 3.3028 3.3254 3.3715 3.3717 3.4081 3.4314 3.6561 3.6643 3.6942 3.7275 4.0034 4.0098 4.0509 4.0718 4.1017 4.1989 4.2241 4.2309 4.2456 4.2645 4.3388 4.3812 4.5981 4.6266 4.9452 4.9687 5.0274 5.0412 5.1656 5.2163 5.2373 5.2576 5.4525 5.4988 6.0099 6.0666 6.1558 6.2090 6.2981 6.3307 7.7449 7.7570 7.8034 7.8249 7.8825 7.9409 8.1153 8.1563 8.2779 8.2832 10.6235 10.6870 11.0612 11.0911 k = 0.2500 0.5000 0.2500 ( 7612 PWs) bands (ev): -57.7700 -57.7700 -32.1730 -32.1730 -31.3456 -31.3456 -31.3456 -31.3456 -4.7071 -4.7067 -4.5394 -4.5393 -4.2155 -4.2151 -4.1925 -4.1922 1.7804 1.8364 1.9808 2.0160 2.1560 2.1714 2.3896 2.4188 2.9883 3.0782 3.1146 3.1522 3.2398 3.2532 3.2913 3.3101 3.3738 3.3775 3.4133 3.4294 3.6662 3.6743 3.7036 3.7417 3.9996 4.0079 4.0478 4.0696 4.1009 4.1987 4.2241 4.2318 4.2476 4.2645 4.3504 4.3988 4.6220 4.6551 4.9127 4.9328 5.0040 5.0262 5.1519 5.1976 5.2130 5.2446 5.4649 5.5065 5.9660 6.0434 6.1035 6.1829 6.2724 6.3072 7.7185 7.7361 7.7765 7.8015 7.8676 7.9207 8.0829 8.1327 8.2517 8.2625 10.6715 10.7338 11.1312 11.1623 k = 0.2368 0.5000 0.2368 ( 7600 PWs) bands (ev): -57.7700 -57.7700 -32.1730 -32.1730 -31.3456 -31.3456 -31.3456 -31.3456 -4.7275 -4.7272 -4.5530 -4.5529 -4.1994 -4.1989 -4.1781 -4.1778 1.7938 1.8533 2.0125 2.0481 2.1962 2.2113 2.4124 2.4447 2.9639 3.0556 3.0949 3.1361 3.2312 3.2494 3.2808 3.2954 3.3777 3.3840 3.4194 3.4303 3.6773 3.6852 3.7136 3.7569 3.9953 4.0057 4.0458 4.0673 4.1000 4.1984 4.2238 4.2327 4.2501 4.2647 4.3627 4.4173 4.6465 4.6851 4.8804 4.8958 4.9831 5.0127 5.1375 5.1791 5.1859 5.2331 5.4773 5.5140 5.9182 6.0086 6.0629 6.1599 6.2528 6.2892 7.6898 7.7092 7.7558 7.7816 7.8563 7.9014 8.0502 8.1104 8.2260 8.2422 10.7165 10.7767 11.1953 11.2282 k = 0.2237 0.5000 0.2237 ( 7612 PWs) bands (ev): -57.7700 -57.7700 -32.1730 -32.1730 -31.3456 -31.3456 -31.3456 -31.3456 -4.7474 -4.7471 -4.5666 -4.5664 -4.1832 -4.1828 -4.1637 -4.1633 1.8063 1.8689 2.0440 2.0798 2.2347 2.2494 2.4328 2.4680 2.9405 3.0325 3.0754 3.1180 3.2227 3.2454 3.2718 3.2822 3.3827 3.3907 3.4257 3.4332 3.6893 3.6969 3.7244 3.7732 3.9909 4.0034 4.0445 4.0651 4.0989 4.1978 4.2232 4.2334 4.2531 4.2650 4.3751 4.4362 4.6700 4.7160 4.8498 4.8587 4.9654 5.0015 5.1214 5.1567 5.1614 5.2225 5.4898 5.5211 5.8668 5.9549 6.0420 6.1403 6.2382 6.2759 7.6595 7.6780 7.7404 7.7646 7.8482 7.8829 8.0174 8.0896 8.2013 8.2223 10.7577 10.8152 11.2522 11.2873 k = 0.2105 0.5000 0.2105 ( 7612 PWs) bands (ev): -57.7700 -57.7700 -32.1730 -32.1730 -31.3456 -31.3456 -31.3456 -31.3456 -4.7668 -4.7665 -4.5799 -4.5797 -4.1671 -4.1667 -4.1493 -4.1489 1.8176 1.8828 2.0749 2.1108 2.2711 2.2851 2.4505 2.4887 2.9187 3.0092 3.0564 3.0983 3.2149 3.2409 3.2645 3.2716 3.3887 3.3978 3.4322 3.4378 3.7023 3.7094 3.7361 3.7906 3.9867 4.0010 4.0440 4.0629 4.0977 4.1970 4.2224 4.2339 4.2563 4.2655 4.3872 4.4551 4.6897 4.7467 4.8230 4.8239 4.9519 4.9935 5.1029 5.1258 5.1452 5.2128 5.5021 5.5276 5.8127 5.8931 6.0308 6.1242 6.2277 6.2664 7.6286 7.6453 7.7280 7.7500 7.8429 7.8649 7.9849 8.0709 8.1779 8.2031 10.7947 10.8489 11.3003 11.3381 k = 0.1974 0.5000 0.1974 ( 7618 PWs) bands (ev): -57.7700 -57.7700 -32.1730 -32.1730 -31.3456 -31.3456 -31.3456 -31.3456 -4.7855 -4.7852 -4.5929 -4.5928 -4.1512 -4.1507 -4.1351 -4.1347 1.8276 1.8947 2.1049 2.1406 2.3051 2.3182 2.4656 2.5067 2.8988 2.9863 3.0383 3.0776 3.2081 3.2355 3.2586 3.2637 3.3954 3.4051 3.4387 3.4435 3.7161 3.7228 3.7489 3.8089 3.9829 3.9988 4.0442 4.0608 4.0964 4.1958 4.2212 4.2343 4.2598 4.2661 4.3981 4.4729 4.6994 4.7659 4.7997 4.8086 4.9432 4.9897 5.0817 5.0937 5.1305 5.2037 5.5142 5.5331 5.7573 5.8288 6.0246 6.1116 6.2204 6.2598 7.5980 7.6129 7.7172 7.7371 7.8401 7.8473 7.9531 8.0544 8.1559 8.1849 10.8271 10.8774 11.3384 11.3795 k = 0.1842 0.5000 0.1842 ( 7620 PWs) bands (ev): -57.7700 -57.7700 -32.1730 -32.1730 -31.3456 -31.3456 -31.3456 -31.3456 -4.8034 -4.8031 -4.6055 -4.6054 -4.1355 -4.1351 -4.1211 -4.1208 1.8362 1.9045 2.1339 2.1690 2.3363 2.3484 2.4785 2.5221 2.8812 2.9644 3.0212 3.0565 3.2024 3.2294 3.2538 3.2584 3.4028 3.4125 3.4452 3.4498 3.7305 3.7369 3.7630 3.8281 3.9798 3.9968 4.0449 4.0590 4.0950 4.1943 4.2196 4.2347 4.2632 4.2668 4.4069 4.4886 4.6932 4.7426 4.8099 4.8200 4.9403 4.9911 5.0584 5.0609 5.1168 5.1952 5.5257 5.5373 5.7016 5.7640 6.0221 6.1023 