Program PWSCF v.5.1.1 starts on 2Nov2015 at 6:36:19 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: ./TaCu3Te4.save/ file Cu.rel-pbe-dn-rrkjus_psl.1.0.0.UPF: wavefunction(s) 3D renormalized Subspace diagonalization in iterative solution of the eigenvalue problem: a serial algorithm will be used Parallelization info -------------------- sticks: dense smooth PW G-vecs: dense smooth PW Min 54 38 10 2126 1220 184 Max 55 39 11 2133 1241 193 Sum 2637 1837 517 102255 59085 9045 bravais-lattice index = 14 lattice parameter (alat) = 11.2023 a.u. unit-cell volume = 1405.7921 (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 = 46.0000 Ry charge density cutoff = 265.0000 Ry Exchange-correlation = PBE ( 1 4 3 4 0 0) Non magnetic calculation with spin-orbit celldm(1)= 11.202296 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 Ta read from file: /home/autes/Pseudo/Ta.rel-pbe-spn-rrkjus_psl.1.0.0.UPF MD5 check sum: ce7a4fa75595c0f83f911fa846a48acf 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 1273 points, 10 beta functions with: l(1) = 0 l(2) = 0 l(3) = 1 l(4) = 1 l(5) = 1 l(6) = 1 l(7) = 2 l(8) = 2 l(9) = 2 l(10) = 2 Q(r) pseudized with 0 coefficients PseudoPot. # 2 for 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. # 3 for Cu read from file: /home/autes/Pseudo/Cu.rel-pbe-dn-rrkjus_psl.1.0.0.UPF MD5 check sum: bfb9b73be46f5385f72b338ff57911ad Pseudo is Ultrasoft + core correction, Zval = 11.0 Generated using "atomic" code by A. Dal Corso v.5.0.2 svn rev. 9656 Using radial grid of 1199 points, 10 beta functions with: l(1) = 0 l(2) = 0 l(3) = 1 l(4) = 1 l(5) = 1 l(6) = 1 l(7) = 2 l(8) = 2 l(9) = 2 l(10) = 2 Q(r) pseudized with 0 coefficients atomic species valence mass pseudopotential Ta 13.00 180.94790 Ta( 1.00) Te 6.00 127.60000 Te( 1.00) Cu 11.00 63.54600 Cu( 1.00) 24 Sym. Ops. (no inversion) found s frac. trans. isym = 1 identity cryst. s( 1) = ( 1 0 0 ) ( 0 1 0 ) ( 0 0 1 ) cart. s( 1) = ( 1.0000000 0.0000000 0.0000000 ) ( 0.0000000 1.0000000 0.0000000 ) ( 0.0000000 0.0000000 1.0000000 ) isym = 2 180 deg rotation - cart. axis [0,0,1] cryst. s( 2) = ( -1 0 0 ) ( 0 -1 0 ) ( 0 0 1 ) cart. s( 2) = ( -1.0000000 0.0000000 0.0000000 ) ( 0.0000000 -1.0000000 0.0000000 ) ( 0.0000000 0.0000000 1.0000000 ) isym = 3 180 deg rotation - cart. axis [0,1,0] cryst. s( 3) = ( -1 0 0 ) ( 0 1 0 ) ( 0 0 -1 ) cart. s( 3) = ( -1.0000000 0.0000000 -0.0000000 ) ( 0.0000000 1.0000000 -0.0000000 ) ( 0.0000000 0.0000000 -1.0000000 ) isym = 4 180 deg rotation - cart. axis [1,0,0] cryst. s( 4) = ( 1 0 0 ) ( 0 -1 0 ) ( 0 0 -1 ) cart. s( 4) = ( 1.0000000 -0.0000000 -0.0000000 ) ( 0.0000000 -1.0000000 0.0000000 ) ( 0.0000000 0.0000000 -1.0000000 ) isym = 5 120 deg rotation - cart. axis [-1,-1,-1] cryst. s( 5) = ( 0 0 1 ) ( 1 0 0 ) ( 0 1 0 ) cart. s( 5) = ( 0.0000000 1.0000000 -0.0000000 ) ( 0.0000000 -0.0000000 1.0000000 ) ( 1.0000000 -0.0000000 -0.0000000 ) isym = 6 120 deg rotation - cart. axis [-1,1,1] cryst. s( 6) = ( 0 0 -1 ) ( -1 0 0 ) ( 0 1 0 ) cart. s( 6) = ( -0.0000000 -1.0000000 0.0000000 ) ( -0.0000000 0.0000000 1.0000000 ) ( -1.0000000 0.0000000 0.0000000 ) isym = 7 120 deg rotation - cart. axis [1,1,-1] cryst. s( 7) = ( 0 0 -1 ) ( 1 0 0 ) ( 0 -1 0 ) cart. s( 7) = ( -0.0000000 1.0000000 -0.0000000 ) ( -0.0000000 0.0000000 -1.0000000 ) ( -1.0000000 0.0000000 0.0000000 ) isym = 8 120 deg rotation - cart. axis [1,-1,1] cryst. s( 8) = ( 0 0 1 ) ( -1 0 0 ) ( 0 -1 0 ) cart. s( 8) = ( 0.0000000 -1.0000000 -0.0000000 ) ( 0.0000000 -0.0000000 -1.0000000 ) ( 1.0000000 -0.0000000 -0.0000000 ) isym = 9 120 deg rotation - cart. axis [1,1,1] cryst. s( 9) = ( 0 1 0 ) ( 0 0 1 ) ( 1 0 0 ) cart. s( 9) = ( 0.0000000 0.0000000 1.0000000 ) ( 1.0000000 0.0000000 -0.0000000 ) ( 0.0000000 1.0000000 -0.0000000 ) isym = 10 120 deg rotation - cart. axis [-1,1,-1] cryst. s(10) = ( 0 -1 0 ) ( 0 0 -1 ) ( 1 0 0 ) cart. s(10) = ( -0.0000000 -0.0000000 1.0000000 ) ( -1.0000000 0.0000000 0.0000000 ) ( 0.0000000 -1.0000000 0.0000000 ) isym = 11 120 deg rotation - cart. axis [1,-1,-1] cryst. s(11) = ( 0 -1 0 ) ( 0 0 1 ) ( -1 0 0 ) cart. s(11) = ( -0.0000000 0.0000000 -1.0000000 ) ( -1.0000000 0.0000000 0.0000000 ) ( 0.0000000 1.0000000 -0.0000000 ) isym = 12 120 deg rotation - cart. axis [-1,-1,1] cryst. s(12) = ( 0 1 0 ) ( 0 0 -1 ) ( -1 0 0 ) cart. s(12) = ( 0.0000000 -0.0000000 -1.0000000 ) ( 1.0000000 -0.0000000 -0.0000000 ) ( 0.0000000 -1.0000000 0.0000000 ) isym = 13 inv. 180 deg rotation - cart. axis [1,1,0] cryst. s(13) = ( 0 -1 0 ) ( -1 0 0 ) ( 0 0 1 ) cart. s(13) = ( -0.0000000 -1.0000000 0.0000000 ) ( -1.0000000 0.0000000 0.0000000 ) ( 0.0000000 0.0000000 1.0000000 ) isym = 14 inv. 180 deg rotation - cart. axis [1,-1,0] cryst. s(14) = ( 0 1 0 ) ( 1 0 0 ) ( 0 0 1 ) cart. s(14) = ( 0.0000000 1.0000000 -0.0000000 ) ( 1.0000000 -0.0000000 0.0000000 ) ( 0.0000000 0.0000000 1.0000000 ) isym = 15 inv. 90 deg rotation - cart. axis [0,0,-1] cryst. s(15) = ( 0 1 0 ) ( -1 0 0 ) ( 0 0 -1 ) cart. s(15) = ( 0.0000000 -1.0000000 -0.0000000 ) ( 1.0000000 -0.0000000 -0.0000000 ) ( 0.0000000 0.0000000 -1.0000000 ) isym = 16 inv. 90 deg rotation - cart. axis [0,0,1] cryst. s(16) = ( 0 -1 0 ) ( 1 0 0 ) ( 0 0 -1 ) cart. s(16) = ( -0.0000000 1.0000000 -0.0000000 ) ( -1.0000000 0.0000000 -0.0000000 ) ( 0.0000000 0.0000000 -1.0000000 ) isym = 17 inv. 180 deg rotation - cart. axis [1,0,1] cryst. s(17) = ( 0 0 -1 ) ( 0 1 0 ) ( -1 0 0 ) cart. s(17) = ( -0.0000000 0.0000000 -1.0000000 ) ( -0.0000000 1.0000000 -0.0000000 ) ( -1.0000000 0.0000000 0.0000000 ) isym = 18 inv. 180 deg rotation - cart. axis [-1,0,1] cryst. s(18) = ( 0 0 1 ) ( 0 1 0 ) ( 1 0 0 ) cart. s(18) = ( 0.0000000 0.0000000 1.0000000 ) ( 0.0000000 1.0000000 -0.0000000 ) ( 1.0000000 -0.0000000 -0.0000000 ) isym = 19 inv. 90 deg rotation - cart. axis [0,1,0] cryst. s(19) = ( 0 0 1 ) ( 0 -1 0 ) ( -1 0 0 ) cart. s(19) = ( 0.0000000 -0.0000000 -1.0000000 ) ( 0.0000000 -1.0000000 0.0000000 ) ( 1.0000000 -0.0000000 -0.0000000 ) isym = 20 inv. 90 deg rotation - cart. axis [0,-1,0] cryst. s(20) = ( 0 0 -1 ) ( 0 -1 0 ) ( 1 0 0 ) cart. s(20) = ( -0.0000000 -0.0000000 1.0000000 ) ( -0.0000000 -1.0000000 0.0000000 ) ( -1.0000000 0.0000000 0.0000000 ) isym = 21 inv. 180 deg rotation - cart. axis [0,1,1] cryst. s(21) = ( 1 0 0 ) ( 0 0 -1 ) ( 0 -1 0 ) cart. s(21) = ( 1.0000000 -0.0000000 -0.0000000 ) ( 0.0000000 -0.0000000 -1.0000000 ) ( 0.0000000 -1.0000000 0.0000000 ) isym = 22 inv. 180 deg rotation - cart. axis [0,1,-1] cryst. s(22) = ( 1 0 0 ) ( 0 0 1 ) ( 0 1 0 ) cart. s(22) = ( 1.0000000 0.0000000 0.0000000 ) ( 0.0000000 0.0000000 1.0000000 ) ( 0.0000000 1.0000000 -0.0000000 ) isym = 23 inv. 90 deg rotation - cart. axis [-1,0,0] cryst. s(23) = ( -1 0 0 ) ( 0 0 1 ) ( 0 -1 0 ) cart. s(23) = ( -1.0000000 0.0000000 -0.0000000 ) ( 0.0000000 0.0000000 -1.0000000 ) ( 0.0000000 1.0000000 -0.0000000 ) isym = 24 inv. 90 deg rotation - cart. axis [1,0,0] cryst. s(24) = ( -1 0 0 ) ( 0 0 -1 ) ( 0 1 0 ) cart. s(24) = ( -1.0000000 0.0000000 0.0000000 ) ( 0.0000000 -0.0000000 1.0000000 ) ( 0.0000000 -1.0000000 0.0000000 ) double point group T_d (-43m) there are 8 classes and 3 irreducible representations the character table: E -E 8C3 -8C3 3C2 6s_d 6S4 -6S4 -3C2 -6s_d G_6 2.00 -2.00 1.00 -1.00 0.00 0.00 1.41 -1.41 G_7 2.00 -2.00 1.00 -1.00 0.00 0.00 -1.41 1.41 G_8 4.00 -4.00 -1.00 1.00 0.00 0.00 0.00 0.00 the symmetry operations in each class: E 1 3C2 -3C2 2 -2 3 -3 4 -4 8C3 5 7 8 6 12 9 10 11 6s_d -6s_d 13 -13 14 -14 17 -17 18 -18 21 -21 22 -22 6S4 15 16 20 19 23 24 -E -1 -8C3 -5 -7 -8 -6 -12 -9 -10 -11 -6S4 -15 -16 -20 -19 -23 -24 Cartesian axes number of k points= 209 Fermi-Dirac smearing, width (Ry)= 0.0010 cart. coord. in units 2pi/alat k( 1) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0047847 k( 2) = ( 0.0000000 0.0185185 -0.0000000), wk = 0.0047847 k( 3) = ( 0.0000000 0.0370370 -0.0000000), wk = 0.0047847 k( 4) = ( 0.0000000 0.0555556 -0.0000000), wk = 0.0047847 k( 5) = ( 0.0000000 0.0740741 -0.0000000), wk = 0.0047847 k( 6) = ( 0.0000000 0.0925926 -0.0000000), wk = 0.0047847 k( 7) = ( 0.0000000 0.1111111 -0.0000000), wk = 0.0047847 k( 8) = ( 0.0000000 0.1296296 -0.0000000), wk = 0.0047847 k( 9) = ( 0.0000000 0.1481482 -0.0000000), wk = 0.0047847 k( 10) = ( 0.0000000 0.1666667 -0.0000000), wk = 0.0047847 k( 11) = ( 0.0000000 0.1851852 -0.0000000), wk = 0.0047847 k( 12) = ( 0.0000000 0.2037037 -0.0000000), wk = 0.0047847 k( 13) = ( 0.0000000 0.2222222 -0.0000000), wk = 0.0047847 k( 14) = ( 0.0000000 0.2407407 -0.0000000), wk = 0.0047847 k( 15) = ( 0.0000000 0.2592593 -0.0000000), wk = 0.0047847 k( 16) = ( 0.0000000 0.2777778 -0.0000000), wk = 0.0047847 k( 17) = ( 0.0000000 0.2962963 -0.0000000), wk = 0.0047847 k( 18) = ( 0.0000000 0.3148148 -0.0000000), wk = 0.0047847 k( 19) = ( 0.0000000 0.3333333 -0.0000000), wk = 0.0047847 k( 20) = ( 0.0000000 0.3518519 -0.0000000), wk = 0.0047847 k( 21) = ( 0.0000000 0.3703704 -0.0000000), wk = 0.0047847 k( 22) = ( 0.0000000 0.3888889 -0.0000000), wk = 0.0047847 k( 23) = ( 0.0000000 0.4074074 -0.0000000), wk = 0.0047847 k( 24) = ( 0.0000000 0.4259259 -0.0000000), wk = 0.0047847 k( 25) = ( 0.0000000 0.4444444 -0.0000000), wk = 0.0047847 k( 26) = ( 0.0000000 0.4629630 -0.0000000), wk = 0.0047847 k( 27) = ( 0.0000000 0.4814815 -0.0000000), wk = 0.0047847 k( 28) = ( 0.0000000 0.5000000 -0.0000000), wk = 0.0047847 k( 29) = ( 0.0000000 0.5000000 -0.0000000), wk = 0.0047847 k( 30) = ( 0.0185185 0.5000000 -0.0000000), wk = 0.0047847 k( 31) = ( 0.0370370 0.5000000 -0.0000000), wk = 0.0047847 k( 32) = ( 0.0555556 0.5000000 -0.0000000), wk = 0.0047847 k( 33) = ( 0.0740741 0.5000000 -0.0000000), wk = 0.0047847 k( 34) = ( 0.0925926 0.5000000 -0.0000000), wk = 0.0047847 k( 35) = ( 0.1111111 0.5000000 -0.0000000), wk = 0.0047847 k( 36) = ( 0.1296296 0.5000000 -0.0000000), wk = 0.0047847 k( 37) = ( 0.1481482 0.5000000 -0.0000000), wk = 0.0047847 k( 38) = ( 0.1666667 0.5000000 -0.0000000), wk = 0.0047847 k( 39) = ( 0.1851852 0.5000000 -0.0000000), wk = 0.0047847 k( 40) = ( 0.2037037 0.5000000 -0.0000000), wk = 0.0047847 k( 41) = ( 0.2222222 0.5000000 -0.0000000), wk = 0.0047847 k( 42) = ( 0.2407407 0.5000000 -0.0000000), wk = 0.0047847 k( 43) = ( 0.2592593 0.5000000 -0.0000000), wk = 0.0047847 k( 44) = ( 0.2777778 0.5000000 -0.0000000), wk = 0.0047847 k( 45) = ( 0.2962963 0.5000000 -0.0000000), wk = 0.0047847 k( 46) = ( 0.3148148 0.5000000 -0.0000000), wk = 0.0047847 k( 47) = ( 0.3333333 0.5000000 -0.0000000), wk = 0.0047847 k( 48) = ( 0.3518519 0.5000000 -0.0000000), wk = 0.0047847 k( 49) = ( 0.3703704 0.5000000 -0.0000000), wk = 0.0047847 k( 50) = ( 0.3888889 0.5000000 -0.0000000), wk = 0.0047847 k( 51) = ( 0.4074074 0.5000000 -0.0000000), wk = 0.0047847 k( 52) = ( 0.4259259 0.5000000 -0.0000000), wk = 0.0047847 k( 53) = ( 0.4444444 0.5000000 -0.0000000), wk = 0.0047847 k( 54) = ( 0.4629630 0.5000000 -0.0000000), wk = 0.0047847 k( 55) = ( 0.4814815 0.5000000 -0.0000000), wk = 0.0047847 k( 56) = ( 0.5000000 0.5000000 -0.0000000), wk = 0.0047847 k( 57) = ( 0.5000000 0.5000000 -0.0000000), wk = 0.0047847 k( 58) = ( 0.4868421 0.4868421 -0.0000000), wk = 0.0047847 k( 59) = ( 0.4736842 0.4736842 -0.0000000), wk = 0.0047847 k( 60) = ( 0.4605263 0.4605263 -0.0000000), wk = 0.0047847 k( 61) = ( 0.4473684 0.4473684 -0.0000000), wk = 0.0047847 k( 62) = ( 0.4342105 0.4342105 -0.0000000), wk = 0.0047847 k( 63) = ( 0.4210526 0.4210526 -0.0000000), wk = 0.0047847 k( 64) = ( 0.4078947 0.4078947 -0.0000000), wk = 0.0047847 k( 65) = ( 0.3947368 0.3947368 -0.0000000), wk = 0.0047847 k( 66) = ( 0.3815789 0.3815789 -0.0000000), wk = 0.0047847 k( 67) = ( 0.3684211 0.3684210 -0.0000000), wk = 0.0047847 k( 68) = ( 0.3552632 0.3552632 -0.0000000), wk = 0.0047847 k( 69) = ( 0.3421053 0.3421053 -0.0000000), wk = 0.0047847 k( 70) = ( 0.3289474 0.3289474 -0.0000000), wk = 0.0047847 k( 71) = ( 0.3157895 0.3157895 -0.0000000), wk = 0.0047847 k( 72) = ( 0.3026316 0.3026316 -0.0000000), wk = 0.0047847 k( 73) = ( 0.2894737 0.2894737 -0.0000000), wk = 0.0047847 k( 74) = ( 0.2763158 0.2763158 -0.0000000), wk = 0.0047847 k( 75) = ( 0.2631579 0.2631579 -0.0000000), wk = 0.0047847 k( 76) = ( 0.2500000 0.2500000 -0.0000000), wk = 0.0047847 k( 77) = ( 0.2368421 0.2368421 -0.0000000), wk = 0.0047847 k( 78) = ( 0.2236842 0.2236842 -0.0000000), wk = 0.0047847 k( 79) = ( 0.2105263 0.2105263 -0.0000000), wk = 0.0047847 k( 80) = ( 0.1973684 0.1973684 -0.0000000), wk = 0.0047847 k( 81) = ( 0.1842105 0.1842105 -0.0000000), wk = 0.0047847 k( 82) = ( 0.1710526 0.1710526 -0.0000000), wk = 0.0047847 k( 83) = ( 0.1578947 0.1578947 -0.0000000), wk = 0.0047847 k( 84) = ( 0.1447368 0.1447368 -0.0000000), wk = 0.0047847 k( 85) = ( 0.1315790 0.1315790 -0.0000000), wk = 0.0047847 k( 86) = ( 0.1184210 0.1184210 -0.0000000), wk = 0.0047847 k( 87) = ( 0.1052632 0.1052632 -0.0000000), wk = 0.0047847 k( 88) = ( 0.0921053 0.0921053 -0.0000000), wk = 0.0047847 k( 89) = ( 0.0789474 0.0789474 -0.0000000), wk = 0.0047847 k( 90) = ( 0.0657895 0.0657895 -0.0000000), wk = 0.0047847 k( 91) = ( 0.0526316 0.0526316 -0.0000000), wk = 0.0047847 k( 92) = ( 0.0394737 0.0394737 -0.0000000), wk = 0.0047847 k( 93) = ( 0.0263158 0.0263158 -0.0000000), wk = 0.0047847 k( 94) = ( 0.0131579 0.0131579 -0.0000000), wk = 0.0047847 k( 95) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0047847 k( 96) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0047847 k( 97) = ( 0.0108696 0.0108696 0.0108696), wk = 0.0047847 k( 98) = ( 0.0217391 0.0217391 0.0217391), wk = 0.0047847 k( 99) = ( 0.0326087 0.0326087 0.0326087), wk = 0.0047847 k( 100) = ( 0.0434783 0.0434783 0.0434783), wk = 0.0047847 k( 101) = ( 0.0543478 0.0543478 0.0543478), wk = 0.0047847 k( 102) = ( 0.0652174 0.0652174 0.0652174), wk = 0.0047847 k( 103) = ( 0.0760870 0.0760870 0.0760870), wk = 0.0047847 k( 104) = ( 0.0869565 0.0869565 0.0869565), wk = 0.0047847 k( 105) = ( 0.0978261 0.0978261 0.0978261), wk = 0.0047847 k( 106) = ( 0.1086957 0.1086956 0.1086956), wk = 0.0047847 k( 107) = ( 0.1195652 0.1195652 0.1195652), wk = 0.0047847 k( 108) = ( 0.1304348 0.1304348 0.1304348), wk = 0.0047847 k( 109) = ( 0.1413043 0.1413043 0.1413043), wk = 0.0047847 k( 110) = ( 0.1521739 0.1521739 0.1521739), wk = 0.0047847 k( 111) = ( 0.1630435 0.1630435 0.1630435), wk = 0.0047847 k( 112) = ( 0.1739130 0.1739130 0.1739130), wk = 0.0047847 k( 113) = ( 0.1847826 0.1847826 0.1847826), wk = 0.0047847 k( 114) = ( 0.1956522 0.1956522 0.1956522), wk = 0.0047847 k( 115) = ( 0.2065217 0.2065217 0.2065217), wk = 0.0047847 k( 116) = ( 0.2173913 0.2173913 0.2173913), wk = 0.0047847 k( 117) = ( 0.2282609 0.2282609 0.2282609), wk = 0.0047847 k( 118) = ( 0.2391304 0.2391304 0.2391304), wk = 0.0047847 k( 119) = ( 0.2500000 0.2500000 0.2500000), wk = 0.0047847 k( 120) = ( 0.2608696 0.2608696 0.2608696), wk = 0.0047847 k( 121) = ( 0.2717391 0.2717391 0.2717391), wk = 0.0047847 k( 122) = ( 0.2826087 0.2826087 0.2826087), wk = 0.0047847 k( 123) = ( 0.2934783 0.2934783 0.2934783), wk = 0.0047847 k( 124) = ( 0.3043478 0.3043478 0.3043478), wk = 0.0047847 k( 125) = ( 0.3152174 0.3152174 0.3152174), wk = 0.0047847 k( 126) = ( 0.3260870 0.3260870 0.3260870), wk = 0.0047847 k( 127) = ( 0.3369565 0.3369565 0.3369565), wk = 0.0047847 k( 128) = ( 0.3478261 0.3478261 0.3478261), wk = 0.0047847 k( 129) = ( 0.3586956 0.3586956 0.3586956), wk = 0.0047847 k( 130) = ( 0.3695652 0.3695652 0.3695652), wk = 0.0047847 k( 131) = ( 0.3804348 0.3804348 0.3804348), wk = 0.0047847 k( 132) = ( 0.3913044 0.3913043 0.3913043), wk = 0.0047847 k( 133) = ( 0.4021739 0.4021739 0.4021739), wk = 0.0047847 k( 134) = ( 0.4130435 0.4130435 0.4130435), wk = 0.0047847 k( 135) = ( 0.4239130 0.4239130 0.4239130), wk = 0.0047847 k( 136) = ( 0.4347826 0.4347826 0.4347826), wk = 0.0047847 k( 137) = ( 0.4456522 0.4456522 0.4456522), wk = 0.0047847 k( 138) = ( 0.4565217 0.4565217 0.4565217), wk = 0.0047847 k( 139) = ( 0.4673913 0.4673913 0.4673913), wk = 0.0047847 k( 140) = ( 0.4782609 0.4782609 0.4782609), wk = 0.0047847 k( 141) = ( 0.4891304 0.4891304 0.4891304), wk = 0.0047847 k( 142) = ( 0.5000000 0.5000000 0.5000000), wk = 0.0047847 k( 143) = ( 0.5000000 0.5000000 0.5000000), wk = 0.0047847 k( 144) = ( 0.4868421 0.5000000 0.4868421), wk = 0.0047847 k( 145) = ( 0.4736842 0.5000000 0.4736842), wk = 0.0047847 k( 146) = ( 0.4605263 0.5000000 0.4605263), wk = 0.0047847 k( 147) = ( 0.4473684 0.5000000 0.4473684), wk = 0.0047847 k( 148) = ( 0.4342105 0.5000000 0.4342105), wk = 0.0047847 k( 149) = ( 0.4210526 0.5000000 0.4210526), wk = 0.0047847 k( 150) = ( 0.4078947 0.5000000 0.4078947), wk = 0.0047847 k( 151) = ( 0.3947368 0.5000000 0.3947368), wk = 0.0047847 k( 152) = ( 0.3815789 0.5000000 0.3815789), wk = 0.0047847 k( 153) = ( 0.3684211 0.5000000 0.3684210), wk = 0.0047847 k( 154) = ( 0.3552632 0.5000000 0.3552632), wk = 0.0047847 k( 155) = ( 0.3421053 0.5000000 0.3421053), wk = 0.0047847 k( 156) = ( 0.3289474 0.5000000 0.3289474), wk = 0.0047847 k( 157) = ( 0.3157895 0.5000000 0.3157895), wk = 0.0047847 k( 158) = ( 0.3026316 0.5000000 0.3026316), wk = 0.0047847 k( 159) = ( 0.2894737 0.5000000 0.2894737), wk = 0.0047847 k( 160) = ( 0.2763158 0.5000000 0.2763158), wk = 0.0047847 k( 161) = ( 0.2631579 0.5000000 0.2631579), wk = 0.0047847 k( 162) = ( 0.2500000 0.5000000 0.2500000), wk = 0.0047847 k( 163) = ( 0.2368421 0.5000000 0.2368421), wk = 0.0047847 k( 164) = ( 0.2236842 0.5000000 0.2236842), wk = 0.0047847 k( 165) = ( 0.2105263 0.5000000 0.2105263), wk = 0.0047847 k( 166) = ( 0.1973684 0.5000000 0.1973684), wk = 0.0047847 k( 167) = ( 0.1842105 0.5000000 0.1842105), wk = 0.0047847 k( 168) = ( 0.1710526 0.5000000 0.1710526), wk = 0.0047847 k( 169) = ( 0.1578947 0.5000000 0.1578947), wk = 0.0047847 k( 170) = ( 0.1447368 0.5000000 0.1447368), wk = 0.0047847 k( 171) = ( 0.1315790 0.5000000 0.1315789), wk = 0.0047847 k( 172) = ( 0.1184210 0.5000000 0.1184210), wk = 0.0047847 k( 173) = ( 0.1052632 0.5000000 0.1052632), wk = 0.0047847 k( 174) = ( 0.0921053 0.5000000 0.0921053), wk = 0.0047847 k( 175) = ( 0.0789474 0.5000000 0.0789474), wk = 0.0047847 k( 176) = ( 0.0657895 0.5000000 0.0657895), wk = 0.0047847 k( 177) = ( 0.0526316 0.5000000 0.0526316), wk = 0.0047847 k( 178) = ( 0.0394737 0.5000000 0.0394737), wk = 0.0047847 k( 179) = ( 0.0263158 0.5000000 0.0263158), wk = 0.0047847 k( 180) = ( 0.0131579 0.5000000 0.0131579), wk = 0.0047847 k( 181) = ( 0.0000000 0.5000000 -0.0000000), wk = 0.0047847 k( 182) = ( 0.5000000 0.5000000 -0.0000000), wk = 0.0047847 k( 183) = ( 0.5000000 0.5000000 0.0185185), wk = 0.0047847 k( 184) = ( 0.5000000 0.5000000 0.0370370), wk = 0.0047847 k( 185) = ( 0.5000000 0.5000000 0.0555556), wk = 0.0047847 k( 186) = ( 0.5000000 0.5000000 0.0740741), wk = 0.0047847 k( 187) = ( 0.5000000 0.5000000 0.0925926), wk = 0.0047847 k( 188) = ( 0.5000000 0.5000000 0.1111111), wk = 0.0047847 k( 189) = ( 0.5000000 0.5000000 0.1296296), wk = 0.0047847 k( 190) = ( 0.5000000 0.5000000 0.1481481), wk = 0.0047847 k( 191) = ( 0.5000000 0.5000000 0.1666667), wk = 0.0047847 k( 192) = ( 0.5000000 0.5000000 0.1851852), wk = 0.0047847 k( 193) = ( 0.5000000 0.5000000 0.2037037), wk = 0.0047847 k( 194) = ( 0.5000000 0.5000000 0.2222222), wk = 0.0047847 k( 195) = ( 0.5000000 0.5000000 0.2407407), wk = 0.0047847 k( 196) = ( 0.5000000 0.5000000 0.2592593), wk = 0.0047847 k( 197) = ( 0.5000000 0.5000000 0.2777778), wk = 0.0047847 k( 198) = ( 0.5000000 0.5000000 0.2962963), wk = 0.0047847 k( 199) = ( 0.5000000 0.5000000 0.3148148), wk = 0.0047847 k( 200) = ( 0.5000000 0.5000000 0.3333333), wk = 0.0047847 k( 201) = ( 0.5000000 0.5000000 0.3518518), wk = 0.0047847 k( 202) = ( 0.5000000 0.5000000 0.3703704), wk = 0.0047847 k( 203) = ( 0.5000000 0.5000000 0.3888889), wk = 0.0047847 k( 204) = ( 0.5000000 0.5000000 0.4074074), wk = 0.0047847 k( 205) = ( 0.5000000 0.5000000 0.4259259), wk = 0.0047847 k( 206) = ( 0.5000000 0.5000000 0.4444444), wk = 0.0047847 k( 207) = ( 0.5000000 0.5000000 0.4629630), wk = 0.0047847 k( 208) = ( 0.5000000 0.5000000 0.4814815), wk = 0.0047847 k( 209) = ( 0.5000000 0.5000000 0.5000000), wk = 0.0047847 cryst. coord. k( 1) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0047847 k( 2) = ( 0.0000000 0.0185185 0.0000000), wk = 0.0047847 k( 3) = ( 0.0000000 0.0370370 0.0000000), wk = 0.0047847 k( 4) = ( 0.0000000 0.0555556 0.0000000), wk = 0.0047847 k( 5) = ( 0.0000000 0.0740741 0.0000000), wk = 0.0047847 k( 6) = ( 0.0000000 0.0925926 0.0000000), wk = 0.0047847 k( 7) = ( 0.0000000 0.1111111 0.0000000), wk = 0.0047847 k( 8) = ( 0.0000000 0.1296296 0.0000000), wk = 0.0047847 k( 9) = ( 0.0000000 0.1481482 0.0000000), wk = 0.0047847 k( 10) = ( 0.0000000 0.1666667 0.0000000), wk = 0.0047847 k( 11) = ( 0.0000000 0.1851852 0.0000000), wk = 0.0047847 k( 12) = ( 0.0000000 0.2037037 0.0000000), wk = 0.0047847 k( 13) = ( 0.0000000 0.2222222 0.0000000), wk = 0.0047847 k( 14) = ( 0.0000000 0.2407407 0.0000000), wk = 0.0047847 k( 15) = ( 0.0000000 0.2592593 0.0000000), wk = 0.0047847 k( 16) = ( 0.0000000 0.2777778 0.0000000), wk = 0.0047847 k( 17) = ( 0.0000000 0.2962963 0.0000000), wk = 0.0047847 k( 18) = ( 0.0000000 0.3148148 0.0000000), wk = 0.0047847 k( 19) = ( 0.0000000 0.3333333 0.0000000), wk = 0.0047847 k( 20) = ( 0.0000000 0.3518519 0.0000000), wk = 0.0047847 k( 21) = ( 0.0000000 0.3703704 0.0000000), wk = 0.0047847 k( 22) = ( 0.0000000 0.3888889 0.0000000), wk = 0.0047847 k( 23) = ( 0.0000000 0.4074074 0.0000000), wk = 0.0047847 k( 24) = ( 0.0000000 0.4259259 0.0000000), wk = 0.0047847 k( 25) = ( 0.0000000 0.4444444 0.0000000), wk = 0.0047847 k( 26) = ( 0.0000000 0.4629630 0.0000000), wk = 0.0047847 k( 27) = ( 0.0000000 0.4814815 0.0000000), wk = 0.0047847 k( 28) = ( 0.0000000 0.5000000 0.0000000), wk = 0.0047847 k( 29) = ( 0.0000000 0.5000000 0.0000000), wk = 0.0047847 k( 30) = ( 0.0185185 0.5000000 0.0000000), wk = 0.0047847 k( 31) = ( 0.0370370 0.5000000 0.0000000), wk = 0.0047847 k( 32) = ( 0.0555556 0.5000000 0.0000000), wk = 0.0047847 k( 33) = ( 0.0740741 0.5000000 0.0000000), wk = 0.0047847 k( 34) = ( 0.0925926 0.5000000 0.0000000), wk = 0.0047847 k( 35) = ( 0.1111111 0.5000000 0.0000000), wk = 0.0047847 k( 36) = ( 0.1296296 0.5000000 0.0000000), wk = 0.0047847 k( 37) = ( 0.1481482 0.5000000 0.0000000), wk = 0.0047847 k( 38) = ( 0.1666667 0.5000000 0.0000000), wk = 0.0047847 k( 39) = ( 0.1851852 0.5000000 0.0000000), wk = 0.0047847 k( 40) = ( 0.2037037 0.5000000 0.0000000), wk = 0.0047847 k( 41) = ( 0.2222222 0.5000000 0.0000000), wk = 0.0047847 k( 42) = ( 0.2407407 0.5000000 0.0000000), wk = 0.0047847 k( 43) = ( 0.2592593 0.5000000 0.0000000), wk = 0.0047847 k( 44) = ( 0.2777778 0.5000000 0.0000000), wk = 0.0047847 k( 45) = ( 0.2962963 0.5000000 0.0000000), wk = 0.0047847 k( 46) = ( 0.3148148 0.5000000 0.0000000), wk = 0.0047847 k( 47) = ( 0.3333333 0.5000000 0.0000000), wk = 0.0047847 k( 48) = ( 0.3518519 0.5000000 0.0000000), wk = 0.0047847 k( 49) = ( 0.3703704 0.5000000 0.0000000), wk = 0.0047847 k( 50) = ( 0.3888889 0.5000000 0.0000000), wk = 0.0047847 k( 51) = ( 0.4074074 0.5000000 0.0000000), wk = 0.0047847 k( 52) = ( 0.4259259 0.5000000 0.0000000), wk = 0.0047847 k( 53) = ( 0.4444444 0.5000000 0.0000000), wk = 0.0047847 k( 54) = ( 0.4629630 0.5000000 0.0000000), wk = 0.0047847 k( 55) = ( 0.4814815 0.5000000 0.0000000), wk = 0.0047847 k( 56) = ( 0.5000000 0.5000000 0.0000000), wk = 0.0047847 k( 57) = ( 0.5000000 0.5000000 0.0000000), wk = 0.0047847 k( 58) = ( 0.4868421 0.4868421 0.0000000), wk = 0.0047847 k( 59) = ( 0.4736842 0.4736842 0.0000000), wk = 0.0047847 k( 60) = ( 0.4605263 0.4605263 0.0000000), wk = 0.0047847 k( 61) = ( 0.4473684 0.4473684 0.0000000), wk = 0.0047847 k( 62) = ( 0.4342105 0.4342105 0.0000000), wk = 0.0047847 k( 63) = ( 0.4210526 0.4210526 0.0000000), wk = 0.0047847 k( 64) = ( 0.4078947 0.4078947 0.0000000), wk = 0.0047847 k( 65) = ( 0.3947368 0.3947368 0.0000000), wk = 0.0047847 k( 66) = ( 0.3815789 0.3815789 0.0000000), wk = 0.0047847 k( 67) = ( 0.3684211 0.3684211 0.0000000), wk = 0.0047847 k( 68) = ( 0.3552632 0.3552632 0.0000000), wk = 0.0047847 k( 69) = ( 0.3421053 0.3421053 0.0000000), wk = 0.0047847 k( 70) = ( 0.3289474 0.3289474 0.0000000), wk = 0.0047847 k( 71) = ( 0.3157895 0.3157895 0.0000000), wk = 0.0047847 k( 72) = ( 0.3026316 0.3026316 -0.0000000), wk = 0.0047847 k( 73) = ( 0.2894737 0.2894737 0.0000000), wk = 0.0047847 k( 74) = ( 0.2763158 0.2763158 0.0000000), wk = 0.0047847 k( 75) = ( 0.2631579 0.2631579 0.0000000), wk = 0.0047847 k( 76) = ( 0.2500000 0.2500000 0.0000000), wk = 0.0047847 k( 77) = ( 0.2368421 0.2368421 0.0000000), wk = 0.0047847 k( 78) = ( 0.2236842 0.2236842 0.0000000), wk = 0.0047847 k( 79) = ( 0.2105263 0.2105263 0.0000000), wk = 0.0047847 k( 80) = ( 0.1973684 0.1973684 0.0000000), wk = 0.0047847 k( 81) = ( 0.1842105 0.1842105 0.0000000), wk = 0.0047847 k( 82) = ( 0.1710526 0.1710526 0.0000000), wk = 0.0047847 k( 83) = ( 0.1578947 0.1578947 0.0000000), wk = 0.0047847 k( 84) = ( 0.1447368 0.1447368 0.0000000), wk = 0.0047847 k( 85) = ( 0.1315790 0.1315790 0.0000000), wk = 0.0047847 k( 86) = ( 0.1184210 0.1184210 0.0000000), wk = 0.0047847 k( 87) = ( 0.1052632 0.1052632 0.0000000), wk = 0.0047847 k( 88) = ( 0.0921053 0.0921053 0.0000000), wk = 0.0047847 k( 89) = ( 0.0789474 0.0789474 0.0000000), wk = 0.0047847 k( 90) = ( 0.0657895 0.0657895 0.0000000), wk = 0.0047847 k( 91) = ( 0.0526316 0.0526316 0.0000000), wk = 0.0047847 k( 92) = ( 0.0394737 0.0394737 0.0000000), wk = 0.0047847 k( 93) = ( 0.0263158 0.0263158 0.0000000), wk = 0.0047847 k( 94) = ( 0.0131579 0.0131579 0.0000000), wk = 0.0047847 k( 95) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0047847 k( 96) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0047847 k( 97) = ( 0.0108696 0.0108696 0.0108696), wk = 0.0047847 k( 98) = ( 0.0217391 0.0217391 0.0217391), wk = 0.0047847 k( 99) = ( 0.0326087 0.0326087 0.0326087), wk = 0.0047847 k( 100) = ( 0.0434783 0.0434783 0.0434783), wk = 0.0047847 k( 101) = ( 0.0543478 0.0543478 0.0543478), wk = 0.0047847 k( 102) = ( 0.0652174 0.0652174 0.0652174), wk = 0.0047847 k( 103) = ( 0.0760870 0.0760870 0.0760870), wk = 0.0047847 k( 104) = ( 0.0869565 0.0869565 0.0869565), wk = 0.0047847 k( 105) = ( 0.0978261 0.0978261 0.0978261), wk = 0.0047847 k( 106) = ( 0.1086957 0.1086957 0.1086957), wk = 0.0047847 k( 107) = ( 0.1195652 0.1195652 0.1195652), wk = 0.0047847 k( 108) = ( 0.1304348 0.1304348 0.1304348), wk = 0.0047847 k( 109) = ( 0.1413043 0.1413043 0.1413043), wk = 0.0047847 k( 110) = ( 0.1521739 0.1521739 0.1521739), wk = 0.0047847 k( 111) = ( 0.1630435 0.1630435 0.1630435), wk = 0.0047847 k( 112) = ( 0.1739130 0.1739130 0.1739130), wk = 0.0047847 k( 113) = ( 0.1847826 0.1847826 0.1847826), wk = 0.0047847 k( 114) = ( 0.1956522 0.1956522 0.1956522), wk = 0.0047847 k( 115) = ( 0.2065217 0.2065217 0.2065217), wk = 0.0047847 k( 116) = ( 0.2173913 0.2173913 0.2173913), wk = 0.0047847 k( 117) = ( 0.2282609 0.2282609 0.2282609), wk = 0.0047847 k( 118) = ( 0.2391304 0.2391304 0.2391304), wk = 0.0047847 k( 119) = ( 0.2500000 0.2500000 0.2500000), wk = 0.0047847 k( 120) = ( 0.2608696 0.2608696 0.2608696), wk = 0.0047847 k( 121) = ( 0.2717391 0.2717391 0.2717391), wk = 0.0047847 k( 122) = ( 0.2826087 0.2826087 0.2826087), wk = 0.0047847 k( 123) = ( 0.2934783 0.2934783 0.2934783), wk = 0.0047847 k( 124) = ( 0.3043478 0.3043478 0.3043478), wk = 0.0047847 k( 125) = ( 0.3152174 0.3152174 0.3152174), wk = 0.0047847 k( 126) = ( 0.3260870 0.3260870 0.3260870), wk = 0.0047847 k( 127) = ( 0.3369565 0.3369565 0.3369565), wk = 0.0047847 k( 128) = ( 0.3478261 0.3478261 0.3478261), wk = 0.0047847 k( 129) = ( 0.3586956 0.3586956 0.3586956), wk = 0.0047847 k( 130) = ( 0.3695652 0.3695652 0.3695652), wk = 0.0047847 k( 131) = ( 0.3804348 0.3804348 0.3804348), wk = 0.0047847 k( 132) = ( 0.3913044 0.3913044 0.3913044), wk = 0.0047847 k( 133) = ( 0.4021739 0.4021739 0.4021739), wk = 0.0047847 k( 134) = ( 0.4130435 0.4130435 0.4130435), wk = 0.0047847 k( 135) = ( 0.4239130 0.4239130 0.4239130), wk = 0.0047847 k( 136) = ( 0.4347826 0.4347826 0.4347826), wk = 0.0047847 k( 137) = ( 0.4456522 0.4456522 0.4456522), wk = 0.0047847 k( 138) = ( 0.4565217 0.4565217 0.4565217), wk = 0.0047847 k( 139) = ( 0.4673913 0.4673913 0.4673913), wk = 0.0047847 k( 140) = ( 0.4782609 0.4782609 0.4782609), wk = 0.0047847 k( 141) = ( 0.4891304 0.4891304 0.4891304), wk = 0.0047847 k( 142) = ( 0.5000000 0.5000000 0.5000000), wk = 0.0047847 k( 143) = ( 0.5000000 0.5000000 0.5000000), wk = 0.0047847 k( 144) = ( 0.4868421 0.5000000 0.4868421), wk = 0.0047847 k( 145) = ( 0.4736842 0.5000000 0.4736842), wk = 0.0047847 k( 146) = ( 0.4605263 0.5000000 0.4605263), wk = 0.0047847 k( 147) = ( 0.4473684 0.5000000 0.4473684), wk = 0.0047847 k( 148) = ( 0.4342105 0.5000000 0.4342105), wk = 0.0047847 k( 149) = ( 0.4210526 0.5000000 0.4210526), wk = 0.0047847 k( 150) = ( 0.4078947 0.5000000 0.4078947), wk = 0.0047847 k( 151) = ( 0.3947368 0.5000000 0.3947368), wk = 0.0047847 k( 152) = ( 0.3815789 0.5000000 0.3815789), wk = 0.0047847 k( 153) = ( 0.3684211 0.5000000 0.3684211), wk = 0.0047847 k( 154) = ( 0.3552632 0.5000000 0.3552632), wk = 0.0047847 k( 155) = ( 0.3421053 0.5000000 0.3421053), wk = 0.0047847 k( 156) = ( 0.3289474 0.5000000 0.3289474), wk = 0.0047847 k( 157) = ( 0.3157895 0.5000000 0.3157895), wk = 0.0047847 k( 158) = ( 0.3026316 0.5000000 0.3026316), wk = 0.0047847 k( 159) = ( 0.2894737 0.5000000 0.2894737), wk = 0.0047847 k( 160) = ( 0.2763158 0.5000000 0.2763158), wk = 0.0047847 k( 161) = ( 0.2631579 0.5000000 0.2631579), wk = 0.0047847 k( 162) = ( 0.2500000 0.5000000 0.2500000), wk = 0.0047847 k( 163) = ( 0.2368421 0.5000000 0.2368421), wk = 0.0047847 k( 164) = ( 0.2236842 0.5000000 0.2236842), wk = 0.0047847 k( 165) = ( 0.2105263 0.5000000 0.2105263), wk = 0.0047847 k( 166) = ( 0.1973684 0.5000000 0.1973684), wk = 0.0047847 k( 167) = ( 0.1842105 0.5000000 0.1842105), wk = 0.0047847 k( 168) = ( 0.1710526 0.5000000 0.1710526), wk = 0.0047847 k( 169) = ( 0.1578947 0.5000000 0.1578947), wk = 0.0047847 k( 170) = ( 0.1447368 0.5000000 0.1447368), wk = 0.0047847 k( 171) = ( 0.1315790 0.5000000 0.1315790), wk = 0.0047847 k( 172) = ( 0.1184210 0.5000000 0.1184210), wk = 0.0047847 k( 173) = ( 0.1052632 0.5000000 0.1052632), wk = 0.0047847 k( 174) = ( 0.0921053 0.5000000 0.0921053), wk = 0.0047847 k( 175) = ( 0.0789474 0.5000000 0.0789474), wk = 0.0047847 k( 176) = ( 0.0657895 0.5000000 0.0657895), wk = 0.0047847 k( 177) = ( 0.0526316 0.5000000 0.0526316), wk = 0.0047847 k( 178) = ( 0.0394737 0.5000000 0.0394737), wk = 0.0047847 k( 179) = ( 0.0263158 0.5000000 0.0263158), wk = 0.0047847 k( 180) = ( 0.0131579 0.5000000 0.0131579), wk = 0.0047847 k( 181) = ( 0.0000000 0.5000000 0.0000000), wk = 0.0047847 k( 182) = ( 0.5000000 0.5000000 0.0000000), wk = 0.0047847 k( 183) = ( 0.5000000 0.5000000 0.0185185), wk = 0.0047847 k( 184) = ( 0.5000000 0.5000000 0.0370370), wk = 0.0047847 k( 185) = ( 0.5000000 0.5000000 0.0555556), wk = 0.0047847 k( 186) = ( 0.5000000 0.5000000 0.0740741), wk = 0.0047847 k( 187) = ( 0.5000000 0.5000000 0.0925926), wk = 0.0047847 k( 188) = ( 0.5000000 0.5000000 0.1111111), wk = 0.0047847 k( 189) = ( 0.5000000 0.5000000 0.1296296), wk = 0.0047847 k( 190) = ( 0.5000000 0.5000000 0.1481482), wk = 0.0047847 k( 191) = ( 0.5000000 0.5000000 0.1666667), wk = 0.0047847 k( 192) = ( 0.5000000 0.5000000 0.1851852), wk = 0.0047847 k( 193) = ( 0.5000000 0.5000000 0.2037037), wk = 0.0047847 k( 194) = ( 0.5000000 0.5000000 0.2222222), wk = 0.0047847 k( 195) = ( 0.5000000 0.5000000 0.2407407), wk = 0.0047847 k( 196) = ( 0.5000000 0.5000000 0.2592593), wk = 0.0047847 k( 197) = ( 0.5000000 0.5000000 0.2777778), wk = 0.0047847 k( 198) = ( 0.5000000 0.5000000 0.2962963), wk = 0.0047847 k( 199) = ( 0.5000000 0.5000000 0.3148148), wk = 0.0047847 k( 200) = ( 0.5000000 0.5000000 0.3333333), wk = 0.0047847 k( 201) = ( 0.5000000 0.5000000 0.3518519), wk = 0.0047847 k( 202) = ( 0.5000000 0.5000000 0.3703704), wk = 0.0047847 k( 203) = ( 0.5000000 0.5000000 0.3888889), wk = 0.0047847 k( 204) = ( 0.5000000 0.5000000 0.4074074), wk = 0.0047847 k( 205) = ( 0.5000000 0.5000000 0.4259259), wk = 0.0047847 k( 206) = ( 0.5000000 0.5000000 0.4444444), wk = 0.0047847 k( 207) = ( 0.5000000 0.5000000 0.4629630), wk = 0.0047847 k( 208) = ( 0.5000000 0.5000000 0.4814815), wk = 0.0047847 k( 209) = ( 0.5000000 0.5000000 0.5000000), wk = 0.0047847 Dense grid: 102255 G-vectors FFT dimensions: ( 60, 60, 60) Smooth grid: 59085 G-vectors FFT dimensions: ( 50, 50, 50) Largest allocated arrays est. size (Mb) dimensions Kohn-Sham Wavefunctions 0.41 Mb ( 316, 84) NL pseudopotentials 0.48 Mb ( 158, 200) Each V/rho on FFT grid 0.11 Mb ( 7200) Each G-vector array 0.02 Mb ( 2133) G-vector shells 0.00 Mb ( 523) Largest temporary arrays est. size (Mb) dimensions Auxiliary wavefunctions 1.62 Mb ( 316, 336) Each subspace H/S matrix 1.72 Mb ( 336, 336) Each matrix 0.51 Mb ( 200, 2, 84) Check: negative/imaginary core charge= -0.000005 0.000000 The potential is recalculated from file : ./TaCu3Te4.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 47.9 secs Computing kpt #: 2 total cpu time spent up to now is 52.6 secs Computing kpt #: 3 total cpu time spent up to now is 57.7 secs Computing kpt #: 4 total cpu time spent up to now is 62.6 secs Computing kpt #: 5 total cpu time spent up to now is 69.4 secs Computing kpt #: 6 total cpu time spent up to now is 74.5 secs Computing kpt #: 7 total cpu time spent up to now is 82.2 secs Computing kpt #: 8 total cpu time spent up to now is 87.3 secs Computing kpt #: 9 total cpu time spent up to now is 92.5 secs Computing kpt #: 10 total cpu time spent up to now is 97.9 secs Computing kpt #: 11 total cpu time spent up to now is 105.0 secs Computing kpt #: 12 total cpu time spent up to now is 110.3 secs Computing kpt #: 13 total cpu time spent up to now is 117.7 secs Computing kpt #: 14 total cpu time spent up to now is 122.8 secs Computing kpt #: 15 total cpu time spent up to now is 129.6 secs Computing kpt #: 16 total cpu time spent up to now is 134.5 secs Computing kpt #: 17 total cpu time spent up to now is 140.3 secs Computing kpt #: 18 total cpu time spent up to now is 146.0 secs Computing kpt #: 19 total cpu time spent up to now is 150.8 secs Computing kpt #: 20 total cpu time spent up to now is 156.1 secs Computing kpt #: 21 total cpu time spent up to now is 162.5 secs Computing kpt #: 22 total cpu time spent up to now is 167.1 secs Computing kpt #: 23 total cpu time spent up to now is 173.2 secs Computing kpt #: 24 total cpu time spent up to now is 179.1 secs Computing kpt #: 25 total cpu time spent up to now is 184.3 secs Computing kpt #: 26 total cpu time spent up to now is 189.6 secs Computing kpt #: 27 total cpu time spent up to now is 196.4 secs Computing kpt #: 28 total cpu time spent up to now is 200.9 secs Computing kpt #: 29 total cpu time spent up to now is 205.5 secs Computing kpt #: 30 total cpu time spent up to now is 211.2 secs Computing kpt #: 31 total cpu time spent up to now is 216.5 secs Computing kpt #: 32 total cpu time spent up to now is 221.2 secs Computing kpt #: 33 total cpu time spent up to now is 228.7 secs Computing kpt #: 34 total cpu time spent up to now is 233.4 secs Computing kpt #: 35 total cpu time spent up to now is 238.1 secs Computing kpt #: 36 total cpu time spent up to now is 245.0 secs Computing kpt #: 37 total cpu time spent up to now is 249.6 secs Computing kpt #: 38 total cpu time spent up to now is 254.4 secs Computing kpt #: 39 total cpu time spent up to now is 262.0 secs Computing kpt #: 40 total cpu time spent up to now is 267.1 secs Computing kpt #: 41 total cpu time spent up to now is 272.1 secs Computing kpt #: 42 total cpu time spent up to now is 277.0 secs Computing kpt #: 43 total cpu time spent up to now is 284.6 secs Computing kpt #: 44 total cpu time spent up to now is 289.5 secs Computing kpt #: 45 total cpu time spent up to now is 294.4 secs Computing kpt #: 46 total cpu time spent up to now is 301.9 secs Computing kpt #: 47 total cpu time spent up to now is 306.7 secs Computing kpt #: 48 total cpu time spent up to now is 311.6 secs Computing kpt #: 49 total cpu time spent up to now is 318.1 secs Computing kpt #: 50 total cpu time spent up to now is 323.8 secs Computing kpt #: 51 total cpu time spent up to now is 328.4 secs Computing kpt #: 52 total cpu time spent up to now is 334.4 secs Computing kpt #: 53 total cpu time spent up to now is 339.1 secs Computing kpt #: 54 total cpu time spent up to now is 345.8 secs Computing kpt #: 55 total cpu time spent up to now is 350.3 secs Computing kpt #: 56 total cpu time spent up to now is 356.9 secs Computing kpt #: 57 total cpu time spent up to now is 361.6 secs Computing kpt #: 58 total cpu time spent up to now is 366.2 secs Computing kpt #: 59 total cpu time spent up to now is 371.9 secs Computing kpt #: 60 total cpu time spent up to now is 377.8 secs Computing kpt #: 61 total cpu time spent up to now is 382.4 secs Computing kpt #: 62 total cpu time spent up to now is 388.7 secs Computing kpt #: 63 total cpu time spent up to now is 394.5 secs Computing kpt #: 64 total cpu time spent up to now is 399.5 secs Computing kpt #: 65 total cpu time spent up to now is 404.4 secs Computing kpt #: 66 total cpu time spent up to now is 410.0 secs Computing kpt #: 67 total cpu time spent up to now is 415.9 secs Computing kpt #: 68 total cpu time spent up to now is 421.6 secs Computing kpt #: 69 total cpu time spent up to now is 427.6 secs Computing kpt #: 70 total cpu time spent up to now is 433.1 secs Computing kpt #: 71 total cpu time spent up to now is 438.5 secs Computing kpt #: 72 total cpu time spent up to now is 444.0 secs Computing kpt #: 73 total cpu time spent up to now is 449.3 secs Computing kpt #: 74 total cpu time spent up to now is 454.7 secs Computing kpt #: 75 total cpu time spent up to now is 460.1 secs Computing kpt #: 76 total cpu time spent up to now is 465.5 secs Computing kpt #: 77 total cpu time spent up to now is 470.9 secs Computing kpt #: 78 total cpu time spent up to now is 476.2 secs Computing kpt #: 79 total cpu time spent up to now is 482.8 secs Computing kpt #: 80 total cpu time spent up to now is 489.1 secs Computing kpt #: 81 total cpu time spent up to now is 494.3 secs Computing kpt #: 82 total cpu time spent up to now is 499.6 secs Computing kpt #: 83 total cpu time spent up to now is 505.0 secs Computing kpt #: 84 total cpu time spent up to now is 510.2 secs Computing kpt #: 85 total cpu time spent up to now is 515.5 secs Computing kpt #: 86 total cpu time spent up to now is 520.7 secs Computing kpt #: 87 total cpu time spent up to now is 525.9 secs Computing kpt #: 88 total cpu time spent up to now is 531.1 secs Computing kpt #: 89 total cpu time spent up to now is 536.4 secs Computing kpt #: 90 total cpu time spent up to now is 541.4 secs Computing kpt #: 91 total cpu time spent up to now is 546.2 secs Computing kpt #: 92 total cpu time spent up to now is 551.0 secs Computing kpt #: 93 total cpu time spent up to now is 555.8 secs Computing kpt #: 94 total cpu time spent up to now is 560.6 secs Computing kpt #: 95 total cpu time spent up to now is 565.1 secs Computing kpt #: 96 total cpu time spent up to now is 569.8 secs Computing kpt #: 97 total cpu time spent up to now is 574.5 secs Computing kpt #: 98 total cpu time spent up to now is 579.3 secs Computing kpt #: 99 total cpu time spent up to now is 584.1 secs Computing kpt #: 100 total cpu time spent up to now is 589.4 secs Computing kpt #: 101 total cpu time spent up to now is 594.6 secs Computing kpt #: 102 total cpu time spent up to now is 599.8 secs Computing kpt #: 103 total cpu time spent up to now is 604.9 secs Computing kpt #: 104 total cpu time spent up to now is 610.0 secs Computing kpt #: 105 total cpu time spent up to now is 615.2 secs Computing kpt #: 106 total cpu time spent up to now is 620.4 secs Computing kpt #: 107 total cpu time spent up to now is 625.5 secs Computing kpt #: 108 total cpu time spent up to now is 630.7 secs Computing kpt #: 109 total cpu time spent up to now is 635.8 secs Computing kpt #: 110 total cpu time spent up to now is 640.9 secs Computing kpt #: 111 total cpu time spent up to now is 646.4 secs Computing kpt #: 112 total cpu time spent up to now is 651.6 secs Computing kpt #: 113 total cpu time spent up to now is 656.8 secs Computing kpt #: 114 total cpu time spent up to now is 662.0 secs Computing kpt #: 115 total cpu time spent up to now is 667.3 secs Computing kpt #: 116 total cpu time spent up to now is 672.7 secs Computing kpt #: 117 total cpu time spent up to now is 678.0 secs Computing kpt #: 118 total cpu time spent up to now is 683.3 secs Computing kpt #: 119 total cpu time spent up to now is 688.5 secs Computing kpt #: 120 total cpu time spent up to now is 693.8 secs Computing kpt #: 121 total cpu time spent up to now is 699.0 secs Computing kpt #: 122 total cpu time spent up to now is 704.3 secs Computing kpt #: 123 total cpu time spent up to now is 709.5 secs Computing kpt #: 124 total cpu time spent up to now is 714.7 secs Computing kpt #: 125 total cpu time spent up to now is 719.7 secs Computing kpt #: 126 total cpu time spent up to now is 724.8 secs Computing kpt #: 127 total cpu time spent up to now is 729.7 secs Computing kpt #: 128 total cpu time spent up to now is 734.6 secs Computing kpt #: 129 total cpu time spent up to now is 739.5 secs Computing kpt #: 130 total cpu time spent up to now is 744.3 secs Computing kpt #: 131 total cpu time spent up to now is 749.5 secs Computing kpt #: 132 total cpu time spent up to now is 754.3 secs Computing kpt #: 133 total cpu time spent up to now is 759.1 secs Computing kpt #: 134 total cpu time spent up to now is 764.1 secs Computing kpt #: 135 total cpu time spent up to now is 769.0 secs Computing kpt #: 136 total cpu time spent up to now is 774.0 secs Computing kpt #: 137 total cpu time spent up to now is 779.4 secs Computing kpt #: 138 total cpu time spent up to now is 785.0 secs Computing kpt #: 139 total cpu time spent up to now is 790.1 secs Computing kpt #: 140 total cpu time spent up to now is 795.1 secs Computing kpt #: 141 total cpu time spent up to now is 800.1 secs Computing kpt #: 142 total cpu time spent up to now is 805.0 secs Computing kpt #: 143 total cpu time spent up to now is 809.9 secs Computing kpt #: 144 total cpu time spent up to now is 814.8 secs Computing kpt #: 145 total cpu time spent up to now is 819.9 secs Computing kpt #: 146 total cpu time spent up to now is 825.0 secs Computing kpt #: 147 total cpu time spent up to now is 830.2 secs Computing kpt #: 148 total cpu time spent up to now is 835.2 secs Computing kpt #: 149 total cpu time spent up to now is 840.3 secs Computing kpt #: 150 total cpu time spent up to now is 845.2 secs Computing kpt #: 151 total cpu time spent up to now is 850.2 secs Computing kpt #: 152 total cpu time spent up to now is 855.1 secs Computing kpt #: 153 total cpu time spent up to now is 859.9 secs Computing kpt #: 154 total cpu time spent up to now is 864.7 secs Computing kpt #: 155 total cpu time spent up to now is 869.6 secs Computing kpt #: 156 total cpu time spent up to now is 874.4 secs Computing kpt #: 157 total cpu time spent up to now is 879.1 secs Computing kpt #: 158 total cpu time spent up to now is 883.8 secs Computing kpt #: 159 total cpu time spent up to now is 888.8 secs Computing kpt #: 160 total cpu time spent up to now is 893.5 secs Computing kpt #: 161 total cpu time spent up to now is 898.1 secs Computing kpt #: 162 total cpu time spent up to now is 902.7 secs Computing kpt #: 163 total cpu time spent up to now is 907.3 secs Computing kpt #: 164 total cpu time spent up to now is 912.0 secs Computing kpt #: 165 total cpu time spent up to now is 916.6 secs Computing kpt #: 166 total cpu time spent up to now is 921.1 secs Computing kpt #: 167 total cpu time spent up to now is 925.8 secs Computing kpt #: 168 total cpu time spent up to now is 930.6 secs Computing kpt #: 169 total cpu time spent up to now is 935.3 secs Computing kpt #: 170 total cpu time spent up to now is 940.1 secs Computing kpt #: 171 total cpu time spent up to now is 944.8 secs Computing kpt #: 172 total cpu time spent up to now is 949.5 secs Computing kpt #: 173 total cpu time spent up to now is 954.3 secs Computing kpt #: 174 total cpu time spent up to now is 959.0 secs Computing kpt #: 175 total cpu time spent up to now is 963.6 secs Computing kpt #: 176 total cpu time spent up to now is 968.2 secs Computing kpt #: 177 total cpu time spent up to now is 972.9 secs Computing kpt #: 178 total cpu time spent up to now is 977.6 secs Computing kpt #: 179 total cpu time spent up to now is 982.3 secs Computing kpt #: 180 total cpu time spent up to now is 986.8 secs Computing kpt #: 181 total cpu time spent up to now is 991.4 secs Computing kpt #: 182 total cpu time spent up to now is 995.8 secs Computing kpt #: 183 total cpu time spent up to now is 1000.2 secs Computing kpt #: 184 total cpu time spent up to now is 1004.6 secs Computing kpt #: 185 total cpu time spent up to now is 1009.0 secs Computing kpt #: 186 total cpu time spent up to now is 1013.6 secs Computing kpt #: 187 total cpu time spent up to now is 1018.1 secs Computing kpt #: 188 total cpu time spent up to now is 1022.6 secs Computing kpt #: 189 total cpu time spent up to now is 1027.2 secs Computing kpt #: 190 total cpu time spent up to now is 1031.7 secs Computing kpt #: 191 total cpu time spent up to now is 1036.3 secs Computing kpt #: 192 total cpu time spent up to now is 1041.0 secs Computing kpt #: 193 total cpu time spent up to now is 1045.8 secs Computing kpt #: 194 total cpu time spent up to now is 1050.7 secs Computing kpt #: 195 total cpu time spent up to now is 1055.7 secs Computing kpt #: 196 total cpu time spent up to now is 1060.8 secs Computing kpt #: 197 total cpu time spent up to now is 1065.8 secs Computing kpt #: 198 total cpu time spent up to now is 1070.8 secs Computing kpt #: 199 total cpu time spent up to now is 1075.9 secs Computing kpt #: 200 total cpu time spent up to now is 1082.3 secs Computing kpt #: 201 total cpu time spent up to now is 1088.3 secs Computing kpt #: 202 total cpu time spent up to now is 1093.3 secs Computing kpt #: 203 total cpu time spent up to now is 1098.4 secs Computing kpt #: 204 total cpu time spent up to now is 1103.6 secs Computing kpt #: 205 total cpu time spent up to now is 1108.6 secs Computing kpt #: 206 total cpu time spent up to now is 1113.6 secs Computing kpt #: 207 total cpu time spent up to now is 1118.6 secs Computing kpt #: 208 total cpu time spent up to now is 1123.5 secs Computing kpt #: 209 total cpu time spent up to now is 1128.5 secs ethr = 1.43E-11, avg # of iterations = 25.2 total cpu time spent up to now is 1128.7 secs End of band structure calculation k = 0.0000 0.0000 0.0000 ( 7441 PWs) bands (ev): -61.0810 -61.0810 -33.9833 -33.9833 -25.3081 -25.3081 -25.3081 -25.3081 -5.1767 -5.1767 -3.8172 -3.8172 -3.7471 -3.7471 -3.7471 -3.7471 1.6365 1.6365 1.6365 1.6365 1.8881 1.8881 3.3875 3.3875 3.5311 3.5311 3.5311 3.5311 3.8265 3.8265 3.9620 3.9620 3.9620 3.9620 4.1202 4.1202 4.1202 4.1202 4.2523 4.2523 4.2822 4.2822 4.2822 4.2822 4.6742 4.6742 4.6742 4.6742 4.6845 4.6845 5.0187 5.0187 5.0485 5.0485 5.0568 5.0568 5.0568 5.0568 5.2955 5.2955 5.5429 5.5429 5.5429 5.5429 6.5903 6.5903 6.6777 6.6777 6.6777 6.6777 8.3356 8.3356 8.4299 8.4299 8.4299 8.4299 8.7522 8.7522 8.7522 8.7522 9.3824 9.3824 10.8154 10.8154 k = 0.0000 0.0185-0.0000 ( 7393 PWs) bands (ev): -61.0809 -61.0809 -33.9832 -33.9832 -25.3080 -25.3080 -25.3080 -25.3080 -5.1757 -5.1757 -3.8176 -3.8176 -3.7481 -3.7481 -3.7471 -3.7471 1.6366 1.6366 1.6390 1.6390 1.8896 1.8896 3.3871 3.3871 3.5300 3.5300 3.5317 3.5317 3.8258 3.8258 3.9574 3.9574 3.9652 3.9652 4.1141 4.1141 4.1254 4.1254 4.2527 4.2527 4.2824 4.2824 4.2830 4.2830 4.6708 4.6708 4.6763 4.6763 4.6847 4.6847 5.0177 5.0177 5.0450 5.0450 5.0571 5.0571 5.0608 5.0608 5.2952 5.2952 5.5394 5.5394 5.5442 5.5442 6.5884 6.5884 6.6748 6.6748 6.6776 6.6776 8.3362 8.3362 8.4290 8.4290 8.4334 8.4334 8.7483 8.7483 8.7538 8.7538 9.3937 9.3937 10.8195 10.8195 k = 0.0000 0.0370-0.0000 ( 7373 PWs) bands (ev): -61.0809 -61.0809 -33.9832 -33.9832 -25.3080 -25.3080 -25.3080 -25.3080 -5.1730 -5.1730 -3.8191 -3.8191 -3.7510 -3.7510 -3.7471 -3.7471 1.6391 1.6391 1.6447 1.6447 1.8938 1.8938 3.3857 3.3857 3.5276 3.5276 3.5324 3.5324 3.8235 3.8235 3.9513 3.9513 3.9667 3.9667 4.1069 4.1069 4.1300 4.1300 4.2537 4.2537 4.2829 4.2829 4.2847 4.2847 4.6657 4.6657 4.6771 4.6771 4.6850 4.6850 5.0149 5.0149 5.0392 5.0392 5.0590 5.0590 5.0667 5.0667 5.2940 5.2940 5.5335 5.5335 5.5435 5.5435 6.5824 6.5824 6.6671 6.6671 6.6767 6.6767 8.3378 8.3378 8.4289 8.4289 8.4409 8.4409 8.7389 8.7389 8.7578 8.7578 9.4262 9.4262 10.8314 10.8314 k = 0.0000 0.0556-0.0000 ( 7369 PWs) bands (ev): -61.0809 -61.0809 -33.9832 -33.9832 -25.3080 -25.3080 -25.3080 -25.3080 -5.1685 -5.1685 -3.8219 -3.8219 -3.7554 -3.7554 -3.7470 -3.7470 1.6436 1.6436 1.6538 1.6538 1.9009 1.9009 3.3834 3.3834 3.5239 3.5239 3.5335 3.5335 3.8193 3.8193 3.9439 3.9439 3.9663 3.9663 4.0985 4.0985 4.1340 4.1340 4.2550 4.2550 4.2837 4.2837 4.2877 4.2877 4.6590 4.6590 4.6771 4.6771 4.6849 4.6849 5.0106 5.0106 5.0332 5.0332 5.0617 5.0617 5.0725 5.0725 5.2921 5.2921 5.5251 5.5251 5.5410 5.5410 6.5718 6.5718 6.6553 6.6553 6.6752 6.6752 8.3394 8.3394 8.4295 8.4295 8.4527 8.4527 8.7272 8.7272 8.7643 8.7643 9.4769 9.4769 10.8508 10.8508 k = 0.0000 0.0741-0.0000 ( 7361 PWs) bands (ev): -61.0809 -61.0809 -33.9832 -33.9832 -25.3080 -25.3080 -25.3080 -25.3080 -5.1621 -5.1621 -3.8265 -3.8265 -3.7609 -3.7609 -3.7470 -3.7470 1.6499 1.6499 1.6663 1.6663 1.9107 1.9107 3.3798 3.3798 3.5191 3.5191 3.5350 3.5350 3.8132 3.8132 3.9354 3.9354 3.9642 3.9642 4.0887 4.0887 4.1377 4.1377 4.2567 4.2567 4.2848 4.2848 4.2918 4.2918 4.6509 4.6509 4.6763 4.6763 4.6845 4.6845 5.0056 5.0056 5.0272 5.0272 5.0647 5.0647 5.0781 5.0781 5.2899 5.2899 5.5144 5.5144 5.5371 5.5371 6.5555 6.5555 6.6412 6.6412 6.6729 6.6729 8.3393 8.3393 8.4314 8.4314 8.4681 8.4681 8.7171 8.7171 8.7733 8.7733 9.5421 9.5421 10.8767 10.8767 k = 0.0000 0.0926-0.0000 ( 7368 PWs) bands (ev): -61.0809 -61.0809 -33.9832 -33.9832 -25.3080 -25.3080 -25.3080 -25.3080 -5.1540 -5.1540 -3.8334 -3.8334 -3.7667 -3.7667 -3.7469 -3.7469 1.6580 1.6580 1.6823 1.6823 1.9233 1.9233 3.3747 3.3747 3.5134 3.5134 3.5368 3.5368 3.8046 3.8046 3.9261 3.9261 3.9601 3.9601 4.0774 4.0774 4.1411 4.1411 4.2586 4.2586 4.2862 4.2862 4.2973 4.2973 4.6412 4.6412 4.6747 4.6747 4.6836 4.6836 5.0003 5.0003 5.0209 5.0209 5.0675 5.0675 5.0834 5.0834 5.2877 5.2877 5.5017 5.5017 5.5321 5.5321 6.5327 6.5327 6.6264 6.6264 6.6698 6.6698 8.3357 8.3357 8.4357 8.4357 8.4863 8.4863 8.7122 8.7122 8.7844 8.7844 9.6186 9.6186 10.9077 10.9077 k = 0.0000 0.1111-0.0000 ( 7344 PWs) bands (ev): -61.0809 -61.0809 -33.9832 -33.9832 -25.3080 -25.3080 -25.3080 -25.3080 -5.1441 -5.1441 -3.8435 -3.8435 -3.7721 -3.7721 -3.7468 -3.7468 1.6679 1.6679 1.7016 1.7016 1.9386 1.9386 3.3676 3.3676 3.5074 3.5074 3.5391 3.5391 3.7933 3.7933 3.9166 3.9166 3.9538 3.9538 4.0649 4.0649 4.1446 4.1446 4.2607 4.2607 4.2881 4.2881 4.3041 4.3041 4.6305 4.6305 4.6721 4.6721 4.6827 4.6827 4.9951 4.9951 5.0142 5.0142 5.0696 5.0696 5.0886 5.0886 5.2858 5.2858 5.4873 5.4873 5.5264 5.5264 6.5033 6.5033 6.6120 6.6120 6.6659 6.6659 8.3274 8.3274 8.4429 8.4429 8.5063 8.5063 8.7147 8.7147 8.7976 8.7976 9.7037 9.7037 10.9414 10.9414 k = 0.0000 0.1296-0.0000 ( 7352 PWs) bands (ev): -61.0809 -61.0809 -33.9832 -33.9832 -25.3081 -25.3081 -25.3080 -25.3080 -5.1325 -5.1325 -3.8571 -3.8571 -3.7765 -3.7765 -3.7467 -3.7467 1.6795 1.6795 1.7243 1.7243 1.9565 1.9565 3.3583 3.3583 3.5014 3.5014 3.5416 3.5416 3.7788 3.7788 3.9070 3.9070 3.9450 3.9450 4.0513 4.0513 4.1480 4.1480 4.2629 4.2629 4.2904 4.2904 4.3119 4.3119 4.6186 4.6186 4.6682 4.6682 4.6817 4.6817 4.9904 4.9904 5.0066 5.0066 5.0705 5.0705 5.0937 5.0937 5.2848 5.2848 5.4715 5.4715 5.5204 5.5204 6.4679 6.4679 6.5984 6.5984 6.6610 6.6610 8.3146 8.3146 8.4525 8.4525 8.5274 8.5274 8.7258 8.7258 8.8123 8.8123 9.7953 9.7953 10.9744 10.9744 k = 0.0000 0.1481-0.0000 ( 7348 PWs) bands (ev): -61.0809 -61.0809 -33.9832 -33.9832 -25.3081 -25.3081 -25.3080 -25.3080 -5.1191 -5.1191 -3.8741 -3.8741 -3.7798 -3.7798 -3.7465 -3.7465 1.6927 1.6927 1.7501 1.7501 1.9771 1.9771 3.3462 3.3462 3.4959 3.4959 3.5445 3.5445 3.7608 3.7608 3.8975 3.8975 3.9333 3.9333 4.0371 4.0371 4.1515 4.1515 4.2653 4.2653 4.2931 4.2931 4.3208 4.3208 4.6061 4.6061 4.6632 4.6632 4.6809 4.6809 4.9858 4.9858 4.9984 4.9984 5.0697 5.0697 5.0991 5.0991 5.2851 5.2851 5.4547 5.4547 5.5144 5.5144 6.4276 6.4276 6.5853 6.5853 6.6552 6.6552 8.2985 8.2985 8.4635 8.4635 8.5493 8.5493 8.7450 8.7450 8.8285 8.8285 9.8916 9.8916 11.0025 11.0025 k = 0.0000 0.1667-0.0000 ( 7356 PWs) bands (ev): -61.0809 -61.0809 -33.9832 -33.9832 -25.3081 -25.3081 -25.3080 -25.3080 -5.1041 -5.1041 -3.8944 -3.8944 -3.7821 -3.7821 -3.7464 -3.7464 1.7074 1.7074 1.7791 1.7791 2.0001 2.0001 3.3311 3.3311 3.4911 3.4911 3.5476 3.5476 3.7392 3.7392 3.8875 3.8875 3.9188 3.9188 4.0230 4.0230 4.1550 4.1550 4.2679 4.2679 4.2965 4.2965 4.3307 4.3307 4.5931 4.5931 4.6572 4.6572 4.6801 4.6801 4.9802 4.9802 4.9904 4.9904 5.0665 5.0665 5.1050 5.1050 5.2872 5.2872 5.4376 5.4376 5.5088 5.5088 6.3837 6.3837 6.5725 6.5725 