6.2156 6.2556 7.5682 7.5815 7.7075 7.7256 7.8301 7.8399 7.9221 8.0403 8.1357 8.1677 10.8545 10.9006 11.3651 11.4103 k = 0.1711 0.5000 0.1711 ( 7632 PWs) bands (ev): -57.7700 -57.7700 -32.1730 -32.1730 -31.3456 -31.3456 -31.3456 -31.3456 -4.8204 -4.8202 -4.6176 -4.6175 -4.1203 -4.1199 -4.1076 -4.1072 1.8433 1.9119 2.1615 2.1955 2.3643 2.3753 2.4892 2.5353 2.8662 2.9440 3.0053 3.0359 3.1980 3.2234 3.2498 3.2548 3.4106 3.4200 3.4515 3.4564 3.7455 3.7518 3.7785 3.8479 3.9774 3.9952 4.0461 4.0574 4.0936 4.1923 4.2176 4.2353 4.2666 4.2677 4.4128 4.5009 4.6747 4.7099 4.8236 4.8499 4.9436 4.9982 5.0285 5.0338 5.1035 5.1869 5.5361 5.5394 5.6471 5.7003 6.0232 6.0964 6.2127 6.2533 7.5397 7.5515 7.6987 7.7151 7.8132 7.8419 7.8924 8.0287 8.1176 8.1519 10.8769 10.9186 11.3793 11.4296 k = 0.1579 0.5000 0.1579 ( 7620 PWs) bands (ev): -57.7700 -57.7700 -32.1730 -32.1730 -31.3456 -31.3456 -31.3456 -31.3456 -4.8365 -4.8363 -4.6292 -4.6291 -4.1056 -4.1052 -4.0945 -4.0941 1.8488 1.9168 2.1874 2.2198 2.3887 2.3988 2.4986 2.5465 2.8542 2.9259 2.9907 3.0164 3.1947 3.2178 3.2467 3.2525 3.4186 3.4275 3.4576 3.4631 3.7608 3.7675 3.7956 3.8684 3.9762 3.9942 4.0478 4.0560 4.0924 4.1900 4.2152 4.2361 4.2688 4.2697 4.4154 4.5085 4.6516 4.6776 4.8420 4.8790 4.9528 4.9953 5.0093 5.0134 5.0901 5.1787 5.5380 5.5443 5.5957 5.6397 6.0277 6.0940 6.2112 6.2525 7.5128 7.5233 7.6907 7.7056 7.7967 7.8451 7.8651 8.0193 8.1018 8.1373 10.8943 10.9314 11.3797 11.4362 k = 0.1447 0.5000 0.1447 ( 7628 PWs) bands (ev): -57.7700 -57.7700 -32.1730 -32.1730 -31.3456 -31.3456 -31.3455 -31.3455 -4.8516 -4.8514 -4.6401 -4.6400 -4.0915 -4.0911 -4.0819 -4.0816 1.8530 1.9192 2.2114 2.2416 2.4089 2.4186 2.5072 2.5560 2.8450 2.9105 2.9774 2.9986 3.1924 3.2131 3.2442 3.2508 3.4266 3.4349 3.4633 3.4694 3.7761 3.7838 3.8143 3.8893 3.9761 3.9939 4.0498 4.0548 4.0913 4.1871 4.2123 4.2372 4.2699 4.2725 4.4142 4.5106 4.6277 4.6464 4.8593 4.9041 4.9659 4.9691 4.9888 5.0311 5.0765 5.1703 5.5281 5.5368 5.5611 5.5880 6.0356 6.0951 6.2109 6.2527 7.4877 7.4969 7.6834 7.6968 7.7807 7.8339 7.8558 8.0116 8.0887 8.1243 10.9066 10.9390 11.3647 11.4285 k = 0.1316 0.5000 0.1316 ( 7616 PWs) bands (ev): -57.7700 -57.7700 -32.1730 -32.1730 -31.3456 -31.3456 -31.3455 -31.3455 -4.8656 -4.8655 -4.6503 -4.6502 -4.0782 -4.0779 -4.0701 -4.0698 1.8558 1.9194 2.2332 2.2606 2.4246 2.4347 2.5159 2.5641 2.8389 2.8982 2.9653 2.9827 3.1910 3.2091 3.2424 3.2496 3.4346 3.4421 3.4686 3.4753 3.7915 3.8004 3.8347 3.9105 3.9774 3.9946 4.0521 4.0538 4.0904 4.1838 4.2090 4.2386 4.2710 4.2748 4.4098 4.5068 4.6045 4.6164 4.8677 4.9155 4.9540 4.9728 4.9905 5.0533 5.0632 5.1614 5.4961 5.4964 5.5592 5.5615 6.0466 6.0999 6.2113 6.2539 7.4645 7.4725 7.6768 7.6887 7.7654 7.8096 7.8631 8.0053 8.0786 8.1129 10.9138 10.9415 11.3333 11.4045 k = 0.1184 0.5000 0.1184 ( 7620 PWs) bands (ev): -57.7700 -57.7700 -32.1730 -32.1730 -31.3456 -31.3456 -31.3455 -31.3455 -4.8785 -4.8783 -4.6597 -4.6596 -4.0658 -4.0655 -4.0591 -4.0588 1.8576 1.9174 2.2527 2.2767 2.4356 2.4471 2.5251 2.5710 2.8356 2.8892 2.9544 2.9691 3.1902 3.2059 3.2411 3.2488 3.4423 3.4490 3.4735 3.4806 3.8067 3.8170 3.8566 3.9322 3.9804 3.9963 4.0531 4.0546 4.0900 4.1799 4.2053 4.2402 4.2720 4.2762 4.4027 4.4977 4.5822 4.5874 4.8584 4.9031 4.9592 4.9844 5.0100 5.0528 5.0772 5.1522 5.4504 5.4561 5.5469 5.5630 6.0604 6.1082 6.2124 6.2556 7.4433 7.4502 7.6710 7.6812 7.7509 7.7861 7.8727 7.9997 8.0717 8.1032 10.9160 10.9388 11.2862 11.3630 k = 0.1053 0.5000 0.1053 ( 7640 PWs) bands (ev): -57.7700 -57.7700 -32.1730 -32.1730 -31.3456 -31.3456 -31.3455 -31.3455 -4.8901 -4.8900 -4.6683 -4.6682 -4.0544 -4.0540 -4.0489 -4.0486 1.8585 1.9136 2.2696 2.2898 2.4425 2.4561 2.5350 2.5770 2.8351 2.8834 2.9446 2.9575 3.1899 3.2033 3.2402 3.2481 3.4497 3.4555 3.4779 3.4851 3.8213 3.8330 3.8800 3.9542 3.9854 3.9993 4.0525 4.0572 4.0903 4.1756 4.2012 4.2419 4.2727 4.2767 4.3939 4.4843 4.5593 4.5606 4.8378 4.8802 4.9779 4.9931 5.0319 5.0540 5.0989 5.1451 5.4057 5.4209 5.5367 5.5614 6.0764 6.1198 6.2141 6.2578 7.4242 7.4300 7.6658 7.6745 7.7373 7.7644 7.8835 7.9944 8.0682 8.0953 10.9129 10.9308 11.2271 11.3062 k = 0.0921 0.5000 0.0921 ( 7642 PWs) bands (ev): -57.7700 -57.7700 -32.1730 -32.1730 -31.3456 -31.3456 -31.3455 -31.3455 -4.9005 -4.9004 -4.6759 -4.6758 -4.0440 -4.0437 -4.0397 -4.0394 1.8588 1.9085 2.2840 2.3002 2.4463 2.4619 2.5451 2.5821 2.8372 2.8806 2.9357 2.9479 3.1900 3.2013 3.2399 3.2477 3.4566 3.4614 3.4816 3.4890 3.8351 3.8476 3.9045 3.9765 3.9924 4.0036 4.0521 4.0598 4.0915 4.1707 4.1969 4.2432 4.2729 4.2758 4.3847 4.4681 4.5320 4.5393 4.8150 4.8554 4.9878 5.0000 5.0492 5.0770 5.1057 5.1519 5.3673 5.3910 5.5253 5.5563 6.0939 6.1340 6.2162 6.2604 7.4073 7.4121 7.6615 7.6684 7.7248 7.7448 7.8948 7.9890 8.0675 8.0893 10.9042 10.9172 11.1625 11.2402 k = 0.0789 0.5000 0.0789 ( 7642 PWs) bands (ev): -57.7700 -57.7700 -32.1730 -32.1730 -31.3456 -31.3456 -31.3455 -31.3455 -4.9096 -4.9095 -4.6827 -4.6826 -4.0348 -4.0346 -4.0315 -4.0313 1.8588 1.9024 2.2958 2.3080 2.4482 2.4650 2.5548 2.5864 2.8414 2.8803 2.9277 2.9398 3.1904 3.1997 3.2400 3.2474 3.4630 3.4669 3.4849 3.4920 3.8478 3.8603 3.9300 3.9989 4.0018 4.0094 4.0519 4.0623 4.0942 4.1653 4.1925 4.2431 4.2724 4.2738 4.3764 4.4505 4.5052 4.5177 4.7936 4.8310 4.9758 5.0193 5.0637 5.0958 5.1100 5.1751 5.3371 5.3661 5.5120 5.5473 6.1119 6.1495 6.2191 6.2632 7.3925 7.3963 7.6580 7.6632 7.7133 7.7272 7.9062 7.9836 8.0691 8.0851 10.8894 10.8980 11.0998 11.1728 k = 0.0658 0.5000 0.0658 ( 7642 PWs) bands (ev): -57.7700 -57.7700 -32.1730 -32.1730 -31.3456 -31.3456 -31.3455 -31.3455 -4.9174 -4.9173 -4.6884 -4.6884 -4.0269 -4.0268 -4.0244 -4.0242 1.8588 1.8958 2.3051 2.3138 2.4492 2.4660 2.5638 2.5897 2.8474 2.8819 2.9205 2.9328 3.1910 3.1984 3.2405 3.2472 3.4688 3.4717 3.4876 3.4943 3.8589 3.8705 3.9562 4.0114 4.0164 4.0222 4.0520 4.0646 4.0991 4.1594 4.1881 4.2397 4.2709 4.2714 4.3704 4.4331 4.4792 4.4959 4.7751 4.8083 4.9632 5.0288 5.0764 5.0859 5.1455 5.2029 5.3154 5.3459 5.4969 5.5348 6.1295 6.1646 6.2232 6.2660 7.3799 7.3829 7.6553 7.6588 7.7031 7.7119 7.9170 7.9784 8.0721 8.0826 10.8682 10.8737 11.0456 11.1106 k = 0.0526 0.5000 0.0526 ( 7638 PWs) bands (ev): -57.7700 -57.7700 -32.1730 -32.1730 -31.3456 -31.3456 -31.3455 -31.3455 -4.9238 -4.9237 -4.6932 -4.6932 -4.0204 -4.0203 -4.0184 -4.0184 1.8591 1.8891 2.3120 2.3178 2.4499 2.4654 2.5717 2.5921 2.8547 2.8849 2.9138 2.9265 3.1916 3.1973 3.2412 3.2470 3.4739 3.4759 3.4897 3.4958 3.8682 3.8782 3.9824 4.0214 4.0241 4.0439 4.0525 4.0669 4.1069 4.1532 4.1836 4.2313 4.2682 4.2697 4.3678 4.4171 4.4545 4.4741 4.7603 4.7880 4.9529 5.0215 5.0865 5.0870 5.1810 5.2311 5.3016 5.3296 5.4805 5.5191 6.1456 6.1771 6.2293 6.2684 7.3695 7.3717 7.6534 7.6553 7.6941 7.6990 7.9268 7.9735 8.0757 8.0817 10.8417 10.8458 11.0040 11.0581 k = 0.0395 0.5000 0.0395 ( 7634 PWs) bands (ev): -57.7700 -57.7700 -32.1730 -32.1730 -31.3456 -31.3456 -31.3455 -31.3455 -4.9288 -4.9287 -4.6969 -4.6969 -4.0153 -4.0152 -4.0137 -4.0137 1.8599 1.8826 2.3169 2.3205 2.4509 2.4638 2.5784 2.5935 2.8626 2.8890 2.9072 2.9207 3.1922 3.1964 3.2421 3.2466 3.4781 3.4793 3.4914 3.4964 3.8757 3.8834 4.0079 4.0297 4.0318 4.0537 4.0598 4.0723 4.1183 4.1475 4.1791 4.2180 4.2645 4.2682 4.3692 4.4040 4.4321 4.4528 4.7494 4.7708 4.9462 5.0038 5.0935 5.0952 5.2151 5.2569 5.2946 5.3165 5.4643 5.5009 6.1596 6.1852 6.2379 6.2700 7.3613 7.3629 7.6523 7.6530 7.6866 7.6886 7.9354 7.9687 8.0792 8.0820 10.8139 10.8176 10.9756 11.0165 k = 0.0263 0.5000 0.0263 ( 7630 PWs) bands (ev): -57.7700 -57.7700 -32.1730 -32.1730 -31.3456 -31.3456 -31.3455 -31.3455 -4.9324 -4.9323 -4.6996 -4.6996 -4.0116 -4.0116 -4.0102 -4.0102 1.8614 1.8767 2.3201 2.3221 2.4523 2.4616 2.5839 2.5939 2.8708 2.8938 2.9006 2.9151 3.1929 3.1956 3.2431 3.2462 3.4814 3.4819 3.4927 3.4964 3.8813 3.8865 4.0302 4.0356 4.0392 4.0567 4.0633 4.0836 4.1322 4.1448 4.1741 4.2013 4.2607 4.2657 4.3748 4.3950 4.4134 4.4326 4.7426 4.7571 4.9440 4.9845 5.1001 5.1011 5.2463 5.2760 5.2938 5.3060 5.4509 5.4815 6.1710 6.1887 6.2477 6.2702 7.3555 7.3565 7.6516 7.6518 7.6806 7.6810 7.9428 7.9641 8.0819 8.0829 10.7900 10.7932 10.9587 10.9858 k = 0.0132 0.5000 0.0132 ( 7636 PWs) bands (ev): -57.7700 -57.7700 -32.1730 -32.1730 -31.3456 -31.3456 -31.3455 -31.3455 -4.9345 -4.9345 -4.7012 -4.7012 -4.0095 -4.0095 -4.0081 -4.0081 1.8638 1.8715 2.3220 2.3228 2.4542 2.4590 2.5882 2.5931 2.8788 2.8938 2.8989 2.9096 3.1935 3.1949 3.2441 3.2456 3.4835 3.4836 3.4938 3.4959 3.8851 3.8877 4.0390 4.0392 4.0510 4.0621 4.0645 4.0865 4.1457 4.1512 4.1675 4.1831 4.2583 