6.6484 6.6484 8.2804 8.2804 8.4751 8.4751 8.5719 8.5719 8.7711 8.7711 8.8456 8.8456 9.9911 9.9911 11.0228 11.0228 k = 0.0000 0.1852-0.0000 ( 7380 PWs) bands (ev): -61.0809 -61.0809 -33.9832 -33.9832 -25.3082 -25.3082 -25.3080 -25.3080 -5.0875 -5.0875 -3.9175 -3.9175 -3.7837 -3.7837 -3.7462 -3.7462 1.7236 1.7236 1.8110 1.8110 2.0255 2.0255 3.3128 3.3128 3.4873 3.4873 3.5509 3.5509 3.7142 3.7142 3.8745 3.8745 3.9033 3.9033 4.0095 4.0095 4.1586 4.1586 4.2707 4.2707 4.3004 4.3004 4.3413 4.3413 4.5799 4.5799 4.6503 4.6503 4.6793 4.6793 4.9714 4.9714 4.9845 4.9845 5.0608 5.0608 5.1117 5.1117 5.2913 5.2913 5.4204 5.4204 5.5038 5.5038 6.3372 6.3372 6.5599 6.5599 6.6407 6.6407 8.2615 8.2615 8.4864 8.4864 8.5954 8.5954 8.8024 8.8024 8.8633 8.8633 10.0922 10.0922 11.0361 11.0361 k = 0.0000 0.2037-0.0000 ( 7396 PWs) bands (ev): -61.0809 -61.0809 -33.9833 -33.9833 -25.3083 -25.3083 -25.3080 -25.3080 -5.0692 -5.0692 -3.9432 -3.9432 -3.7848 -3.7848 -3.7461 -3.7461 1.7411 1.7411 1.8458 1.8458 2.0532 2.0532 3.2914 3.2914 3.4844 3.4844 3.5543 3.5543 3.6861 3.6861 3.8538 3.8538 3.8912 3.8912 3.9971 3.9971 4.1622 4.1622 4.2739 4.2739 4.3050 4.3050 4.3525 4.3525 4.5670 4.5670 4.6429 4.6429 4.6785 4.6785 4.9593 4.9593 4.9806 4.9806 5.0523 5.0523 5.1198 5.1198 5.2973 5.2973 5.4038 5.4038 5.4995 5.4995 6.2890 6.2890 6.5475 6.5475 6.6322 6.6322 8.2425 8.2425 8.4971 8.4971 8.6196 8.6196 8.8372 8.8372 8.8814 8.8814 10.1934 10.1934 11.0455 11.0455 k = 0.0000 0.2222-0.0000 ( 7396 PWs) bands (ev): -61.0809 -61.0809 -33.9833 -33.9833 -25.3083 -25.3083 -25.3080 -25.3080 -5.0494 -5.0494 -3.9709 -3.9709 -3.7856 -3.7856 -3.7459 -3.7459 1.7597 1.7597 1.8833 1.8833 2.0832 2.0832 3.2670 3.2670 3.4825 3.4825 3.5578 3.5578 3.6553 3.6553 3.8244 3.8244 3.8834 3.8834 3.9858 3.9858 4.1658 4.1658 4.2775 4.2775 4.3104 4.3104 4.3644 4.3644 4.5545 4.5545 4.6352 4.6352 4.6776 4.6776 4.9453 4.9453 4.9769 4.9769 5.0410 5.0410 5.1293 5.1293 5.3054 5.3054 5.3880 5.3880 5.4963 5.4963 6.2397 6.2397 6.5353 6.5353 6.6228 6.6228 8.2242 8.2242 8.5072 8.5072 8.6443 8.6443 8.8740 8.8740 8.8996 8.8996 10.2930 10.2930 11.0540 11.0540 k = 0.0000 0.2407-0.0000 ( 7388 PWs) bands (ev): -61.0809 -61.0809 -33.9833 -33.9833 -25.3083 -25.3083 -25.3080 -25.3080 -5.0282 -5.0282 -4.0005 -4.0005 -3.7860 -3.7860 -3.7457 -3.7457 1.7794 1.7794 1.9233 1.9233 2.1153 2.1153 3.2398 3.2398 3.4813 3.4813 3.5614 3.5614 3.6224 3.6224 3.7884 3.7884 3.8781 3.8781 3.9756 3.9756 4.1693 4.1693 4.2815 4.2815 4.3165 4.3165 4.3767 4.3767 4.5428 4.5428 4.6274 4.6274 4.6766 4.6766 4.9298 4.9298 4.9729 4.9729 5.0271 5.0271 5.1406 5.1406 5.3152 5.3152 5.3734 5.3734 5.4941 5.4941 6.1900 6.1900 6.5235 6.5235 6.6129 6.6129 8.2068 8.2068 8.5166 8.5166 8.6692 8.6692 8.9101 8.9101 8.9189 8.9189 10.3889 10.3889 11.0639 11.0639 k = 0.0000 0.2593-0.0000 ( 7384 PWs) bands (ev): -61.0809 -61.0809 -33.9832 -33.9832 -25.3083 -25.3083 -25.3080 -25.3080 -5.0056 -5.0056 -4.0317 -4.0317 -3.7863 -3.7863 -3.7456 -3.7456 1.8000 1.8000 1.9656 1.9656 2.1494 2.1494 3.2099 3.2099 3.4808 3.4808 3.5649 3.5649 3.5878 3.5878 3.7472 3.7472 3.8742 3.8742 3.9662 3.9662 4.1727 4.1727 4.2859 4.2859 4.3234 4.3234 4.3892 4.3892 4.5319 4.5319 4.6198 4.6198 4.6755 4.6755 4.9133 4.9133 4.9683 4.9683 5.0110 5.0110 5.1536 5.1536 5.3262 5.3262 5.3603 5.3603 5.4928 5.4928 6.1404 6.1404 6.5119 6.5119 6.6023 6.6023 8.1907 8.1907 8.5254 8.5254 8.6938 8.6938 8.9325 8.9325 8.9510 8.9510 10.4791 10.4791 11.0766 11.0766 k = 0.0000 0.2778-0.0000 ( 7388 PWs) bands (ev): -61.0809 -61.0809 -33.9833 -33.9833 -25.3084 -25.3084 -25.3080 -25.3080 -4.9816 -4.9816 -4.0642 -4.0642 -3.7864 -3.7864 -3.7454 -3.7454 1.8212 1.8212 2.0101 2.0101 2.1852 2.1852 3.1777 3.1777 3.4806 3.4806 3.5518 3.5518 3.5685 3.5685 3.7020 3.7020 3.8711 3.8711 3.9574 3.9574 4.1759 4.1759 4.2909 4.2909 4.3310 4.3310 4.4018 4.4018 4.5220 4.5220 4.6124 4.6124 4.6741 4.6741 4.8960 4.8960 4.9629 4.9629 4.9929 4.9929 5.1683 5.1683 5.3364 5.3364 5.3506 5.3506 5.4924 5.4924 6.0915 6.0915 6.5009 6.5009 6.5913 6.5913 8.1759 8.1759 8.5336 8.5336 8.7178 8.7178 8.9489 8.9489 8.9872 8.9872 10.5613 10.5613 11.0930 11.0930 k = 0.0000 0.2963-0.0000 ( 7400 PWs) bands (ev): -61.0809 -61.0809 -33.9833 -33.9833 -25.3084 -25.3084 -25.3080 -25.3080 -4.9565 -4.9565 -4.0977 -4.0977 -3.7864 -3.7864 -3.7452 -3.7452 1.8428 1.8428 2.0566 2.0566 2.2228 2.2228 3.1433 3.1433 3.4806 3.4806 3.5156 3.5156 3.5715 3.5715 3.6535 3.6535 3.8689 3.8689 3.9492 3.9492 4.1789 4.1789 4.2963 4.2963 4.3393 4.3393 4.4143 4.4143 4.5132 4.5132 4.6053 4.6053 4.6723 4.6723 4.8785 4.8785 4.9566 4.9566 4.9735 4.9735 5.1846 5.1846 5.3345 5.3345 5.3553 5.3553 5.4927 5.4927 6.0433 6.0433 6.4904 6.4904 6.5800 6.5800 8.1626 8.1626 8.5412 8.5412 8.7408 8.7408 8.9638 8.9638 9.0221 9.0221 10.6337 10.6337 11.1126 11.1126 k = 0.0000 0.3148-0.0000 ( 7396 PWs) bands (ev): -61.0809 -61.0809 -33.9833 -33.9833 -25.3085 -25.3085 -25.3080 -25.3080 -4.9303 -4.9303 -4.1321 -4.1321 -3.7864 -3.7864 -3.7451 -3.7451 1.8646 1.8646 2.1047 2.1047 2.2618 2.2618 3.1068 3.1068 3.4755 3.4755 3.4845 3.4845 3.5735 3.5735 3.6035 3.6035 3.8673 3.8673 3.9413 3.9413 4.1817 4.1817 4.3023 4.3023 4.3481 4.3481 4.4264 4.4264 4.5057 4.5057 4.5988 4.5988 4.6702 4.6702 4.8611 4.8611 4.9494 4.9494 4.9535 4.9535 5.2022 5.2022 5.3265 5.3265 5.3682 5.3682 5.4936 5.4936 5.9964 5.9964 6.4807 6.4807 6.5687 6.5687 8.1506 8.1506 8.5483 8.5483 8.7624 8.7624 8.9773 8.9773 9.0549 9.0549 10.6955 10.6955 11.1336 11.1336 k = 0.0000 0.3333-0.0000 ( 7400 PWs) bands (ev): -61.0809 -61.0809 -33.9833 -33.9833 -25.3085 -25.3085 -25.3080 -25.3080 -4.9033 -4.9033 -4.1669 -4.1669 -3.7863 -3.7863 -3.7449 -3.7449 1.8861 1.8861 2.1543 2.1543 2.3021 2.3021 3.0686 3.0686 3.4418 3.4418 3.4820 3.4820 3.5474 3.5474 3.5802 3.5802 3.8664 3.8664 3.9339 3.9339 4.1841 4.1841 4.3087 4.3087 4.3574 4.3574 4.4377 4.4377 4.4997 4.4997 4.5928 4.5928 4.6677 4.6677 4.8443 4.8443 4.9321 4.9321 4.9426 4.9426 5.2206 5.2206 5.3192 5.3192 5.3822 5.3822 5.4947 5.4947 5.9510 5.9510 6.4718 6.4718 6.5574 6.5574 8.1400 8.1400 8.5548 8.5548 8.7825 8.7825 8.9895 8.9895 9.0853 9.0853 10.7474 10.7474 11.1526 11.1526 k = 0.0000 0.3519-0.0000 ( 7400 PWs) bands (ev): -61.0809 -61.0809 -33.9833 -33.9833 -25.3085 -25.3085 -25.3080 -25.3080 -4.8755 -4.8755 -4.2019 -4.2019 -3.7862 -3.7862 -3.7448 -3.7448 1.9072 1.9072 2.2050 2.2050 2.3433 2.3433 3.0288 3.0288 3.4064 3.4064 3.4774 3.4774 3.4999 3.4999 3.5820 3.5820 3.8660 3.8660 3.9268 3.9268 4.1863 4.1863 4.3155 4.3155 4.3669 4.3669 4.4476 4.4476 4.4953 4.4953 4.5874 4.5874 4.6646 4.6646 4.8284 4.8284 4.9114 4.9114 4.9347 4.9347 5.2393 5.2393 5.3136 5.3136 5.3964 5.3964 5.4960 5.4960 5.9073 5.9073 6.4637 6.4637 6.5464 6.5464 8.1308 8.1308 8.5607 8.5607 8.8009 8.8009 9.0001 9.0001 9.1129 9.1129 10.7909 10.7909 11.1664 11.1664 k = 0.0000 0.3704-0.0000 ( 7392 PWs) bands (ev): -61.0809 -61.0809 -33.9833 -33.9833 -25.3086 -25.3086 -25.3080 -25.3080 -4.8474 -4.8474 -4.2367 -4.2367 -3.7861 -3.7861 -3.7447 -3.7447 1.9273 1.9273 2.2563 2.2563 2.3850 2.3850 2.9876 2.9876 3.3717 3.3717 3.4375 3.4375 3.4877 3.4877 3.5842 3.5842 3.8662 3.8662 3.9201 3.9201 4.1883 4.1883 4.3226 4.3226 4.3766 4.3766 4.4554 4.4554 4.4934 4.4934 4.5825 4.5825 4.6610 4.6610 4.8141 4.8141 4.8913 4.8913 4.9268 4.9268 5.2572 5.2572 5.3103 5.3103 5.4105 5.4105 5.4972 5.4972 5.8656 5.8656 6.4567 6.4567 6.5358 6.5358 8.1228 8.1228 8.5660 8.5660 8.8174 8.8174 9.0093 9.0093 9.1375 9.1375 10.8284 10.8284 11.1728 11.1728 k = 0.0000 0.3889-0.0000 ( 7396 PWs) bands (ev): -61.0809 -61.0809 -33.9833 -33.9833 -25.3086 -25.3086 -25.3080 -25.3080 -4.8192 -4.8192 -4.2707 -4.2707 -3.7860 -3.7860 -3.7445 -3.7445 1.9460 1.9460 2.3080 2.3080 2.4267 2.4267 2.9454 2.9454 3.3369 3.3369 3.3888 3.3888 3.4874 3.4874 3.5864 3.5864 3.8670 3.8670 3.9137 3.9137 4.1899 4.1899 4.3299 4.3299 4.3860 4.3860 4.4599 4.4599 4.4946 4.4946 4.5781 4.5781 4.6568 4.6568 4.8017 4.8017 4.8722 4.8722 4.9190 4.9190 5.2718 5.2718 5.3114 5.3114 5.4244 5.4244 5.4981 5.4981 5.8263 5.8263 6.4506 6.4506 6.5259 6.5259 8.1160 8.1160 8.5707 8.5707 8.8319 8.8319 9.0170 9.0170 9.1589 9.1589 10.8620 10.8620 11.1713 11.1713 k = 0.0000 0.4074-0.0000 ( 7404 PWs) bands (ev): -61.0810 -61.0810 -33.9833 -33.9833 -25.3086 -25.3086 -25.3080 -25.3080 -4.7916 -4.7916 -4.3035 -4.3035 -3.7858 -3.7858 -3.7444 -3.7444 1.9629 1.9629 2.3595 2.3595 2.4675 2.4675 2.9023 2.9023 3.2998 3.2998 3.3468 3.3468 3.4879 3.4879 3.5882 3.5882 3.8682 3.8682 3.9078 3.9078 4.1912 4.1912 4.3370 4.3370 4.3947 4.3947 4.4618 4.4618 4.4982 4.4982 4.5743 4.5743 4.6522 4.6522 4.7916 4.7916 4.8546 4.8546 4.9116 4.9116 5.2795 5.2795 5.3195 5.3195 5.4380 5.4380 5.4986 5.4986 5.7899 5.7899 6.4457 6.4457 6.5169 6.5169 8.1104 8.1104 8.5747 8.5747 8.8442 8.8442 9.0233 9.0233 9.1771 9.1771 10.8932 10.8932 11.1625 11.1625 k = 0.0000 0.4259-0.0000 ( 7400 PWs) bands (ev): -61.0809 -61.0809 -33.9833 -33.9833 -25.3086 -25.3086 -25.3080 -25.3080 -4.7653 -4.7653 -4.3340 -4.3340 -3.7857 -3.7857 -3.7444 -3.7444 1.9776 1.9776 2.4100 2.4100 2.5061 2.5061 2.8591 2.8591 3.2595 3.2595 3.3152 3.3152 3.4885 3.4885 3.5898 3.5898 3.8699 3.8699 3.9022 3.9022 4.1923 4.1923 4.3437 4.3437 4.4023 4.4023 4.4623 4.4623 4.5029 4.5029 4.5709 4.5709 4.6476 4.6476 4.7838 4.7838 4.8389 4.8389 4.9050 4.9050 5.2814 5.2814 5.3329 5.3329 5.4510 5.4510 5.4986 5.4986 5.7568 5.7568 6.4418 6.4418 6.5090 6.5090 8.1059 8.1059 8.5780 8.5780 8.8544 8.8544 9.0283 9.0283 9.1921 9.1921 10.9230 10.9230 11.1478 11.1478 k = 0.0000 0.4444-0.0000 ( 7416 PWs) bands (ev): -61.0810 -61.0810 -33.9833 -33.9833 -25.3087 -25.3087 -25.3080 -25.3080 -4.7416 -4.7416 -4.3612 -4.3612 -3.7856 -3.7856 -3.7443 -3.7443 1.9896 1.9896 2.4584 2.4584 2.5406 2.5406 2.8168 2.8168 3.2203 3.2203 3.2926 3.2926 3.4890 3.4890 3.5910 3.5910 3.8720 3.8720 3.8970 3.8970 4.1931 4.1931 4.3496 4.3496 4.4082 4.4082 4.4627 4.4627 4.5073 4.5073 4.5679 4.5679 4.6434 4.6434 4.7784 4.7784 4.8257 4.8257 4.8994 4.8994 5.2812 5.2812 5.3469 5.3469 5.4632 5.4632 5.4979 5.4979 5.7282 5.7282 6.4388 6.4388 6.5025 6.5025 8.1024 8.1024 8.5806 8.5806 8.8624 8.8624 9.0320 9.0320 9.2037 9.2037 10.9519 10.9519 11.1287 11.1287 k = 0.0000 0.4630-0.0000 ( 7416 PWs) bands (ev): -61.0810 -61.0810 -33.9833 -33.9833 -25.3087 -25.3087 -25.3080 -25.3080 -4.7221 -4.7221 -4.3832 -4.3832 -3.7856 -3.7856 -3.7442 -3.7442 1.9985 1.9985 2.5025 2.5025 2.5684 2.5684 2.7774 2.7774 3.1876 3.1876 3.2771 3.2771 3.4895 3.4895 3.5919 3.5919 3.8745 3.8745 3.8925 3.8925 4.1937 4.1937 4.3543 4.3543 4.4122 4.4122 4.4634 4.4634 4.5107 4.5107 4.5655 4.5655 4.6399 4.6399 4.7752 4.7752 4.8155 4.8155 4.8952 4.8952 5.2805 5.2805 5.3587 5.3587 5.4742 5.4742 5.4966 5.4966 5.7055 5.7055 6.4369 6.4369 6.4977 6.4977 8.1000 8.1000 8.5825 8.5825 8.8682 8.8682 9.0346 9.0346 9.2120 9.2120 10.9794 10.9794 11.1072 11.1072 k = 0.0000 0.4815-0.0000 ( 7408 PWs) bands (ev): -61.0810 -61.0810 -33.9833 -33.9833 -25.3087 -25.3087 -25.3080 -25.3080 -4.7089 -4.7089 -4.3978 -4.3978 -3.7855 -3.7855 -3.7442 -3.7442 2.0039 2.0039 2.5374 2.5374 2.5864 2.5864 2.7460 2.7460 3.1658 3.1658 3.2679 3.2679 3.4897 3.4897 3.5924 3.5924 3.8769 3.8769 3.8887 3.8887 4.1940 4.1940 4.3574 4.3574 4.4144 4.4144 4.4642 4.4642 4.5128 4.5128 4.5639 4.5639 4.6378 4.6378 4.7737 4.7737 4.8089 4.8089 4.8926 4.8926 5.2800 5.2800 5.3665 5.3665 5.4832 5.4832 5.4942 5.4942 5.6905 5.6905 6.4357 6.4357 6.4947 6.4947 8.0985 8.0985 8.5837 8.5837 8.8716 8.8716 9.0361 9.0361 9.2170 9.2170 11.0036 11.0036 11.0863 11.0863 k = 0.0000 0.5000-0.0000 ( 7368 PWs) bands (ev): -61.0809 -61.0809 -33.9833 -33.9833 -25.3086 -25.3086 -25.3080 -25.3080 -4.7043 -4.7043 -4.4030 -4.4030 -3.7855 -3.7855 -3.7442 -3.7442 2.0058 2.0058 2.5521 2.5521 2.5923 2.5923 2.7330 2.7330 3.1581 3.1581 3.2649 3.2649 3.4899 3.4899 3.5928 3.5928 3.8782 3.8782 3.8871 3.8871 4.1943 4.1943 4.3585 4.3585 4.4151 4.4151 4.4646 4.4646 4.5136 4.5136 4.5633 4.5633 4.6371 4.6371 4.7733 4.7733 4.8066 4.8066 4.8917 4.8917 5.2798 5.2798 5.3692 5.3692 5.4886 5.4886 5.4914 5.4914 5.6853 5.6853 6.4354 6.4354 6.4937 6.4937 8.0981 8.0981 8.5841 8.5841 8.8728 8.8728 9.0367 9.0367 9.2186 9.2186 11.0156 11.0156 11.0753 11.0753 k = 0.0000 0.5000-0.0000 ( 7368 PWs) bands (ev): -61.0809 -61.0809 -33.9833 -33.9833 -25.3086 -25.3086 -25.3080 -25.3080 -4.7043 -4.7043 -4.4030 -4.4030 -3.7855 -3.7855 -3.7442 -3.7442 2.0058 2.0058 2.5521 2.5521 2.5923 2.5923 2.7330 2.7330 3.1581 3.1581 3.2649 3.2649 3.4899 3.4899 3.5928 3.5928 3.8782 3.8782 3.8871 3.8871 4.1943 4.1943 4.3585 4.3585 4.4151 4.4151 4.4646 4.4646 4.5136 4.5136 4.5633 4.5633 4.6371 4.6371 4.7733 4.7733 4.8066 4.8066 4.8917 4.8917 5.2798 5.2798 5.3692 5.3692 5.4886 5.4886 5.4914 5.4914 5.6853 5.6853 6.4354 6.4354 6.4937 6.4937 8.0981 8.0981 8.5841 8.5841 8.8728 8.8728 9.0367 9.0367 9.2186 9.2186 11.0156 11.0156 11.0753 11.0753 k = 0.0185 0.5000-0.0000 ( 7412 PWs) bands (ev): -61.0810 -61.0810 -33.9833 -33.9833 -25.3087 -25.3087 -25.3080 -25.3080 -4.7036 -4.7035 -4.4034 -4.4016 -3.7874 -3.7849 -3.7449 -3.7449 2.0033 2.0097 2.5512 2.5523 2.5886 2.5962 2.7312 2.7338 3.1567 3.1592 3.2593 3.2706 3.4892 3.4903 3.5920 3.5930 3.8765 3.8782 3.8869 3.8872 4.1934 4.1945 4.3544 4.3586 4.4076 4.4192 4.4609 4.4660 4.5072 4.5227 4.5532 4.5712 4.6311 4.6465 4.7603 4.7841 4.8046 4.8129 4.8920 4.8976 5.2684 5.2938 5.3668 5.3697 5.4787 5.4845 5.4948 5.4949 5.6865 5.6908 6.4286 6.4389 6.4883 6.4961 8.0909 8.1092 8.5803 8.5922 8.8579 8.8863 9.0260 9.0417 9.2087 9.2323 11.0165 11.0255 11.0698 11.0878 k = 0.0370 0.5000-0.0000 ( 7412 PWs) bands (ev): -61.0810 -61.0810 -33.9833 -33.9833 -25.3087 -25.3087 -25.3080 -25.3080 -4.7014 -4.7013 -4.4028 -4.3992 -3.7907 -3.7857 -3.7469 -3.7469 2.0023 2.0151 2.5497 2.5520 2.5851 2.6005 2.7283 2.7336 3.1551 3.1600 3.2539 3.2763 3.4884 3.4907 3.5911 3.5930 3.8730 3.8770 3.8864 3.8876 4.1923 4.1944 4.3470 4.3532 4.3991 4.4198 4.4568 4.4641 4.5025 4.5348 4.5433 4.5752 4.6292 4.6580 4.7462 4.7943 4.8067 4.8208 4.8976 4.9107 5.2599 5.3090 5.3639 5.3678 5.4628 5.4785 5.4944 5.4987 5.6945 5.7023 6.4188 6.4393 6.4803 6.4957 8.0878 8.1244 8.5811 8.6047 8.8423 8.8971 9.0118 9.0407 9.2019 9.2500 11.0284 11.0461 11.0711 11.1070 k = 0.0556 0.5000-0.0000 ( 7400 PWs) bands (ev): -61.0809 -61.0809 -33.9833 -33.9833 -25.3087 -25.3087 -25.3080 -25.3080 -4.6979 -4.6977 -4.4013 -4.3958 -3.7952 -3.7878 -3.7503 -3.7501 2.0028 2.0219 2.5476 2.5512 2.5821 2.6050 2.7243 2.7326 3.1534 3.1602 3.2492 3.2819 3.4876 3.4910 3.5900 3.5927 3.8680 3.8752 3.8850 3.8880 4.1907 4.1938 4.3362 4.3404 4.3928 4.4177 4.4526 4.4600 4.4988 4.5354 4.5484 4.5765 4.6296 4.6697 4.7330 4.8051 4.8108 4.8282 4.9083 4.9312 5.2536 5.3209 5.3636 5.3638 5.4445 5.4721 5.4909 5.5022 5.7074 5.7175 6.4062 6.4366 6.4700 6.4924 8.0888 8.1435 8.5861 8.6212 8.8264 8.9028 8.9972 9.0343 9.1975 9.2710 11.0509 11.0767 11.0792 11.1328 k = 0.0741 0.5000-0.0000 ( 7400 PWs) bands (ev): -61.0809 -61.0809 -33.9833 -33.9833 -25.3087 -25.3087 -25.3080 -25.3080 -4.6929 -4.6927 -4.3987 -4.3915 -3.8010 -3.7914 -3.7551 -3.7546 2.0046 2.0300 2.5449 2.5499 2.5794 2.6097 2.7193 2.7308 3.1517 3.1595 3.2453 3.2874 3.4866 3.4913 3.5887 3.5921 3.8616 3.8727 3.8826 3.8882 4.1886 4.1926 4.3215 4.3218 4.3892 4.4136 4.4479 4.4555 4.4961 4.5300 4.5623 4.5766 4.6306 4.6791 4.7228 4.8134 4.8157 4.8373 4.9239 4.9575 5.2482 5.3228 5.3580 5.3683 5.4287 5.4652 5.4874 5.5061 5.7231 5.7348 6.3912 6.4310 6.4580 6.4866 8.0938 8.1663 8.5952 8.6414 8.8102 8.9000 8.9866 9.0245 9.1951 9.2943 11.0833 11.0933 11.1171 11.1646 k = 0.0926 0.5000-0.0000 ( 7414 PWs) bands (ev): -61.0810 -61.0810 -33.9833 -33.9833 -25.3087 -25.3087 -25.3081 -25.3081 -4.6865 -4.6863 -4.3952 -4.3862 -3.8080 -3.7964 -3.7611 -3.7603 2.0078 2.0393 2.5415 2.5481 2.5774 2.6145 2.7133 2.7286 3.1498 3.1576 3.2429 3.2930 3.4856 3.4915 3.5872 3.5912 3.8538 3.8696 3.8792 3.8883 4.1859 4.1908 4.2990 4.3041 4.3867 4.4082 4.4427 4.4519 4.4945 4.5267 4.5757 4.5769 4.6315 4.6826 4.7182 4.8164 4.8210 4.8507 4.9439 4.9877 5.2422 5.3160 5.3509 5.3656 5.4256 5.4579 5.4868 5.5123 5.7398 5.7528 6.3741 6.4229 6.4449 6.4787 8.1026 8.1926 8.6077 8.6648 8.7937 8.8863 8.9831 9.0131 9.1947 9.3188 11.1132 11.1249 11.1657 11.2020 k = 0.1111 0.5000-0.0000 ( 7410 PWs) bands (ev): -61.0810 -61.0810 -33.9833 -33.9833 -25.3087 -25.3087 -25.3081 -25.3081 -4.6787 -4.6784 -4.3908 -4.3800 -3.8162 -3.8029 -3.7685 -3.7670 2.0122 2.0496 2.5375 2.5455 2.5762 2.6192 2.7064 2.7263 3.1478 3.1545 3.2421 3.2987 3.4845 3.4918 3.5857 3.5899 3.8448 3.8657 3.8752 3.8882 4.1826 4.1881 4.2751 4.2839 4.3842 4.4026 4.4376 4.4495 4.4942 4.5253 4.5778 4.5883 4.6321 4.6793 4.7195 4.8157 4.8272 4.8662 4.9674 5.0205 5.2341 5.3052 5.3429 5.3488 5.4341 5.4499 5.4915 5.5239 5.7562 5.7708 6.3556 6.4127 6.4317 6.4696 8.1151 8.2222 8.6230 8.6908 8.7769 8.8637 8.9855 9.0025 9.1963 9.3437 11.1382 11.1744 11.2220 11.2441 k = 0.1296 0.5000-0.0000 ( 7418 PWs) bands (ev): -61.0810 -61.0810 -33.9833 -33.9833 -25.3087 -25.3087 -25.3081 -25.3081 -4.6696 -4.6693 -4.3854 -4.3729 -3.8257 -3.8110 -3.7770 -3.7747 2.0177 2.0608 2.5328 2.5421 2.5763 2.6235 2.6987 2.7244 3.1458 3.1501 3.2432 3.3046 3.4834 3.4921 3.5841 3.5883 3.8346 3.8604 3.8711 3.8878 4.1785 4.1846 4.2506 4.2621 4.3809 4.3973 4.4331 4.4479 4.4948 4.5253 4.5792 4.6000 4.6326 4.6729 4.7219 4.8129 4.8348 4.8816 4.9934 5.0549 5.2231 5.2921 5.3268 5.3336 5.4409 5.4411 5.5030 5.5437 5.7714 5.7883 6.3359 6.4004 6.4193 6.4601 8.1312 8.2548 8.6395 8.7188 8.7602 8.8359 8.9913 8.9946 9.1997 9.3681 11.1672 11.2308 11.2849 11.2898 k = 0.1481 0.5000-0.0000 ( 7418 PWs) bands (ev): -61.0810 -61.0810 -33.9833 -33.9833 -25.3087 -25.3087 -25.3081 -25.3081 -4.6592 -4.6588 -4.3790 -4.3649 -3.8364 -3.8205 -3.7868 -3.7833 2.0242 2.0727 2.5275 2.5376 2.5781 2.6270 2.6904 2.7237 3.1436 3.1446 3.2460 3.3107 3.4824 3.4926 3.5825 3.5864 3.8232 3.8532 3.8674 3.8873 4.1735 4.1800 4.2263 4.2397 4.3768 4.3924 4.4299 4.4470 4.4962 4.5265 4.5811 4.6107 4.6334 4.6663 4.7224 4.8087 4.8440 4.8955 5.0205 5.0899 5.2097 5.2777 5.3044 5.3229 5.4315 5.4416 5.5212 5.5696 5.7853 5.8054 6.3157 6.3865 6.4089 6.4514 8.1508 8.2901 8.6538 8.7463 8.7479 8.8053 8.9907 8.9995 9.2047 9.3916 11.1991 11.2924 11.3381 11.3532 k = 0.1667 0.5000-0.0000 ( 7410 PWs) bands (ev): -61.0810 -61.0810 -33.9833 -33.9833 -25.3087 -25.3087 -25.3081 -25.3081 -4.6475 -4.6470 -4.3718 -4.3560 -3.8482 -3.8317 -3.7976 -3.7927 2.0316 2.0850 2.5216 2.5320 2.5815 2.6288 2.6819 2.7250 3.1385 3.1413 3.2503 3.3172 3.4815 3.4934 3.5810 3.5842 3.8107 3.8442 3.8642 3.8866 4.1674 4.1741 4.2025 4.2173 4.3718 4.3879 4.4283 4.4466 4.4980 4.5286 4.5835 4.6205 4.6345 4.6604 4.7204 4.8036 4.8548 4.9075 5.0471 5.1250 5.1950 5.2618 5.2844 5.3107 5.4212 5.4376 5.5442 5.5970 5.7977 5.8228 6.2953 6.3709 6.4017 6.4447 8.1734 8.3275 8.6589 8.7421 8.7670 8.7837 8.9918 9.0102 9.2108 9.4138 11.2326 11.3572 11.3875 11.4258 k = 0.1852 0.5000-0.0000 ( 7412 PWs) bands (ev): -61.0810 -61.0810 -33.9833 -33.9833 -25.3087 -25.3087 -25.3082 -25.3082 -4.6345 -4.6340 -4.3637 -4.3462 -3.8612 -3.8443 -3.8095 -3.8030 2.0398 2.0975 2.5150 2.5254 2.5863 2.6285 2.6738 2.7294 3.1321 3.1390 3.2561 3.3241 3.4807 3.4944 3.5795 3.5817 3.7971 3.8334 3.8614 3.8857 4.1598 4.1669 4.1798 4.1955 4.3665 4.3839 4.4279 4.4467 4.4999 4.5313 4.5864 4.6294 4.6360 4.6556 4.7161 4.7977 4.8667 4.9172 5.0709 5.1580 5.1818 5.2449 5.2691 5.2972 5.4103 5.4306 5.5690 5.6210 5.8094 5.8420 6.2750 6.3540 6.3987 6.4413 8.1990 8.3665 8.6490 8.7378 8.7530 8.8099 8.9981 9.0238 9.2175 9.4343 11.2660 11.4213 11.4377 11.5009 k = 0.2037 0.5000-0.0000 ( 7402 PWs) bands (ev): -61.0809 -61.0809 -33.9833 -33.9833 -25.3087 -25.3087 -25.3082 -25.3082 -4.6204 -4.6198 -4.3547 -4.3357 -3.8753 -3.8584 -3.8222 -3.8139 2.0486 2.1099 2.5078 2.5177 2.5918 2.6257 2.6672 2.7373 3.1257 3.1366 3.2629 3.3314 3.4800 3.4957 3.5782 3.5788 3.7823 3.8210 3.8588 3.8847 4.1490 4.1577 4.1599 4.1749 4.3611 4.3803 4.4287 4.4473 4.5019 4.5343 4.5898 4.6370 4.6378 4.6524 4.7099 4.7912 4.8794 4.9244 5.0887 5.1621 5.1972 5.2280 5.2606 5.2830 5.3990 5.4218 5.5922 5.6377 5.8220 5.8643 6.2552 6.3360 6.4009 6.4417 8.2272 8.4063 8.6296 8.7060 8.7741 8.8390 9.0095 9.0408 9.2244 9.4529 11.2974 11.4736 11.4939 11.5763 k = 0.2222 0.5000-0.0000 ( 7406 PWs) bands (ev): -61.0810 -61.0810 -33.9833 -33.9833 -25.3087 -25.3087 -25.3082 -25.3082 -4.6051 -4.6045 -4.3449 -4.3243 -3.8906 -3.8738 -3.8359 -3.8256 2.0579 2.1221 2.5000 2.5091 2.5960 2.6204 2.6643 2.7488 3.1197 3.1342 3.2707 3.3391 3.4794 3.4973 3.5755 3.5770 3.7663 3.8070 3.8564 3.8835 4.1319 4.1452 4.1460 4.1571 4.3561 4.3771 4.4304 4.4483 4.5038 4.5374 4.5938 4.6399 4.6420 4.6522 4.7025 4.7843 4.8925 4.9287 5.0971 5.1502 5.2119 5.2276 5.2614 5.2699 5.3876 5.4120 5.6097 5.6450 5.8375 5.8904 6.2363 6.3175 6.4087 6.4466 8.2576 8.4456 8.6068 8.6763 8.7997 8.8671 9.0255 9.0612 9.2311 9.4695 11.3247 11.5121 11.5504 11.6479 k = 0.2407 0.5000-0.0000 ( 7402 PWs) bands (ev): -61.0809 -61.0809 -33.9833 -33.9833 -25.3087 -25.3087 -25.3082 -25.3082 -4.5887 -4.5881 -4.3344 -4.3123 -3.9069 -3.8904 -3.8503 -3.8381 2.0677 2.1338 2.4915 2.4996 2.5963 2.6132 2.6682 2.7638 3.1143 3.1317 3.2794 3.3472 3.4789 3.4994 3.5717 3.5759 3.7492 3.7914 3.8543 3.8823 4.1124 4.1286 4.1344 4.1430 4.3516 4.3743 4.4327 4.4498 4.5055 4.5402 4.5982 4.6422 4.6432 4.6560 4.6946 4.7771 4.9056 4.9303 5.0955 5.1399 5.1966 5.2417 5.2722 5.2723 5.3764 5.4018 5.6185 5.6429 5.8576 5.9192 6.2187 6.2990 6.4222 6.4559 8.2898 8.4816 8.5835 8.6517 8.8274 8.8940 9.0456 9.0850 9.2373 9.4839 11.3458 11.5389 11.5951 11.7087 k = 0.2593 0.5000-0.0000 ( 7406 PWs) bands (ev): -61.0810 -61.0810 -33.9833 -33.9833 -25.3088 -25.3088 -25.3082 -25.3082 -4.5714 -4.5707 -4.3231 -4.2995 -3.9241 -3.9082 -3.8653 -3.8511 2.0779 2.1450 2.4825 2.4894 2.5916 2.6046 2.6802 2.7819 3.1098 3.1292 3.2886 3.3556 3.4785 3.5017 3.5674 3.5752 3.7310 3.7740 3.8524 3.8810 4.0933 4.1107 4.1222 4.1299 4.3477 4.3718 4.4355 4.4517 4.5071 4.5422 4.6031 4.6434 4.6446 4.6607 4.6871 4.7699 4.9184 4.9290 5.0869 5.1324 5.1819 5.2306 5.2899 5.2981 5.3659 5.3920 5.6177 5.6328 5.8823 5.9488 6.2028 6.2809 6.4411 6.4697 8.3231 8.5082 8.5617 8.6383 8.8560 8.9200 9.0691 9.1116 9.2429 9.4959 11.3587 11.5515 11.6199 11.7473 k = 0.2778 0.5000-0.0000 ( 7412 PWs) bands (ev): -61.0810 -61.0810 -33.9834 -33.9834 -25.3088 -25.3088 -25.3083 -25.3083 -4.5532 -4.5524 -4.3111 -4.2862 -3.9424 -3.9269 -3.8809 -3.8649 2.0884 2.1557 2.4731 2.4786 2.5833 2.5949 2.6988 2.8027 3.1062 3.1267 3.2984 3.3643 3.4781 3.5043 3.5624 3.5747 3.7117 3.7549 3.8508 3.8797 4.0753 4.0930 4.1091 4.1163 4.3445 4.3695 4.4388 4.4540 4.5083 4.5432 4.6085 4.6441 4.6469 4.6637 4.6816 4.7627 4.9249 4.9302 5.0755 5.1278 5.1678 5.2162 5.3102 5.3241 5.3577 5.3838 5.6080 5.6163 5.9103 5.9772 6.1890 6.2636 6.4648 6.4875 8.3565 8.5169 8.5429 8.6443 8.8849 8.9456 9.0954 9.1401 9.2478 9.5055 11.3619 11.5477 11.6201 11.7521 k = 0.2963 0.5000-0.0000 ( 7416 PWs) bands (ev): -61.0810 -61.0810 -33.9834 -33.9834 -25.3088 -25.3088 -25.3083 -25.3083 -4.5341 -4.5333 -4.2985 -4.2722 -3.9614 -3.9465 -3.8970 -3.8792 2.0991 2.1656 2.4632 2.4671 2.5732 2.5845 2.7227 2.8260 3.1037 3.1242 3.3087 3.3732 3.4775 3.5072 3.5565 3.5745 3.6917 3.7340 3.8495 3.8782 4.0584 4.0761 4.0952 4.1021 4.3421 4.3675 4.4424 4.4567 4.5093 4.5431 4.6143 4.6451 4.6489 4.6631 4.6807 4.7559 4.9187 4.9397 5.0647 5.1257 5.1547 5.2022 5.3276 5.3362 5.3628 5.3800 5.5913 5.5952 5.9393 6.0027 6.1779 6.2475 6.4923 6.5087 8.3880 8.5087 8.5292 8.6679 8.9138 8.9716 9.1236 9.1696 9.2520 9.5126 11.3551 11.5283 11.5970 11.7218 k = 0.3148 0.5000-0.0000 ( 7412 PWs) bands (ev): -61.0810 -61.0810 -33.9834 -33.9834 -25.3088 -25.3088 -25.3083 -25.3083 -4.5144 -4.5135 -4.2853 -4.2578 -3.9811 -3.9668 -3.9134 -3.8940 2.1101 2.1750 2.4529 2.4552 2.5624 2.5738 2.7505 2.8513 3.1025 3.1216 3.3193 3.3822 3.4768 3.5101 3.5493 3.5746 3.6712 3.7113 3.8486 3.8768 4.0428 4.0602 4.0808 4.0872 4.3404 4.3656 4.4463 4.4599 4.5100 4.5416 4.6206 4.6448 4.6505 4.6616 4.6832 4.7496 4.9110 4.9454 5.0575 5.1252 5.1429 5.1901 5.3311 5.3356 5.3839 5.3860 5.5694 5.5709 5.9675 6.0242 6.1699 6.2330 6.5226 6.5326 8.4138 8.4938 8.5243 8.6984 8.9426 8.9989 9.1531 9.1990 9.2556 9.5170 11.3395 11.4968 11.5558 11.6670 k = 0.3333 0.5000-0.0000 ( 7404 PWs) bands (ev): -61.0809 -61.0809 -33.9834 -33.9834 -25.3088 -25.3088 -25.3083 -25.3083 -4.4941 -4.4932 -4.2716 -4.2430 -4.0015 -3.9876 -3.9301 -3.9094 2.1213 2.1838 2.4425 2.4429 2.5515 2.5631 2.7817 2.8782 3.1025 3.1190 3.3301 3.3910 3.4759 3.5130 3.5403 3.5752 3.6511 3.6868 3.8479 3.8752 4.0286 4.0453 4.0661 4.0721 4.3393 4.3639 4.4504 4.4633 4.5104 4.5389 4.6271 4.6422 4.6515 4.6631 4.6865 4.7441 4.9024 4.9458 5.0558 5.1242 5.1330 5.1817 5.3239 5.3337 5.4011 5.4057 5.5437 5.5443 5.9936 6.0409 6.1657 6.2204 6.5543 6.5583 8.4286 8.4779 8.5333 8.7288 8.9710 9.0282 9.1832 9.2261 9.2597 9.5185 11.3169 11.4575 11.5034 11.5996 k = 0.3519 0.5000-0.0000 ( 7404 PWs) bands (ev): -61.0809 -61.0809 -33.9834 -33.9834 -25.3089 -25.3089 -25.3083 -25.3083 -4.4733 -4.4724 -4.2576 -4.2279 -4.0221 -4.0087 -3.9470 -3.9251 2.1327 2.1920 2.4303 2.4318 2.5412 2.5526 2.8156 2.9062 3.1038 3.1162 3.3410 3.3996 3.4746 3.5153 3.5285 3.5759 3.6324 3.6605 3.8476 3.8736 4.0158 4.0315 4.0515 4.0571 4.3388 4.3622 4.4547 4.4671 4.5105 4.5351 4.6338 4.6384 4.6518 4.6672 4.6896 4.7394 4.8936 4.9408 5.0590 5.1207 5.1262 5.1790 5.3171 5.3280 5.4190 5.4256 5.5153 5.5164 6.0164 6.0526 6.1651 6.2099 6.5850 6.5860 8.4323 8.4633 8.5559 8.7558 8.9990 9.0602 9.2130 9.2449 9.2698 9.5170 11.2899 11.4140 11.4457 11.5282 k = 0.3704 0.5000-0.0000 ( 7400 PWs) bands (ev): -61.0809 -61.0809 -33.9834 -33.9834 -25.3089 -25.3089 -25.3083 -25.3083 -4.4524 -4.4515 -4.2434 -4.2127 -4.0429 -4.0297 -3.9638 -3.9411 2.1443 2.1996 2.4178 2.4212 2.5316 2.5426 2.8516 2.9346 3.1066 3.1132 3.3519 3.4074 3.4732 3.5124 3.5179 3.5768 3.6165 3.6329 3.8476 3.8719 4.0046 4.0189 4.0374 4.0425 4.3388 4.3606 4.4592 4.4710 4.5104 4.5306 4.6348 4.6405 4.6513 4.6724 4.6924 4.7355 4.8852 4.9320 5.0641 5.1140 5.1244 5.1825 5.3112 5.3216 5.4361 5.4432 5.4852 5.4880 6.0354 6.0600 6.1678 6.2017 6.6116 6.6165 8.4305 8.4510 8.5858 8.7778 9.0264 9.0948 9.2418 9.2502 9.2902 9.5124 11.2608 11.3693 11.3875 11.4579 k = 0.3889 0.5000-0.0000 ( 7404 PWs) bands (ev): -61.0809 -61.0809 -33.9834 -33.9834 -25.3089 -25.3089 -25.3083 -25.3083 -4.4316 -4.4308 -4.2291 -4.1977 -4.0633 -4.0503 -3.9804 -3.9574 2.1559 2.2066 2.4056 2.4107 2.5231 2.5332 2.8891 2.9625 3.1100 3.1107 3.3627 3.4141 3.4718 3.4938 3.5184 3.5774 3.6042 3.6046 3.8479 3.8701 3.9951 4.0077 4.0241 4.0287 4.3393 4.3590 4.4637 4.4751 4.5099 4.5255 4.6319 4.6463 4.6509 4.6779 4.6948 4.7325 4.8776 4.9212 5.0673 5.1053 5.1300 5.1908 5.3062 5.3153 5.4502 5.4538 5.4584 5.4607 6.0503 6.0642 6.1724 6.1960 6.6372 6.6447 8.4273 8.4412 8.6181 