4.2620 4.3844 4.3909 4.4000 4.4140 4.7400 4.7473 4.9468 4.9677 5.1043 5.1046 5.2725 5.2852 5.2962 5.2977 5.4446 5.4630 6.1796 6.1886 6.2569 6.2684 7.3521 7.3526 7.6511 7.6515 7.6764 7.6766 7.9491 7.9594 8.0836 8.0839 10.7746 10.7764 10.9517 10.9651 k = 0.0000 0.5000-0.0000 ( 7624 PWs) bands (ev): -57.7700 -57.7700 -32.1730 -32.1730 -31.3456 -31.3456 -31.3455 -31.3455 -4.9352 -4.9352 -4.7018 -4.7018 -4.0088 -4.0088 -4.0074 -4.0074 1.8672 1.8672 2.3228 2.3228 2.4565 2.4565 2.5912 2.5912 2.8865 2.8865 2.9042 2.9042 3.1942 3.1942 3.2449 3.2449 3.4842 3.4842 3.4949 3.4949 3.8872 3.8872 4.0404 4.0404 4.0584 4.0584 4.0778 4.0778 4.1580 4.1580 4.1656 4.1656 4.2589 4.2589 4.3924 4.3924 4.3978 4.3978 4.7416 4.7416 4.9549 4.9549 5.1058 5.1058 5.2897 5.2897 5.2916 5.2916 5.4492 5.4492 6.1854 6.1854 6.2639 6.2639 7.3511 7.3511 7.6512 7.6512 7.6750 7.6750 7.9545 7.9545 8.0842 8.0842 10.7699 10.7699 10.9539 10.9539 k = 0.5000 0.5000-0.0000 ( 7660 PWs) bands (ev): -57.7700 -57.7700 -32.1730 -32.1730 -31.3457 -31.3457 -31.3456 -31.3456 -4.5447 -4.5447 -4.4338 -4.4338 -4.4331 -4.4331 -4.2912 -4.2912 2.0909 2.0909 2.1192 2.1192 2.2484 2.2484 2.6651 2.6651 2.9606 2.9606 3.0817 3.0817 3.1179 3.1179 3.2194 3.2194 3.2617 3.2617 3.4516 3.4516 3.5948 3.5948 3.6396 3.6396 4.0801 4.0801 4.0863 4.0863 4.1567 4.1567 4.2177 4.2177 4.3393 4.3393 4.3779 4.3779 4.6399 4.6399 4.7370 4.7370 4.9051 4.9051 5.0513 5.0513 5.0529 5.0529 5.4114 5.4114 5.8586 5.8586 5.9515 5.9515 6.5539 6.5539 7.4663 7.4663 7.6385 7.6385 8.1108 8.1108 8.2411 8.2411 8.3068 8.3068 11.0962 11.0962 11.1005 11.1005 k = 0.5000 0.5000 0.0185 ( 7660 PWs) bands (ev): -57.7700 -57.7700 -32.1730 -32.1730 -31.3457 -31.3457 -31.3456 -31.3456 -4.5444 -4.5444 -4.4337 -4.4337 -4.4330 -4.4330 -4.2913 -4.2913 2.0887 2.0887 2.1166 2.1166 2.2450 2.2450 2.6606 2.6606 2.9629 2.9629 3.0813 3.0813 3.1216 3.1216 3.2217 3.2217 3.2623 3.2623 3.4513 3.4513 3.5948 3.5948 3.6395 3.6395 4.0800 4.0800 4.0864 4.0864 4.1557 4.1557 4.2182 4.2182 4.3385 4.3385 4.3764 4.3764 4.6375 4.6375 4.7383 4.7383 4.9091 4.9091 5.0530 5.0530 5.0580 5.0580 5.4112 5.4112 5.8592 5.8592 5.9525 5.9525 6.5547 6.5547 7.4658 7.4658 7.6419 7.6419 8.1117 8.1117 8.2420 8.2420 8.3065 8.3065 11.0947 11.0947 11.0989 11.0989 k = 0.5000 0.5000 0.0370 ( 7644 PWs) bands (ev): -57.7700 -57.7700 -32.1730 -32.1730 -31.3457 -31.3457 -31.3456 -31.3456 -4.5434 -4.5434 -4.4334 -4.4334 -4.4326 -4.4326 -4.2915 -4.2915 2.0821 2.0821 2.1089 2.1089 2.2348 2.2348 2.6476 2.6476 2.9695 2.9695 3.0814 3.0814 3.1308 3.1308 3.2283 3.2283 3.2644 3.2644 3.4506 3.4506 3.5948 3.5948 3.6394 3.6394 4.0798 4.0798 4.0867 4.0867 4.1531 4.1531 4.2197 4.2197 4.3364 4.3364 4.3720 4.3720 4.6308 4.6308 4.7424 4.7424 4.9208 4.9208 5.0606 5.0606 5.0703 5.0703 5.4105 5.4105 5.8610 5.8610 5.9553 5.9553 6.5573 6.5573 7.4646 7.4646 7.6518 7.6518 8.1144 8.1144 8.2449 8.2449 8.3056 8.3056 11.0899 11.0899 11.0939 11.0939 k = 0.5000 0.5000 0.0556 ( 7632 PWs) bands (ev): -57.7700 -57.7700 -32.1730 -32.1730 -31.3457 -31.3457 -31.3456 -31.3456 -4.5417 -4.5417 -4.4328 -4.4328 -4.4321 -4.4321 -4.2919 -4.2919 2.0714 2.0714 2.0964 2.0964 2.2185 2.2185 2.6270 2.6270 2.9800 2.9800 3.0841 3.0841 3.1425 3.1425 3.2373 3.2373 3.2694 3.2694 3.4495 3.4495 3.5948 3.5948 3.6393 3.6393 4.0795 4.0795 4.0871 4.0871 4.1490 4.1490 4.2217 4.2217 4.3330 4.3330 4.3653 4.3653 4.6207 4.6207 4.7495 4.7495 4.9389 4.9389 5.0738 5.0738 5.0885 5.0885 5.4094 5.4094 5.8641 5.8641 5.9604 5.9604 6.5614 6.5614 7.4635 7.4635 7.6674 7.6674 8.1188 8.1188 8.2495 8.2495 8.3042 8.3042 11.0818 11.0818 11.0853 11.0853 k = 0.5000 0.5000 0.0741 ( 7632 PWs) bands (ev): -57.7700 -57.7700 -32.1730 -32.1730 -31.3457 -31.3457 -31.3456 -31.3456 -4.5395 -4.5395 -4.4320 -4.4320 -4.4313 -4.4313 -4.2925 -4.2925 2.0568 2.0568 2.0795 2.0795 2.1968 2.1968 2.6003 2.6003 2.9937 2.9937 3.0898 3.0898 3.1552 3.1552 3.2455 3.2455 3.2799 3.2799 3.4478 3.4478 3.5947 3.5947 3.6390 3.6390 4.0788 4.0788 4.0876 4.0876 4.1441 4.1441 4.2241 4.2241 4.3285 4.3285 4.3567 4.3567 4.6082 4.6082 4.7598 4.7598 4.9620 4.9620 5.0917 5.0917 5.1119 5.1119 5.4079 5.4079 5.8691 5.8691 5.9679 5.9679 6.5672 6.5672 7.4632 7.4632 7.6881 7.6881 8.1249 8.1249 8.2558 8.2558 8.3023 8.3023 11.0699 11.0699 11.0727 11.0727 k = 0.5000 0.5000 