8.7939 9.0531 9.1313 9.2505 9.2690 9.3122 9.5045 11.2320 11.3250 11.3326 11.3917 k = 0.4074 0.5000-0.0000 ( 7398 PWs) bands (ev): -61.0809 -61.0809 -33.9834 -33.9834 -25.3089 -25.3089 -25.3083 -25.3083 -4.4113 -4.4105 -4.2152 -4.1834 -4.0828 -4.0700 -3.9966 -3.9736 2.1675 2.2126 2.3940 2.4005 2.5158 2.5247 2.9275 2.9887 3.1065 3.1160 3.3733 3.4191 3.4707 3.4723 3.5180 3.5700 3.5840 3.5958 3.8486 3.8682 3.9873 3.9981 4.0122 4.0160 4.3402 4.3573 4.4682 4.4792 4.5091 4.5202 4.6299 4.6465 4.6551 4.6829 4.6971 4.7301 4.8713 4.9099 5.0673 5.0962 5.1431 5.2024 5.3023 5.3096 5.4223 5.4301 5.4658 5.4707 6.0611 6.0666 6.1778 6.1928 6.6609 6.6697 8.4245 8.4339 8.6502 8.8041 9.0788 9.1677 9.2499 9.2939 9.3322 9.4931 11.2053 11.2797 11.2868 11.3320 k = 0.4259 0.5000-0.0000 ( 7396 PWs) bands (ev): -61.0809 -61.0809 -33.9834 -33.9834 -25.3089 -25.3089 -25.3083 -25.3083 -4.3921 -4.3913 -4.2020 -4.1709 -4.1002 -4.0877 -4.0118 -3.9897 2.1788 2.2173 2.3837 2.3910 2.5099 2.5174 2.9657 3.0120 3.1029 3.1220 3.3834 3.4214 3.4506 3.4701 3.5163 3.5440 3.5827 3.5906 3.8497 3.8661 3.9814 3.9901 4.0017 4.0047 4.3414 4.3555 4.4728 4.4832 4.5080 4.5149 4.6288 4.6441 4.6613 4.6864 4.7001 4.7280 4.8666 4.8990 5.0657 5.0876 5.1616 5.2164 5.2996 5.3046 5.3907 5.4028 5.4766 5.4807 6.0681 6.0682 6.1830 6.1916 6.6818 6.6906 8.4226 8.4287 8.6810 8.8085 9.1032 9.1985 9.2534 9.3157 9.3490 9.4782 11.1823 11.2371 11.2497 11.2805 k = 0.4444 0.5000-0.0000 ( 7388 PWs) bands (ev): -61.0809 -61.0809 -33.9834 -33.9834 -25.3089 -25.3089 -25.3083 -25.3083 -4.3747 -4.3741 -4.1906 -4.1624 -4.1130 -4.1023 -4.0253 -4.0051 2.1897 2.2204 2.3752 2.3823 2.5054 2.5112 3.0024 3.0315 3.0993 3.1270 3.3922 3.4204 3.4324 3.4689 3.5133 3.5191 3.5835 3.5877 3.8511 3.8639 3.9774 3.9841 3.9929 3.9951 4.3428 4.3537 4.4775 4.4870 4.5066 4.5097 4.6286 4.6411 4.6673 4.6877 4.7041 4.7259 4.8637 4.8889 5.0640 5.0800 5.1835 5.2318 5.2981 5.3002 5.3596 5.3764 5.4852 5.4883 6.0695 6.0721 6.1874 6.1918 6.6992 6.7069 8.4214 8.4252 8.7095 8.8076 9.1262 9.2112 9.2720 9.3338 9.3623 9.4597 11.1644 11.2022 11.2190 11.2383 k = 0.4630 0.5000-0.0000 ( 7400 PWs) bands (ev): -61.0809 -61.0809 -33.9834 -33.9834 -25.3089 -25.3089 -25.3083 -25.3083 -4.3604 -4.3599 -4.1819 -4.1615 -4.1180 -4.1120 -4.0357 -4.0195 2.1997 2.2213 2.3692 2.3749 2.5025 2.5064 3.0351 3.0468 3.0966 3.1283 3.3974 3.4162 3.4233 3.4630 3.5028 3.5094 3.5843 3.5863 3.8527 3.8616 3.9753 3.9801 3.9861 3.9872 4.3445 4.3519 4.4820 4.4902 4.5048 4.5049 4.6292 4.6380 4.6729 4.6871 4.7086 4.7235 4.8629 4.8801 5.0631 5.0736 5.2074 5.2476 5.2966 5.2982 5.3299 5.3515 5.4915 5.4935 6.0708 6.0737 6.1907 6.1927 6.7126 6.7182 8.4209 8.4230 8.7352 8.8017 9.1474 9.2077 9.3025 9.3472 9.3723 9.4381 11.1526 11.1762 11.1956 11.2067 k = 0.4815 0.5000-0.0000 ( 7394 PWs) bands (ev): -61.0809 -61.0809 -33.9834 -33.9834 -25.3089 -25.3089 -25.3083 -25.3083 -4.3507 -4.3505 -4.1762 -4.1664 -4.1173 -4.1160 -4.0410 -4.0315 2.2084 2.2195 2.3662 2.3694 2.5011 2.5031 3.0578 3.0580 3.0988 3.1228 3.3988 3.4095 3.4268 3.4504 3.4986 3.5050 3.5849 3.5857 3.8547 3.8592 3.9753 3.9783 3.9813 3.9813 4.3462 4.3500 4.4865 4.4920 4.5015 4.5028 4.6306 4.6351 4.6778 4.6851 4.7131 4.7206 4.8642 4.8729 5.0635 5.0687 5.2323 5.2597 5.2936 5.3014 5.3042 5.3291 5.4954 5.4964 6.0721 6.0739 6.1927 6.1935 6.7215 6.7244 8.4208 8.4218 8.7576 8.7912 9.1666 9.1974 9.3325 9.3547 9.3804 9.4143 11.1476 11.1589 11.1814 11.1863 k = 0.5000 0.5000-0.0000 ( 7380 PWs) bands (ev): -61.0809 -61.0809 -33.9833 -33.9833 -25.3089 -25.3089 -25.3083 -25.3083 -4.3472 -4.3472 -4.1718 -4.1718 -4.1166 -4.1166 -4.0394 -4.0394 2.2152 2.2152 2.3664 2.3664 2.5014 2.5014 3.0634 3.0634 3.1105 3.1105 3.4026 3.4026 3.4370 3.4370 3.5008 3.5008 3.5854 3.5854 3.8569 3.8569 3.9772 3.9772 3.9788 3.9788 4.3481 4.3481 4.4904 4.4904 4.5011 4.5011 4.6326 4.6326 4.6819 4.6819 4.7172 4.7172 4.8676 4.8676 5.0653 5.0653 5.2545 5.2545 5.2926 5.2926 5.3113 5.3113 5.4970 5.4970 6.0732 6.0732 6.1936 6.1936 6.7255 6.7255 8.4211 8.4211 8.7764 8.7764 9.1834 9.1834 9.3519 9.3519 9.3928 9.3928 11.1496 11.1496 11.1779 11.1779 k = 0.5000 0.5000-0.0000 ( 7380 PWs) bands (ev): -61.0809 -61.0809 -33.9833 -33.9833 -25.3089 -25.3089 -25.3083 -25.3083 -4.3472 -4.3472 -4.1718 -4.1718 -4.1166 -4.1166 -4.0394 -4.0394 2.2152 2.2152 2.3664 2.3664 2.5014 2.5014 3.0634 3.0634 3.1105 3.1105 3.4026 3.4026 3.4370 3.4370 3.5008 3.5008 3.5854 3.5854 3.8569 3.8569 3.9772 3.9772 3.9788 3.9788 4.3481 4.3481 4.4904 4.4904 4.5011 4.5011 4.6326 4.6326 4.6819 4.6819 4.7172 4.7172 4.8676 4.8676 5.0653 5.0653 5.2545 5.2545 5.2926 5.2926 5.3113 5.3113 5.4970 5.4970 6.0732 6.0732 6.1936 6.1936 6.7255 6.7255 8.4211 8.4211 8.7764 8.7764 9.1834 9.1834 9.3519 9.3519 9.3928 9.3928 11.1496 11.1496 11.1779 11.1779 k = 0.4868 0.4868-0.0000 ( 7394 PWs) bands (ev): -61.0809 -61.0809 -33.9834 -33.9834 -25.3089 -25.3089 -25.3083 -25.3083 -4.3507 -4.3506 -4.1758 -4.1665 -4.1168 -4.1168 -4.0410 -4.0313 2.2084 2.2196 2.3660 2.3696 2.5011 2.5032 3.0558 3.0604 3.0971 3.1240 3.3984 3.4101 3.4267 3.4505 3.4980 3.5055 3.5849 3.5857 3.8547 3.8592 3.9748 3.9793 3.9806 3.9815 4.3462 4.3500 4.4863 4.4924 4.5007 4.5033 4.6305 4.6352 4.6778 4.6851 4.7130 4.7206 4.8642 4.8729 5.0634 5.0687 5.2325 5.2588 5.2975 5.2993 5.3025 5.3297 5.4954 5.4964 6.0720 6.0740 6.1927 6.1934 6.7214 6.7244 8.4208 8.4217 8.7575 8.7912 9.1665 9.1975 9.3351 9.3485 9.3855 9.4127 11.1486 11.1565 11.1805 11.1887 k = 0.4737 0.4737-0.0000 ( 7392 PWs) bands (ev): -61.0809 -61.0809 -33.9834 -33.9834 -25.3089 -25.3089 -25.3083 -25.3083 -4.3608 -4.3608 -4.1779 -4.1606 -4.1176 -4.1167 -4.0359 -4.0184 2.1997 2.2214 2.3674 2.3757 2.5027 2.5071 3.0351 3.0484 3.0876 3.1354 3.3973 3.4194 3.4222 3.4645 3.4963 3.5131 3.5844 3.5861 3.8526 3.8617 3.9732 3.9833 3.9852 3.9872 4.3444 4.3519 4.4813 4.4924 4.5012 4.5070 4.6290 4.6384 4.6729 4.6872 4.7084 4.7236 4.8628 4.8802 5.0628 5.0740 5.2083 5.2461 5.2938 5.3024 5.3270 5.3538 5.4915 5.4936 6.0702 6.0744 6.1907 6.1924 6.7125 6.7184 8.4209 8.4228 8.7352 8.8016 9.1471 9.2084 9.3119 9.3227 9.3934 9.4315 11.1555 11.1599 11.1941 11.2219 k = 0.4605 0.4605-0.0000 ( 7396 PWs) bands (ev): -61.0809 -61.0809 -33.9834 -33.9834 -25.3089 -25.3089 -25.3083 -25.3083 -4.3771 -4.3766 -4.1780 -4.1544 -4.1183 -4.1155 -4.0252 -4.0023 2.1900 2.2208 2.3689 2.3834 2.5068 2.5139 3.0040 3.0282 3.0815 3.1450 3.3988 3.4182 3.4352 3.4760 3.4956 3.5253 3.5838 3.5869 3.8507 3.8644 3.9725 3.9903 3.9904 3.9962 4.3427 4.3538 4.4759 4.4916 4.5019 4.5111 4.6278 4.6420 4.6676 4.6882 4.7031 4.7260 4.8634 4.8890 5.0629 5.0813 5.1848 5.2318 5.2888 5.3065 5.3568 5.3812 5.4854 5.4886 6.0676 6.0741 6.1874 6.1907 6.6992 6.7077 8.4214 8.4243 8.7099 8.8070 9.1257 9.2153 9.2859 9.2907 9.4016 9.4468 11.1611 11.1630 11.2247 11.2747 k = 0.4474 0.4474-0.0000 ( 7397 PWs) bands (ev): -61.0809 -61.0809 -33.9834 -33.9834 -25.3089 -25.3089 -25.3083 -25.3083 -4.3983 -4.3970 -4.1760 -4.1479 -4.1180 -4.1129 -4.0109 -3.9844 2.1798 2.2185 2.3688 2.3903 2.5151 2.5242 2.9665 3.0009 3.0772 3.1540 3.4025 3.4195 3.4509 3.4835 3.4959 3.5415 3.5832 3.5886 3.8490 3.8673 3.9727 3.9959 4.0004 4.0080 4.3411 4.3556 4.4705 4.4905 4.5026 4.5150 4.6270 4.6462 4.6621 4.6883 4.6974 4.7279 4.8658 4.8991 5.0632 5.0909 5.1627 5.2199 5.2841 5.3103 5.3882 5.4106 5.4772 5.4817 6.0640 6.0731 6.1827 6.1884 6.6826 6.6932 8.4222 8.4263 8.6822 8.8072 9.1027 9.2143 9.2562 9.2621 9.4075 9.4581 11.1617 11.1685 11.2722 11.3435 k = 0.4342 0.4342-0.0000 ( 7387 PWs) bands (ev): -61.0809 -61.0809 -33.9834 -33.9833 -25.3089 -25.3089 -25.3083 -25.3083 -4.4233 -4.4212 -4.1722 -4.1411 -4.1161 -4.1090 -3.9944 -3.9656 2.1693 2.2149 2.3658 2.3940 2.5290 2.5386 2.9247 2.9684 3.0745 3.1632 3.4082 3.4234 3.4675 3.4882 3.4974 3.5585 3.5827 3.5926 3.8475 3.8704 3.9738 4.0021 4.0131 4.0221 4.3396 4.3572 4.4651 4.4894 4.5033 4.5185 4.6264 4.6501 4.6574 4.6873 4.6912 4.7295 4.8699 4.9097 5.0631 5.1028 5.1425 5.2119 5.2797 5.3138 5.4206 5.4412 5.4676 5.4731 6.0594 6.0709 6.1766 6.1851 6.6636 6.6759 8.4233 8.4289 8.6528 8.8019 9.0786 9.1968 9.2208 9.2499 9.4109 9.4655 11.1619 11.1730 11.3326 11.4249 k = 0.4211 0.4211-0.0000 ( 7409 PWs) bands (ev): -61.0810 -61.0810 -33.9834 -33.9834 -25.3089 -25.3089 -25.3083 -25.3083 -4.4511 -4.4483 -4.1668 -4.1337 -4.1124 -4.1038 -3.9769 -3.9466 2.1588 2.2104 2.3594 2.3930 2.5492 2.5565 2.8801 2.9325 3.0735 3.1728 3.4157 3.4291 3.4829 3.4909 3.5011 3.5718 3.5824 3.6015 3.8463 3.8739 3.9756 4.0086 4.0278 4.0381 4.3381 4.3585 4.4598 4.4883 4.5039 4.5213 4.6260 4.6489 4.6583 4.6845 4.6856 4.7308 4.8754 4.9204 5.0618 5.1149 5.1265 5.2086 5.2752 5.3171 5.4527 5.4547 5.4633 5.4741 6.0541 6.0672 6.1690 6.1804 6.6437 6.6571 8.4248 8.4320 8.6222 8.7913 9.0536 9.1661 9.1859 9.2470 9.4119 9.4690 11.1615 11.1768 11.4013 11.5156 k = 0.4079 0.4079-0.0000 ( 7407 PWs) bands (ev): -61.0810 -61.0810 -33.9834 -33.9834 -25.3089 -25.3089 -25.3083 -25.3083 -4.4810 -4.4776 -4.1601 -4.1258 -4.1071 -4.0973 -3.9591 -3.9279 2.1482 2.2049 2.3496 2.3872 2.5752 2.5769 2.8336 2.8953 3.0747 3.1835 3.4247 3.4359 3.4925 3.4935 3.5104 3.5794 3.5828 3.6166 3.8454 3.8777 3.9781 4.0155 4.0444 4.0554 4.3368 4.3596 4.4547 4.4874 4.5044 4.5236 4.6258 4.6443 4.6634 4.6777 4.6832 4.7320 4.8820 4.9307 5.0590 5.1054 5.1368 5.2107 5.2709 5.3204 5.4422 5.4511 5.4857 5.5055 6.0487 6.0617 6.1598 6.1734 6.6243 6.6382 8.4266 8.4358 8.5910 8.7758 9.0275 9.1306 9.1528 9.2456 9.4104 9.4689 11.1600 11.1797 11.4729 11.6110 k = 0.3947 0.3947-0.0000 ( 7431 PWs) bands (ev): -61.0810 -61.0810 -33.9834 -33.9834 -25.3089 -25.3089 -25.3083 -25.3083 -4.5123 -4.5086 -4.1522 -4.1172 -4.1001 -4.0897 -3.9416 -3.9097 2.1372 2.1983 2.3367 2.3771 2.5978 2.6055 2.7861 2.8592 3.0788 3.1954 3.4352 3.4432 3.4931 3.4996 3.5243 3.5842 3.5844 3.6344 3.8448 3.8819 3.9811 4.0224 4.0622 4.0733 4.3356 4.3601 4.4498 4.4867 4.5047 4.5253 4.6255 4.6397 4.6678 4.6721 4.6802 4.7333 4.8895 4.9400 5.0547 5.0912 5.1563 5.2178 5.2666 5.3234 5.4283 5.4386 5.5166 5.5369 6.0441 6.0540 6.1492 6.1632 6.6069 6.6208 8.4287 8.4403 8.5598 8.7562 8.9998 9.0937 9.1226 9.2430 9.4065 9.4652 11.1568 11.1813 11.5405 11.7035 k = 0.3816 0.3816-0.0000 ( 7425 PWs) bands (ev): -61.0810 -61.0810 -33.9834 -33.9834 -25.3089 -25.3089 -25.3083 -25.3083 -4.5447 -4.5408 -4.1432 -4.1079 -4.0916 -4.0809 -3.9246 -3.8923 2.1258 2.1905 2.3209 2.3634 2.6154 2.6389 2.7388 2.8280 3.0861 3.2090 3.4470 3.4505 3.4931 3.5054 3.5378 3.5884 3.5887 3.6526 3.8449 3.8866 3.9846 4.0295 4.0808 4.0917 4.3345 4.3601 4.4452 4.4865 4.5051 4.5266 4.6251 4.6355 4.6624 4.6766 4.6769 4.7348 4.8975 4.9478 5.0494 5.0792 5.1785 5.2296 5.2625 5.3264 5.4136 5.4252 5.5458 5.5672 6.0416 6.0437 6.1381 6.1490 6.5927 6.6064 8.4311 8.4454 8.5292 8.7337 8.9703 9.0564 9.0959 9.2385 9.4000 9.4583 11.1509 11.1808 11.5948 11.7526 k = 0.3684 0.3684-0.0000 ( 7433 PWs) bands (ev): -61.0810 -61.0810 -33.9834 -33.9834 -25.3088 -25.3088 -25.3083 -25.3083 -4.5777 -4.5738 -4.1332 -4.0978 -4.0819 -4.0711 -3.9084 -3.8759 2.1136 2.1811 2.3025 2.3466 2.6237 2.6682 2.6981 2.8081 3.0972 3.2244 3.4571 3.4597 3.4927 3.5125 3.5480 3.5927 3.5971 3.6703 3.8455 3.8917 3.9885 4.0364 4.0999 4.1099 4.3335 4.3593 4.4408 4.4868 4.5054 4.5276 4.6244 4.6320 4.6550 4.6735 4.6833 4.7367 4.9058 4.9537 5.0437 5.0697 5.2023 5.2450 5.2586 5.3291 5.3988 5.4111 5.5720 5.5955 6.0299 6.0423 6.1280 6.1303 6.5825 6.5958 8.4336 8.4510 8.4998 8.7093 8.9392 9.0194 9.0723 9.2315 9.3906 9.4482 11.1413 11.1772 11.6252 11.7198 k = 0.3553 0.3553-0.0000 ( 7425 PWs) bands (ev): -61.0810 -61.0810 -33.9834 -33.9834 -25.3088 -25.3088 -25.3083 -25.3083 -4.6111 -4.6072 -4.1223 -4.0871 -4.0710 -4.0604 -3.8931 -3.8606 2.1005 2.1699 2.2818 2.3268 2.6159 2.6382 2.7192 2.8059 3.1124 3.2419 3.4626 3.4733 3.4918 3.5215 3.5542 3.5976 3.6104 3.6874 3.8469 3.8975 3.9926 4.0432 4.1189 4.1278 4.3325 4.3577 4.4368 4.4875 4.5058 4.5285 4.6233 4.6291 4.6474 4.6700 4.6906 4.7393 4.9141 4.9575 5.0381 5.0632 5.2268 5.2549 5.2630 5.3316 5.3846 5.3966 5.5948 5.6211 6.0113 6.0472 6.1074 6.1217 6.5766 6.5896 8.4361 8.4548 8.4744 8.6842 8.9072 8.9832 9.0511 9.2221 9.3784 9.4351 11.1270 11.1694 11.6273 11.6807 k = 0.3421 0.3421-0.0000 ( 7425 PWs) bands (ev): -61.0810 -61.0810 -33.9834 -33.9834 -25.3088 -25.3088 -25.3083 -25.3083 -4.6447 -4.6410 -4.1105 -4.0756 -4.0591 -4.0488 -3.8788 -3.8464 2.0860 2.1565 2.2590 2.3045 2.5923 2.5925 2.7580 2.8211 3.1321 3.2618 3.4669 3.4873 3.4909 3.5323 3.5575 3.6032 3.6273 3.7037 3.8491 3.9039 3.9967 4.0497 4.1375 4.1449 4.3316 4.3551 4.4331 4.4886 4.5061 4.5294 4.6215 4.6268 4.6398 4.6669 4.6984 4.7427 4.9220 4.9591 5.0331 5.0596 5.2500 5.2516 5.2823 5.3336 5.3725 5.3818 5.6140 5.6435 5.9876 6.0536 6.0846 6.1210 6.5748 6.5877 8.4385 8.4397 8.4701 8.6592 8.8752 8.9482 9.0312 9.2099 9.3632 9.4190 11.1067 11.1557 11.6103 11.6450 k = 0.3289 0.3289-0.0000 ( 7425 PWs) bands (ev): -61.0810 -61.0810 -33.9834 -33.9834 -25.3087 -25.3087 -25.3083 -25.3083 -4.6782 -4.6747 -4.0979 -4.0636 -4.0462 -4.0363 -3.8656 -3.8334 2.0702 2.1408 2.2343 2.2797 2.5470 2.5593 2.7987 2.8473 3.1565 3.2840 3.4702 3.4895 3.5016 3.5440 3.5601 3.6098 3.6464 3.7193 3.8524 3.9110 4.0010 4.0559 4.1553 4.1611 4.3307 4.3515 4.4298 4.4900 4.5064 4.5306 4.6186 4.6252 4.6324 4.6645 4.7068 4.7469 4.9294 4.9588 5.0290 5.0587 5.2487 5.2684 5.3014 5.3352 5.3651 5.3670 5.6305 5.6629 5.9594 6.0389 6.0855 6.1272 6.5767 6.5896 8.4156 8.4404 8.4775 8.6351 8.8439 