0.0926 ( 7640 PWs) bands (ev): -57.7700 -57.7700 -32.1730 -32.1730 -31.3457 -31.3457 -31.3456 -31.3456 -4.5366 -4.5366 -4.4310 -4.4310 -4.4303 -4.4303 -4.2932 -4.2932 2.0386 2.0386 2.0587 2.0587 2.1706 2.1706 2.5688 2.5688 3.0101 3.0101 3.0985 3.0985 3.1680 3.1680 3.2508 3.2508 3.2967 3.2967 3.4458 3.4458 3.5947 3.5947 3.6386 3.6386 4.0778 4.0778 4.0880 4.0880 4.1389 4.1389 4.2267 4.2267 4.3234 4.3234 4.3468 4.3468 4.5943 4.5943 4.7732 4.7732 4.9887 4.9887 5.1131 5.1131 5.1390 5.1390 5.4061 5.4061 5.8761 5.8761 5.9785 5.9785 6.5745 6.5745 7.4647 7.4647 7.7130 7.7130 8.1325 8.1325 8.2634 8.2634 8.3001 8.3001 11.0538 11.0538 11.0556 11.0556 k = 0.5000 0.5000 0.1111 ( 7640 PWs) bands (ev): -57.7700 -57.7700 -32.1730 -32.1730 -31.3457 -31.3457 -31.3456 -31.3456 -4.5331 -4.5331 -4.4298 -4.4298 -4.4291 -4.4291 -4.2941 -4.2941 2.0173 2.0173 2.0348 2.0348 2.1407 2.1407 2.5339 2.5339 3.0282 3.0282 3.1096 3.1096 3.1808 3.1808 3.2541 3.2541 3.3176 3.3176 3.4435 3.4435 3.5947 3.5947 3.6381 3.6381 4.0763 4.0763 4.0882 4.0882 4.1341 4.1341 4.2292 4.2292 4.3178 4.3178 4.3364 4.3364 4.5799 4.5799 4.7896 4.7896 5.0178 5.0178 5.1367 5.1367 5.1688 5.1688 5.4040 5.4040 5.8858 5.8858 5.9926 5.9926 6.5832 6.5832 7.4684 7.4684 7.7417 7.7417 8.1416 8.1416 8.2717 8.2717 8.2982 8.2982 11.0329 11.0329 11.0333 11.0333 k = 0.5000 0.5000 0.1296 ( 7640 PWs) bands (ev): -57.7700 -57.7700 -32.1730 -32.1730 -31.3457 -31.3457 -31.3456 -31.3456 -4.5290 -4.5290 -4.4285 -4.4285 -4.4277 -4.4277 -4.2952 -4.2952 1.9934 1.9934 2.0084 2.0084 2.1081 2.1081 2.4966 2.4966 3.0476 3.0476 3.1224 3.1224 3.1936 3.1936 3.2567 3.2567 3.3402 3.3402 3.4410 3.4410 3.5947 3.5947 3.6374 3.6374 4.0738 4.0738 4.0882 4.0882 4.1302 4.1302 4.2317 4.2317 4.3122 4.3122 4.3257 4.3257 4.5655 4.5655 4.8089 4.8089 5.0483 5.0483 5.1611 5.1611 5.1996 5.1996 5.4018 5.4018 5.8990 5.8990 6.0110 6.0110 6.5933 6.5933 7.4750 7.4750 7.7735 7.7735 8.1519 8.1519 8.2787 8.2787 8.2985 8.2985 11.0051 11.0051 11.0069 11.0069 k = 0.5000 0.5000 0.1481 ( 7636 PWs) bands (ev): -57.7700 -57.7700 -32.1730 -32.1730 -31.3457 -31.3457 -31.3456 -31.3456 -4.5244 -4.5244 -4.4269 -4.4269 -4.4262 -4.4262 -4.2965 -4.2965 1.9672 1.9672 1.9800 1.9800 2.0735 2.0735 2.4580 2.4580 3.0677 3.0677 3.1366 3.1366 3.2064 3.2064 3.2590 3.2590 3.3631 3.3631 3.4386 3.4386 3.5949 3.5949 3.6366 3.6366 4.0704 4.0704 4.0879 4.0879 4.1278 4.1278 4.2339 4.2339 4.3066 4.3066 4.3152 4.3152 4.5516 4.5516 4.8308 4.8308 5.0792 5.0792 5.1851 5.1851 5.2302 5.2302 5.3995 5.3995 5.9162 5.9162 6.0343 6.0343 6.6047 6.6047 7.4849 7.4849 7.8080 7.8080 8.1633 8.1633 8.2806 8.2806 8.3046 8.3046 10.9706 10.9706 10.9749 10.9749 k = 0.5000 0.5000 0.1667 ( 7624 PWs) bands (ev): -57.7700 -57.7700 -32.1730 -32.1730 -31.3457 -31.3457 -31.3456 -31.3456 -4.5193 -4.5193 -4.4252 -4.4252 -4.4245 -4.4245 -4.2980 -4.2980 1.9393 1.9393 1.9505 1.9505 2.0377 2.0377 2.4186 2.4186 3.0880 3.0880 3.1515 3.1515 3.2190 3.2190 3.2613 3.2613 3.3845 3.3845 3.4370 3.4370 3.5950 3.5950 3.6357 3.6357 4.0657 4.0657 4.0874 4.0874 4.1270 4.1270 4.2359 4.2359 4.3012 4.3012 4.3053 4.3053 4.5384 4.5384 4.8549 4.8549 5.1097 5.1097 5.2076 5.2076 5.2592 5.2592 5.3974 5.3974 5.9382 5.9382 6.0629 6.0629 6.6173 6.6173 7.4984 7.4984 7.8449 7.8449 8.1755 8.1755 8.2782 8.2782 8.3156 8.3156 10.9294 10.9294 10.9370 10.9370 k = 0.5000 0.5000 0.1852 ( 7648 PWs) bands (ev): -57.7700 -57.7700 -32.1730 -32.1730 -31.3457 -31.3457 -31.3456 -31.3456 -4.5136 -4.5136 -4.4235 -4.4235 -4.4227 -4.4227 -4.2998 -4.2998 1.9099 1.9099 1.9203 1.9203 2.0012 2.0012 2.3792 2.3792 3.1083 3.1083 3.1668 3.1668 3.2313 3.2313 3.2639 3.2639 3.4018 3.4018 3.4386 3.4386 3.5952 3.5952 3.6346 3.6346 4.0600 4.0600 4.0867 4.0867 4.1277 4.1277 4.2377 4.2377 4.2947 4.2947 4.2974 4.2974 4.5259 4.5259 4.8808 4.8808 5.1390 5.1390 5.2278 5.2278 5.2854 5.2854 5.3955 5.3955 5.9656 5.9656 6.0973 6.0973 6.6309 6.6309 7.5157 7.5157 7.8837 7.8837 8.1883 8.1883 8.2743 8.2743 8.3286 8.3286 10.8814 10.8814 10.8928 10.8928 k = 0.5000 0.5000 0.2037 ( 7660 PWs) bands (ev): -57.7700 -57.7700 -32.1730 -32.1730 -31.3457 -31.3457 -31.3456 -31.3456 -4.5075 -4.5075 -4.4216 -4.4216 -4.4209 -4.4209 -4.3018 -4.3018 1.8795 1.8795 1.8900 1.8900 1.9645 1.9645 2.3402 2.3402 3.1282 3.1282 3.1820 3.1820 3.2429 3.2429 3.2668 3.2668 3.4101 3.4101 3.4478 3.4478 3.5955 3.5955 3.6334 3.6334 4.0536 4.0536 4.0861 4.0861 4.1295 4.1295 4.2392 4.2392 4.2864 4.2864 4.2926 4.2926 4.5143 4.5143 4.9081 4.9081 5.1665 5.1665 5.2450 5.2450 5.3078 5.3078 5.3943 5.3943 5.9987 5.9987 6.1376 6.1376 6.6454 6.6454 7.5371 7.5371 7.9240 7.9240 8.2013 8.2013 8.2702 8.2702 8.3425 8.3425 10.8269 10.8269 10.8428 10.8428 k = 0.5000 0.5000 0.2222 ( 7644 PWs) bands (ev): -57.7700 -57.7700 -32.1730 -32.1730 -31.3457 -31.3457 -31.3456 -31.3456 -4.5010 -4.5010 -4.4196 -4.4196 -4.4189 -4.4189 -4.3040 -4.3040 1.8488 1.8488 1.8599 1.8599 1.9281 1.9281 2.3020 2.3020 3.1476 3.1476 3.1971 3.1971 3.2536 3.2536 3.2705 3.2705 3.4105 3.4105 3.4635 3.4635 3.5958 3.5958 3.6321 3.6321 4.0470 4.0470 4.0855 4.0855 4.1323 4.1323 4.2405 4.2405 4.2787 4.2787 4.2887 4.2887 4.5037 4.5037 4.9366 4.9366 5.1916 5.1916 5.2590 5.2590 5.3256 5.3256 5.3940 5.3940 6.0376 6.0376 6.1835 6.1835 6.6608 6.6608 7.5626 7.5626 7.9652 7.9652 8.2138 8.2138 8.2668 8.2668 8.3567 8.3567 10.7666 10.7666 10.7873 10.7873 k = 0.5000 0.5000 0.2407 ( 7636 PWs) bands (ev): -57.7700 -57.7700 -32.1730 -32.1730 -31.3457 -31.3457 -31.3456 -31.3456 -4.4942 -4.4942 -4.4176 -4.4176 -4.4169 -4.4169 -4.3065 -4.3065 1.8181 1.8181 1.8305 1.8305 1.8924 1.8924 2.2651 2.2651 3.1663 3.1663 3.2117 3.2117 3.2623 3.2623 3.2758 3.2758 3.4076 3.4076 3.4809 3.4809 3.5963 3.5963 3.6306 3.6306 4.0404 4.0404 4.0850 4.0850 4.1358 4.1358 4.2413 4.2413 4.2718 4.2718 4.2853 4.2853 4.4940 4.4940 4.9656 4.9656 5.2139 5.2139 5.2698 5.2698 5.3386 5.3386 5.3950 5.3950 6.0816 6.0816 6.2345 6.2345 6.6769 6.6769 7.5923 7.5923 8.0065 8.0065 8.2242 8.2242 8.2658 8.2658 8.3709 8.3709 10.7014 10.7014 10.7272 10.7272 k = 0.5000 0.5000 0.2593 ( 7628 PWs) bands (ev): -57.7700 -57.7700 -32.1730 -32.1730 -31.3457 -31.3457 -31.3456 -31.3456 -4.4870 -4.4870 -4.4156 -4.4156 -4.4149 -4.4149 -4.3093 -4.3093 1.7879 1.7879 1.8018 1.8018 1.8578 1.8578 2.2295 2.2295 3.1842 3.1842 3.2256 3.2256 3.2684 3.2684 3.2832 3.2832 3.4036 3.4036 3.4979 3.4979 3.5967 3.5967 3.6291 3.6291 4.0340 4.0340 4.0845 4.0845 4.1398 4.1398 4.2416 4.2416 4.2661 4.2661 4.2824 4.2824 4.4852 4.4852 4.9950 4.9950 5.2329 5.2329 5.2778 5.2778 5.3468 5.3468 5.3973 5.3973 6.1302 6.1302 6.2899 6.2899 6.6935 6.6935 7.6261 7.6261 8.0470 8.0470 8.2298 8.2298 8.2703 8.2703 8.3847 8.3847 10.6325 10.6325 10.6635 10.6635 k = 0.5000 0.5000 0.2778 ( 7636 PWs) bands (ev): -57.7700 -57.7700 -32.1730 -32.1730 -31.3457 -31.3457 -31.3456 -31.3456 -4.4795 -4.4795 -4.4136 -4.4136 -4.4129 -4.4129 -4.3125 -4.3125 1.7587 1.7587 1.7742 1.7742 1.8246 1.8246 2.1958 2.1958 3.2012 3.2012 3.2388 3.2388 3.2728 3.2728 3.2916 3.2916 3.3989 3.3989 3.5139 3.5139 3.5973 3.5973 3.6275 3.6275 4.0279 4.0279 4.0840 4.0840 4.1442 4.1442 4.2410 4.2410 4.2617 4.2617 4.2799 4.2799 4.4773 4.4773 5.0243 5.0243 5.2483 5.2483 5.2833 5.2833 5.3512 5.3512 5.4004 5.4004 6.1821 6.1821 6.3488 6.3488 6.7107 6.7107 7.6639 7.6639 8.0855 8.0855 8.2299 8.2299 8.2813 8.2813 8.3978 8.3978 10.5614 10.5614 10.5975 10.5975 k = 0.5000 0.5000 0.2963 ( 7644 PWs) bands (ev): -57.7700 -57.7700 -32.1730 -32.1730 -31.3457 -31.3457 -31.3456 -31.3456 -4.4718 -4.4718 -4.4116 -4.4116 -4.4109 -4.4109 -4.3159 -4.3159 1.7308 1.7308 1.7479 1.7479 1.7930 1.7930 2.1639 2.1639 3.2171 3.2171 3.2511 3.2511 3.2767 3.2767 3.3000 3.3000 3.3940 3.3940 3.5286 3.5286 3.5978 3.5978 3.6259 3.6259 4.0223 4.0223 4.0835 4.0835 4.1488 4.1488 4.2394 4.2394 4.2590 4.2590 4.2777 4.2777 4.4702 4.4702 5.0532 5.0532 5.2599 5.2599 5.2870 5.2870 5.3530 5.3530 5.4038 5.4038 6.2361 6.2361 6.4101 6.4101 6.7283 6.7283 7.7053 7.7053 8.1204 8.1204 8.2271 8.2271 8.2969 8.2969 8.4099 8.4099 10.4894 10.4894 10.5304 10.5304 k = 0.5000 0.5000 0.3148 ( 7632 PWs) bands (ev): -57.7700 -57.7700 -32.1730 -32.1730 -31.3457 -31.3457 -31.3456 -31.3456 -4.4639 -4.4639 -4.4097 -4.4097 -4.4090 -4.4090 -4.3196 -4.3196 1.7044 1.7044 1.7232 1.7232 1.7633 1.7633 2.1343 2.1343 3.2320 3.2320 3.2624 3.2624 3.2806 3.2806 3.3080 3.3080 3.3889 3.3889 3.5421 3.5421 3.5984 3.5984 3.6243 3.6243 4.0173 4.0173 4.0830 4.0830 4.1536 4.1536 4.2367 4.2367 4.2578 4.2578 4.2759 4.2759 4.4640 4.4640 5.0814 5.0814 5.2678 5.2678 5.2895 5.2895 5.3533 5.3533 5.4066 5.4066 6.2909 6.2909 6.4726 6.4726 6.7464 6.7464 7.7499 7.7499 8.1499 8.1499 8.2238 8.2238 8.3157 8.3157 8.4209 8.4209 10.4182 10.4182 10.4634 10.4634 k = 0.5000 0.5000 0.3333 ( 7616 PWs) bands (ev): -57.7700 -57.7700 -32.1730 -32.1730 -31.3457 -31.3457 -31.3456 -31.3456 -4.4560 -4.4560 -4.4079 -4.4079 -4.4072 -4.4072 -4.3236 -4.3236 1.6799 1.6799 1.7004 1.7004 1.7357 1.7357 2.1069 2.1069 3.2457 3.2457 3.2725 3.2725 3.2846 3.2846 3.3152 3.3152 3.3837 3.3837 3.5542 3.5542 3.5991 3.5991 3.6228 3.6228 4.0128 4.0128 4.0826 4.0826 4.1586 4.1586 4.2334 4.2334 4.2575 4.2575 4.2744 4.2744 4.4585 4.4585 5.1087 5.1087 5.2722 5.2722 5.2912 5.2912 5.3528 5.3528 5.4086 5.4086 6.3450 6.3450 6.5351 6.5351 6.7647 6.7647 7.7973 7.7973 8.1722 8.1722 8.2216 8.2216 8.3366 8.3366 8.4306 8.4306 10.3493 10.3493 10.3980 10.3980 k = 0.5000 0.5000 0.3519 ( 7608 PWs) bands (ev): -57.7700 -57.7700 -32.1730 -32.1730 -31.3457 -31.3457 -31.3457 -31.3457 -4.4480 -4.4480 -4.4062 -4.4062 -4.4055 -4.4055 -4.3279 -4.3279 1.6574 1.6574 1.6795 1.6795 1.7103 1.7103 2.0821 2.0821 3.2583 3.2583 3.2810 3.2810 3.2892 3.2892 3.3215 3.3215 3.3785 3.3785 3.5650 3.5650 3.5997 3.5997 3.6213 3.6213 4.0088 4.0088 4.0822 4.0822 4.1636 4.1636 4.2299 4.2299 4.2579 4.2579 4.2730 4.2730 4.4537 4.4537 5.1346 5.1346 5.2740 5.2740 5.2922 5.2922 5.3519 5.3519 5.4094 5.4094 6.3969 6.3969 6.5965 6.5965 6.7834 6.7834 7.8467 7.8467 8.1854 8.1854 8.2223 8.2223 8.3586 8.3586 8.4389 8.4389 10.2841 10.2841 10.3353 10.3353 k = 0.5000 0.5000 0.3704 ( 7616 PWs) bands (ev): -57.7700 -57.7700 -32.1731 -32.1731 -31.3457 -31.3457 -31.3457 -31.3457 -4.4400 -4.4400 -4.4046 -4.4046 -4.4039 -4.4039 -4.3325 -4.3325 1.6372 1.6372 1.6609 1.6609 1.6874 1.6874 2.0599 2.0599 3.2696 3.2696 3.2875 3.2875 3.2948 3.2948 3.3270 3.3270 3.3733 3.3733 3.5744 3.5744 3.6004 3.6004 3.6200 3.6200 4.0053 4.0053 4.0818 4.0818 4.1685 4.1685 4.2263 4.2263 4.2585 4.2585 4.2718 4.2718 4.4496 4.4496 5.1590 5.1590 5.2740 5.2740 5.2925 5.2925 5.3511 5.3511 5.4089 5.4089 6.4452 6.4452 6.6552 6.6552 6.8022 6.8022 7.8973 7.8973 8.1900 8.1900 8.2263 8.2263 8.3798 8.3798 8.4459 8.4459 10.2240 10.2240 10.2764 10.2764 k = 0.5000 0.5000 0.3889 ( 7624 PWs) bands (ev): -57.7700 -57.7700 -32.1731 -32.1731 -31.3457 -31.3457 -31.3457 -31.3457 -4.4321 -4.4321 -4.4032 -4.4032 -4.4025 -4.4025 -4.3374 -4.3374 1.6193 1.6193 1.6446 1.6446 1.6670 1.6670 2.0404 2.0404 3.2796 3.2796 3.2924 3.2924 3.3010 3.3010 3.3316 3.3316 3.3682 3.3682 3.5824 3.5824 3.6010 3.6010 3.6189 3.6189 4.0023 4.0023 4.0815 4.0815 4.1735 4.1735 4.2227 4.2227 4.2593 4.2593 4.2707 4.2707 4.4461 4.4461 5.1814 5.1814 5.2731 5.2731 5.2920 5.2920 5.3506 5.3506 5.4070 5.4070 6.4888 6.4888 6.7101 6.7101 6.8210 6.8210 7.9482 7.9482 8.1898 8.1898 8.2305 8.2305 8.3983 8.3983 8.4517 8.4517 10.1705 10.1705 10.2225 10.2225 k = 0.5000 0.5000 0.4074 ( 7640 PWs) bands (ev): -57.7700 -57.7700 -32.1731 -32.1731 -31.3457 -31.3457 -31.3457 -31.3457 -4.4244 -4.4244 -4.4020 -4.4020 -4.4013 -4.4013 -4.3424 -4.3424 1.6040 1.6040 1.6309 1.6309 1.6493 1.6493 2.0237 2.0237 3.2883 3.2883 3.2965 3.2965 3.3067 3.3067 3.3354 3.3354 3.3633 3.3633 3.5890 3.5890 3.6016 3.6016 3.6179 3.6179 3.9999 3.9999 4.0812 4.0812 4.1783 4.1783 4.2190 4.2190 4.2602 4.2602 4.2696 4.2696 4.4432 4.4432 5.2016 5.2016 5.2716 5.2716 5.2910 5.2910 5.3509 5.3509 5.4037 5.4037 6.5264 6.5264 6.7597 6.7597 6.8394 6.8394 7.9981 7.9981 8.1880 8.1880 8.2327 8.2327 8.4129 8.4129 8.4563 8.4563 10.1246 10.1246 10.1744 10.1744 k = 0.5000 0.5000 0.4259 ( 7632 PWs) bands (ev): -57.7700 -57.7700 -32.1731 -32.1731 -31.3457 -31.3457 -31.3457 -31.3457 -4.4170 -4.4170 -4.4009 -4.4009 -4.4003 -4.4003 -4.3476 -4.3476 1.5912 1.5912 1.6199 1.6199 1.6344 1.6344 2.0100 2.0100 3.2956 3.2956 3.3003 3.3003 3.3116 3.3116 3.3384 3.3384 3.3587 3.3587 3.5943 3.5943 3.6021 3.6021 3.6173 3.6173 3.9979 3.9979 4.0809 4.0809 4.1830 4.1830 4.2155 4.2155 4.2611 4.2611 4.2687 4.2687 4.4409 4.4409 5.2192 5.2192 5.2698 5.2698 5.2897 5.2897 5.3522 5.3522 5.3991 5.3991 6.5574 6.5574 6.8028 6.8028 6.8565 6.8565 8.0458 8.0458 8.1860 8.1860 8.2319 8.2319 8.4233 8.4233 8.4592 8.4592 10.0874 10.0874 10.1323 10.1323 k = 0.5000 0.5000 0.4444 ( 7624 PWs) bands (ev): -57.7700 -57.7700 -32.1731 -32.1731 -31.3457 -31.3457 -31.3457 -31.3457 -4.4103 -4.4103 -4.4001 -4.4001 -4.3994 -4.3994 -4.3526 -4.3526 1.5813 1.5813 1.6115 1.6115 1.6224 1.6224 1.9992 1.9992 3.3014 3.3014 3.3036 3.3036 3.3154 3.3154 3.3407 3.3407 3.3546 3.3546 3.5983 3.5983 3.6026 3.6026 3.6169 3.6169 3.9965 3.9965 4.0808 4.0808 4.1877 4.1877 4.2119 4.2119 4.2621 4.2621 4.2678 4.2678 4.4392 4.4392 5.2339 5.2339 5.2680 5.2680 5.2884 5.2884 5.3549 5.3549 5.3932 5.3932 6.5815 6.5815 6.8380 6.8380 6.8713 6.8713 8.0899 8.0899 8.1842 8.1842 8.2277 8.2277 8.4307 8.4307 8.4598 8.4598 10.0595 10.0595 10.0964 10.0964 k = 0.5000 0.5000 0.4630 ( 7624 PWs) bands (ev): -57.7700 -57.7700 -32.1731 -32.1731 -31.3457 -31.3457 -31.3457 -31.3457 -4.4045 -4.4045 -4.3995 -4.3995 -4.3989 -4.3989 -4.3571 -4.3571 1.5741 1.5741 1.6060 1.6060 1.6132 1.6132 1.9915 1.9915 3.3056 3.3056 3.3064 3.3064 3.3182 3.3182 3.3426 3.3426 3.3510 3.3510 3.6010 3.6010 3.6029 3.6029 3.6168 3.6168 3.9954 3.9954 4.0806 4.0806 4.1921 4.1921 4.2082 4.2082 4.2631 4.2631 4.2669 4.2669 4.4379 4.4379 5.2454 5.2454 5.2659 5.2659 5.2872 5.2872 5.3591 5.3591 5.3864 5.3864 6.5985 6.5985 6.8644 6.8644 6.8827 6.8827 8.1287 8.1287 8.1829 8.1829 8.2197 8.2197 8.4365 8.4365 8.4577 8.4577 10.0414 10.0414 10.0674 10.0674 k = 0.5000 0.5000 0.4815 ( 7656 PWs) bands (ev): -57.7700 -57.7700 -32.1731 -32.1731 -31.3457 -31.3457 -31.3457 -31.3457 -4.4005 -4.4005 -4.3990 -4.3990 -4.3985 -4.3985 -4.3605 -4.3605 1.5698 1.5698 1.6034 1.6034 1.6070 1.6070 1.9868 1.9868 3.3081 3.3081 3.3082 3.3082 3.3198 3.3198 3.3441 3.3441 3.3480 3.3480 3.6024 3.6024 3.6031 3.6031 3.6168 3.6168 3.9947 3.9947 4.0805 4.0805 4.1963 4.1963 4.2044 4.2044 4.2640 4.2640 4.2659 4.2659 4.4371 4.4371 5.2538 5.2538 5.2632 5.2632 5.2863 5.2863 5.3648 5.3648 5.3790 5.3790 6.6085 6.6085 6.8814 6.8814 6.8892 6.8892 8.1610 8.1610 8.1821 8.1821 8.2070 8.2070 8.4420 8.4420 8.4533 8.4533 10.0333 10.0333 10.0466 10.0466 k = 0.5000 0.5000 0.5000 ( 7664 PWs) bands (ev): -57.7700 -57.7700 -32.1731 -32.1731 -31.3457 -31.3457 -31.3457 -31.3457 -4.3994 -4.3994 -4.3984 -4.3984 -4.3984 -4.3984 -4.3618 -4.3618 1.5683 1.5683 1.6037 1.6037 1.6037 1.6037 1.9853 1.9853 3.3089 3.3089 3.3089 3.3089 3.3203 3.3203 3.3458 3.3458 3.3458 3.3458 3.6030 3.6030 3.6030 3.6030 3.6168 3.6168 3.9945 3.9945 4.0805 4.0805 4.2004 4.2004 4.2004 4.2004 4.2649 4.2649 4.2649 4.2649 4.4368 4.4368 5.2595 5.2595 5.2595 5.2595 5.2860 5.2860 5.3717 5.3717 5.3717 5.3717 6.6119 6.6119 6.8893 6.8893 6.8893 6.8893 8.1818 8.1818 8.1818 8.1818 8.1930 8.1930 8.4478 8.4478 8.4478 8.4478 10.0351 10.0351 10.0351 10.0351 Writing output data file VCu3Te4.save init_run : 3.96s CPU 11.28s WALL ( 1 calls) electrons : 1620.19s CPU 1638.87s WALL ( 1 calls) Called by init_run: wfcinit : 0.00s CPU 0.00s WALL ( 1 calls) potinit : 0.46s CPU 1.53s WALL ( 1 calls) Called by electrons: c_bands : 1620.17s CPU 1638.54s WALL ( 1 calls) v_of_rho : 0.12s CPU 0.96s WALL ( 1 calls) v_h : 0.00s CPU 0.01s WALL ( 1 calls) v_xc : 0.11s CPU 0.57s WALL ( 1 calls) newd : 1.05s CPU 1.32s WALL ( 1 calls) Called by c_bands: init_us_2 : 0.03s CPU 0.11s WALL ( 210 calls) cegterg : 1528.90s CPU 1542.76s WALL ( 633 calls) Called by sum_band: Called by *egterg: h_psi : 703.34s CPU 715.32s WALL ( 11844 calls) s_psi : 54.05s CPU 54.13s WALL ( 11844 calls) g_psi : 1.37s CPU 1.34s WALL ( 11001 calls) cdiaghg : 582.49s CPU 580.74s WALL ( 11211 calls) cegterg:over : 122.23s CPU 119.48s WALL ( 11001 calls) cegterg:upda : 42.56s CPU 45.08s WALL ( 11001 calls) cegterg:last : 32.54s CPU 32.96s WALL ( 1466 calls) Called by h_psi: h_psi:vloc : 580.29s CPU 589.98s WALL ( 11844 calls) h_psi:vnl : 122.19s CPU 123.78s WALL ( 11844 calls) add_vuspsi : 46.58s CPU 49.94s WALL ( 11844 calls) General routines calbec : 75.57s CPU 73.73s WALL ( 11844 calls) fft : 0.40s CPU 1.17s WALL ( 19 calls) ffts : 0.01s CPU 0.02s WALL ( 4 calls) fftw : 536.96s CPU 543.94s WALL ( 1395312 calls) interpolate : 0.04s CPU 0.06s WALL ( 4 calls) davcio : 0.02s CPU 3.00s WALL ( 420 calls) Parallel routines fft_scatter : 353.79s CPU 354.98s WALL ( 1395335 calls) PWSCF : 28m16.31s CPU 30m28.75s WALL This run was terminated on: 7:12:55 2Nov2015 =------------------------------------------------------------------------------= JOB DONE. =------------------------------------------------------------------------------=