8.9144 9.0120 9.1949 9.3449 9.4001 11.0795 11.1347 11.5865 11.6147 k = 0.3158 0.3158-0.0000 ( 7415 PWs) bands (ev): -61.0810 -61.0810 -33.9834 -33.9833 -25.3087 -25.3087 -25.3083 -25.3083 -4.7115 -4.7082 -4.0846 -4.0509 -4.0326 -4.0232 -3.8534 -3.8217 2.0528 2.1227 2.2078 2.2528 2.5025 2.5217 2.8400 2.8794 3.1854 3.3085 3.4727 3.4883 3.5151 3.5528 3.5664 3.6177 3.6669 3.7341 3.8569 3.9189 4.0052 4.0617 4.1719 4.1763 4.3297 4.3469 4.4273 4.4912 4.5067 4.5323 4.6147 4.6238 4.6259 4.6628 4.7158 4.7522 4.9361 4.9573 5.0262 5.0599 5.2464 5.2764 5.3183 5.3389 5.3526 5.3645 5.6458 5.6802 5.9281 6.0071 6.1070 6.1401 6.5815 6.5945 8.3925 8.4414 8.4865 8.6126 8.8141 8.8822 8.9926 9.1771 9.3236 9.3783 11.0450 11.1054 11.5629 11.5903 k = 0.3026 0.3026-0.0000 ( 7417 PWs) bands (ev): -61.0810 -61.0810 -33.9833 -33.9833 -25.3087 -25.3087 -25.3083 -25.3083 -4.7445 -4.7414 -4.0707 -4.0378 -4.0182 -4.0094 -3.8422 -3.8111 2.0339 2.1022 2.1798 2.2238 2.4594 2.4822 2.8815 2.9144 3.2187 3.3351 3.4749 3.4871 3.5275 3.5552 3.5799 3.6274 3.6882 3.7481 3.8628 3.9277 4.0093 4.0670 4.1872 4.1904 4.3286 4.3414 4.4255 4.4920 4.5067 4.5345 4.6097 4.6188 4.6243 4.6621 4.7255 4.7587 4.9420 4.9551 5.0248 5.0627 5.2447 5.2719 5.3279 5.3420 5.3453 5.3705 5.6624 5.6970 5.8951 5.9718 6.1355 6.1588 6.5885 6.6017 8.3711 8.4413 8.4962 8.5921 8.7863 8.8517 8.9727 9.1566 9.2995 9.3539 11.0033 11.0672 11.5424 11.5717 k = 0.2895 0.2895-0.0000 ( 7415 PWs) bands (ev): -61.0810 -61.0810 -33.9833 -33.9833 -25.3086 -25.3086 -25.3082 -25.3082 -4.7769 -4.7741 -4.0562 -4.0242 -4.0032 -3.9951 -3.8321 -3.8017 2.0135 2.0796 2.1503 2.1932 2.4178 2.4422 2.9227 2.9509 3.2561 3.3633 3.4772 3.4860 3.5382 3.5553 3.5963 3.6393 3.7101 3.7614 3.8702 3.9377 4.0133 4.0719 4.2008 4.2033 4.3273 4.3352 4.4249 4.4918 4.5062 4.5372 4.6040 4.6139 4.6245 4.6622 4.7359 4.7665 4.9471 4.9528 5.0249 5.0664 5.2437 5.2601 5.3194 5.3447 5.3511 5.3801 5.6828 5.7155 5.8620 5.9353 6.1684 6.1824 6.5970 6.6105 8.3518 8.4396 8.5061 8.5738 8.7609 8.8230 8.9519 9.1334 9.2728 9.3269 10.9548 11.0206 11.5249 11.5579 k = 0.2763 0.2763-0.0000 ( 7407 PWs) bands (ev): -61.0810 -61.0810 -33.9833 -33.9833 -25.3086 -25.3086 -25.3082 -25.3082 -4.8087 -4.8062 -4.0413 -4.0102 -3.9876 -3.9803 -3.8230 -3.7934 1.9917 2.0549 2.1198 2.1610 2.3776 2.4022 2.9634 2.9880 3.2970 3.3923 3.4802 3.4850 3.5469 3.5548 3.6141 3.6535 3.7320 3.7739 3.8792 3.9489 4.0172 4.0763 4.2125 4.2150 4.3259 4.3283 4.4256 4.4902 4.5048 4.5405 4.5981 4.6107 4.6253 4.6631 4.7471 4.7754 4.9510 4.9517 5.0265 5.0707 5.2434 5.2453 5.3062 5.3468 5.3554 5.3885 5.7086 5.7369 5.8305 5.8988 6.2044 6.2097 6.6065 6.6201 8.3347 8.4361 8.5160 8.5577 8.7383 8.7964 8.9301 9.1078 9.2437 9.2974 10.9004 10.9666 11.5086 11.5475 k = 0.2632 0.2632-0.0000 ( 7407 PWs) bands (ev): -61.0810 -61.0810 -33.9833 -33.9833 -25.3085 -25.3085 -25.3082 -25.3082 -4.8397 -4.8374 -4.0259 -3.9961 -3.9717 -3.9651 -3.8148 -3.7862 1.9687 2.0286 2.0882 2.1277 2.3388 2.3626 3.0034 3.0249 3.3406 3.4202 3.4842 3.4853 3.5534 3.5539 3.6328 3.6700 3.7538 3.7856 3.8898 3.9615 4.0209 4.0802 4.2223 4.2255 4.3209 4.3242 4.4279 4.4866 4.5022 4.5443 4.5926 4.6095 4.6266 4.6645 4.7590 4.7857 4.9499 4.9559 5.0295 5.0753 5.2293 5.2436 5.2934 5.3436 5.3585 5.3935 5.7405 5.7568 5.8071 5.8628 6.2394 6.2422 6.6163 6.6300 8.3196 8.4311 8.5252 8.5433 8.7189 8.7720 8.9071 9.0799 9.2128 9.2657 10.8408 10.9061 11.4906 11.5387 k = 0.2500 0.2500-0.0000 ( 7419 PWs) bands (ev): -61.0810 -61.0810 -33.9833 -33.9833 -25.3085 -25.3085 -25.3082 -25.3082 -4.8698 -4.8678 -4.0104 -3.9817 -3.9556 -3.9496 -3.8075 -3.7800 1.9449 2.0010 2.0560 2.0936 2.3013 2.3238 3.0424 3.0614 3.3861 3.4430 3.4835 3.4961 3.5528 3.5580 3.6521 3.6884 3.7751 3.7969 3.9020 3.9757 4.0245 4.0837 4.2300 4.2348 4.3133 4.3221 4.4318 4.4809 4.4980 4.5489 4.5880 4.6105 4.6284 4.6663 4.7714 4.7970 4.9496 4.9603 5.0336 5.0800 5.2129 5.2433 5.2825 5.3357 5.3596 5.3955 5.7502 5.7777 5.8180 5.8285 6.2707 6.2808 6.6262 6.6398 8.3067 8.4248 8.5298 8.5330 8.7026 8.7501 8.8828 9.0501 9.1803 9.2320 10.7766 10.8401 11.4680 11.5291 k = 0.2368 0.2368-0.0000 ( 7411 PWs) bands (ev): -61.0810 -61.0810 -33.9833 -33.9833 -25.3085 -25.3085 -25.3082 -25.3082 -4.8989 -4.8972 -3.9946 -3.9674 -3.9392 -3.9340 -3.8010 -3.7747 1.9203 1.9725 2.0232 2.0589 2.2650 2.2857 3.0802 3.0970 3.4326 3.4566 3.4830 3.5161 3.5520 3.5613 3.6720 3.7082 3.7954 3.8078 3.9154 3.9915 4.0281 4.0868 4.2359 4.2429 4.3056 4.3198 4.4374 4.4728 4.4920 4.5545 4.5851 4.6135 4.6308 4.6684 4.7844 4.8094 4.9506 4.9652 5.0386 5.0847 5.1967 5.2408 5.2753 5.3245 5.3572 5.3969 5.7254 5.7916 5.8242 5.8546 6.3026 6.3195 6.6357 6.6492 8.2960 8.4180 8.5167 8.5388 8.6893 8.7308 8.8573 9.0186 9.1469 9.1967 10.7083 10.7695 11.4396 11.5151 k = 0.2237 0.2237-0.0000 ( 7397 PWs) bands (ev): -61.0809 -61.0809 -33.9833 -33.9833 -25.3084 -25.3084 -25.3081 -25.3081 -4.9270 -4.9255 -3.9788 -3.9530 -3.9228 -3.9183 -3.7951 -3.7702 1.8955 1.9435 1.9902 2.0239 2.2300 2.2486 3.1167 3.1315 3.4631 3.4785 3.4829 3.5394 3.5545 3.5639 3.6922 3.7289 3.8145 3.8188 3.9299 4.0089 4.0315 4.0897 4.2400 4.2498 4.2980 4.3173 4.4437 4.4627 4.4852 4.5614 4.5840 4.6178 4.6336 4.6706 4.7976 4.8225 4.9528 4.9708 5.0443 5.0892 5.1810 5.2344 5.2732 5.3120 5.3505 5.4000 5.6992 5.7609 5.8703 5.8995 6.3345 6.3576 6.6445 6.6578 8.2876 8.4114 8.5035 8.5417 8.6785 8.7144 8.8308 8.9860 9.1130 9.1601 10.6363 10.6949 11.4069 11.4904 k = 0.2105 0.2105-0.0000 ( 7391 PWs) bands (ev): -61.0809 -61.0809 -33.9833 -33.9833 -25.3084 -25.3084 -25.3081 -25.3081 -4.9539 -4.9526 -3.9631 -3.9389 -3.9065 -3.9027 -3.7899 -3.7666 1.8705 1.9145 1.9573 1.9889 2.1961 2.2126 3.1516 3.1645 3.4667 3.4828 3.5213 3.5452 3.5680 3.5767 3.7127 3.7502 3.8299 3.8321 3.9450 4.0274 4.0351 4.0923 4.2427 4.2553 4.2909 4.3145 4.4479 4.4509 4.4806 4.5696 4.5845 4.6231 4.6370 4.6729 4.8112 4.8362 4.9564 4.9774 5.0507 5.0933 5.1658 5.2248 5.2730 5.3016 5.3403 5.4051 5.6743 5.7308 5.9210 5.9493 6.3660 6.3945 6.6525 6.6654 8.2813 8.4055 8.4899 8.5415 8.6693 8.7005 8.8034 8.9527 9.0791 9.1228 10.5608 10.6164 11.3721 11.4527 k = 0.1974 0.1974-0.0000 ( 7375 PWs) bands (ev): -61.0809 -61.0809 -33.9833 -33.9833 -25.3083 -25.3083 -25.3081 -25.3081 -4.9795 -4.9785 -3.9475 -3.9251 -3.8904 -3.8872 -3.7853 -3.7636 1.8458 1.8858 1.9246 1.9543 2.1634 2.1777 3.1847 3.1959 3.4693 3.4832 3.5442 3.5485 3.5850 3.6056 3.7332 3.7716 3.8417 3.8482 3.9603 4.0389 4.0466 4.0950 4.2442 4.2592 4.2847 4.3115 4.4377 4.4442 4.4842 4.5790 4.5865 4.6289 4.6408 4.6752 4.8249 4.8501 4.9613 4.9848 5.0576 5.0970 5.1514 5.2138 5.2675 5.3001 5.3284 5.4118 5.6513 5.7025 5.9746 6.0025 6.3966 6.4298 6.6595 6.6720 8.2773 8.4007 8.4762 8.5379 8.6607 8.6885 8.7755 8.9191 9.0458 9.0853 10.4819 10.5345 11.3374 11.4097 k = 0.1842 0.1842-0.0000 ( 7385 PWs) bands (ev): -61.0809 -61.0809 -33.9833 -33.9833 -25.3083 -25.3083 -25.3081 -25.3081 -5.0039 -5.0030 -3.9322 -3.9117 -3.8745 -3.8719 -3.7811 -3.7612 1.8216 1.8576 1.8925 1.9202 2.1319 2.1441 3.2157 3.2253 3.4716 3.4839 3.5426 3.5544 3.6198 3.6342 3.7536 3.7929 3.8541 3.8627 3.9755 4.0429 4.0654 4.0980 4.2449 4.2607 4.2803 4.3084 4.4237 4.4334 4.4954 4.5894 4.5896 4.6347 4.6452 4.6774 4.8388 4.8641 4.9676 4.9928 5.0649 5.1000 5.1380 5.2022 5.2567 5.3075 5.3161 5.4197 5.6305 5.6762 6.0303 6.0581 6.4259 6.4631 6.6654 6.6774 8.2755 8.3973 8.4626 8.5314 8.6518 8.6772 8.7476 8.8859 9.0134 9.0483 10.3998 10.4493 11.3038 11.3655 k = 0.1711 0.1711-0.0000 ( 7389 PWs) bands (ev): -61.0809 -61.0809 -33.9833 -33.9833 -25.3083 -25.3083 -25.3081 -25.3081 -5.0268 -5.0261 -3.9174 -3.8988 -3.8592 -3.8571 -3.7773 -3.7593 1.7981 1.8304 1.8612 1.8869 2.1017 2.1119 3.2444 3.2525 3.4741 3.4852 3.5408 3.5546 3.6560 3.6614 3.7738 3.8140 3.8673 3.8757 3.9901 4.0475 4.0820 4.1025 4.2451 4.2594 4.2785 4.3052 4.4091 4.4197 4.5105 4.5937 4.6003 4.6405 4.6500 4.6795 4.8531 4.8780 4.9750 5.0010 5.0722 5.1019 5.1256 5.1901 5.2461 5.3047 5.3192 5.4284 5.6119 5.6519 6.0874 6.1153 6.4538 6.4940 6.6701 6.6816 8.2761 8.3954 8.4496 8.5229 8.6412 8.6650 8.7207 8.8537 8.9824 9.0124 10.3149 10.3609 11.2716 11.3178 k = 0.1579 0.1579-0.0000 ( 7389 PWs) bands (ev): -61.0809 -61.0809 -33.9833 -33.9833 -25.3082 -25.3082 -25.3081 -25.3081 -5.0483 -5.0477 -3.9032 -3.8866 -3.8443 -3.8427 -3.7738 -3.7578 1.7756 1.8043 1.8311 1.8548 2.0730 2.0812 3.2706 3.2773 3.4770 3.4870 3.5390 3.5535 3.6868 3.6888 3.7937 3.8349 3.8812 3.8875 4.0038 4.0526 4.0929 4.1113 4.2452 4.2562 4.2786 4.3021 4.3942 4.4047 4.5276 4.5985 4.6112 4.6462 4.6551 4.6813 4.8680 4.8918 4.9831 5.0088 5.0791 5.1022 5.1149 5.1776 5.2384 5.2949 5.3336 5.4378 5.5957 5.6299 6.1453 6.1734 6.4801 6.5222 6.6737 6.6846 8.2788 8.3946 8.4377 8.5131 8.6277 8.6505 8.6966 8.8232 8.9529 8.9782 10.2274 10.2699 11.2385 11.2645 k = 0.1447 0.1447-0.0000 ( 7393 PWs) bands (ev): -61.0809 -61.0809 -33.9833 -33.9833 -25.3082 -25.3082 -25.3081 -25.3081 -5.0683 -5.0678 -3.8897 -3.8753 -3.8302 -3.8290 -3.7705 -3.7566 1.7542 1.7797 1.8022 1.8240 2.0458 2.0523 3.2940 3.2995 3.4804 3.4894 3.5372 3.5517 3.7102 3.7171 3.8131 3.8554 3.8953 3.8980 4.0164 4.0585 4.0981 4.1238 4.2454 4.2528 4.2792 4.2990 4.3794 4.3892 4.5458 4.6041 4.6216 4.6516 4.6604 4.6829 4.8836 4.9056 4.9916 5.0159 5.0847 5.0984 5.1079 5.1645 5.2351 5.2874 5.3502 5.4479 5.5819 5.6101 6.2034 6.2314 6.5045 6.5476 6.6762 6.6865 8.2836 8.3940 8.4279 8.5029 8.6099 8.6328 8.6770 8.7949 8.9250 8.9464 10.1380 10.1765 11.1947 11.2085 k = 0.1316 0.1316-0.0000 ( 7385 PWs) bands (ev): -61.0809 -61.0809 -33.9832 -33.9832 -25.3082 -25.3082 -25.3080 -25.3080 -5.0867 -5.0864 -3.8770 -3.8648 -3.8168 -3.8160 -3.7673 -3.7556 1.7342 1.7565 1.7750 1.7948 2.0202 2.0253 3.3146 3.3189 3.4846 3.4927 3.5355 3.5497 3.7315 3.7408 3.8320 3.8754 3.9076 3.9093 4.0278 4.0650 4.1015 4.1354 4.2458 4.2501 4.2799 4.2961 4.3648 4.3738 4.5645 4.6102 4.6312 4.6569 4.6656 4.6843 4.8999 4.9194 5.0000 5.0220 5.0882 5.0907 5.1047 5.1510 5.2367 5.2826 5.3685 5.4585 5.5706 5.5927 6.2611 6.2888 6.5271 6.5699 6.6778 6.6875 8.2904 8.3916 8.4220 8.4929 8.5879 8.6116 8.6632 8.7696 8.8988 8.9170 10.0473 10.0815 11.1419 11.1527 k = 0.1184 0.1184-0.0000 ( 7369 PWs) bands (ev): -61.0809 -61.0809 -33.9832 -33.9832 -25.3081 -25.3081 -25.3080 -25.3080 -5.1035 -5.1033 -3.8653 -3.8554 -3.8043 -3.8038 -3.7643 -3.7547 1.7157 1.7351 1.7497 1.7675 1.9966 2.0004 3.3321 3.3354 3.4895 3.4966 3.5340 3.5474 3.7506 3.7603 3.8502 3.8945 3.9163 3.9224 4.0383 4.0718 4.1045 4.1445 4.2467 4.2487 4.2804 4.2934 4.3506 4.3586 4.5828 4.6168 4.6398 4.6619 4.6704 4.6854 4.9167 4.9334 5.0078 5.0270 5.0826 5.0891 5.1016 5.1377 5.2427 5.2803 5.3883 5.4695 5.5616 5.5778 6.3174 6.3445 6.5477 6.5890 6.6785 6.6876 8.2985 8.3861 8.4211 8.4834 8.5632 8.5876 8.6551 8.7477 8.8742 8.8903 9.9561 9.9858 11.0892 11.0985 k = 0.1053 0.1053-0.0000 ( 7357 PWs) bands (ev): -61.0809 -61.0809 -33.9832 -33.9832 -25.3081 -25.3081 -25.3080 -25.3080 -5.1186 -5.1185 -3.8548 -3.8470 -3.7929 -3.7926 -3.7613 -3.7539 1.6989 1.7156 1.7265 1.7423 1.9748 1.9776 3.3467 3.3491 3.4952 3.5013 3.5327 3.5451 3.7675 3.7761 3.8675 3.9120 3.9243 3.9343 4.0483 4.0786 4.1074 4.1503 4.2480 4.2486 4.2806 4.2909 4.3372 4.3441 4.6002 4.6238 4.6473 4.6666 4.6746 4.6862 4.9337 4.9475 5.0146 5.0309 5.0753 5.0878 5.0976 5.1248 5.2515 5.2803 5.4095 5.4809 5.5550 5.5656 6.3717 6.3975 6.5664 6.6051 6.6786 6.6872 8.3076 8.3784 8.4234 8.4747 8.5380 8.5618 8.6523 8.7299 8.8511 8.8658 9.8656 9.8905 11.0392 11.0467 k = 0.0921 0.0921-0.0000 ( 7349 PWs) bands (ev): -61.0809 -61.0809 -33.9832 -33.9832 -25.3080 -25.3080 -25.3080 -25.3080 -5.1321 -5.1320 -3.8455 -3.8397 -3.7825 -3.7824 -3.7585 -3.7531 1.6838 1.6980 1.7055 1.7194 1.9553 1.9571 3.3584 3.3601 3.5013 3.5065 3.5316 3.5429 3.7822 3.7890 3.8839 3.9274 3.9314 3.9446 4.0580 4.0851 4.1104 4.1529 4.2496 4.2496 4.2808 4.2887 4.3247 4.3304 4.6162 4.6310 4.6537 4.6709 4.6780 4.6867 4.9505 4.9616 5.0203 5.0338 5.0691 5.0848 5.0929 5.1127 5.2615 5.2819 5.4316 5.4925 5.5503 5.5560 6.4227 6.4466 6.5835 6.6183 6.6782 6.6863 8.3167 8.3702 8.4263 8.4668 8.5135 8.5356 8.6552 8.7170 8.8297 8.8434 9.7769 9.7969 10.9924 10.9980 k = 0.0789 0.0789-0.0000 ( 7351 PWs) bands (ev): -61.0809 -61.0809 -33.9832 -33.9832 -25.3080 -25.3080 -25.3080 -25.3080 -5.1438 -5.1438 -3.8375 -3.8335 -3.7734 -3.7734 -3.7558 -3.7521 1.6706 1.6825 1.6871 1.6989 1.9379 1.9391 3.3676 3.3686 3.5075 3.5119 3.5307 3.5406 3.7946 3.7995 3.8992 3.9380 3.9401 3.9531 4.0677 4.0913 4.1133 4.1527 4.2512 4.2512 4.2809 4.2867 4.3133 4.3179 4.6304 4.6385 4.6592 4.6748 4.6805 4.6869 4.9665 4.9752 5.0247 5.0358 5.0640 5.0807 5.0878 5.1015 5.2712 5.2845 5.4539 5.5042 5.5475 5.5490 6.4693 6.4902 6.5997 6.6292 6.6777 6.6852 8.3250 8.3622 8.4286 8.4596 8.4911 8.5103 8.6639 8.7100 8.8101 8.8229 9.6916 9.7067 10.9494 10.9532 k = 0.0658 0.0658-0.0000 ( 7361 PWs) bands (ev): -61.0809 -61.0809 -33.9832 -33.9832 -25.3080 -25.3080 -25.3080 -25.3080 -5.1538 -5.1538 -3.8309 -3.8284 -3.7655 -3.7655 -3.7533 -3.7511 1.6595 1.6691 1.6713 1.6812 1.9230 1.9237 3.3745 3.3751 3.5136 3.5171 3.5301 3.5385 3.8049 3.8079 3.9133 3.9438 3.9498 3.9599 4.0773 4.0972 4.1161 4.1504 4.2527 4.2528 4.2810 4.2851 4.3034 4.3070 4.6423 4.6461 4.6638 4.6780 4.6821 4.6868 4.9814 4.9879 5.0283 5.0371 5.0600 5.0762 5.0824 5.0915 5.2795 5.2873 5.4756 5.5156 5.5444 5.5458 6.5099 6.5264 6.6158 6.6387 6.6771 6.6839 8.3314 8.3548 8.4297 8.4529 8.4714 8.4873 8.6781 8.7096 8.7927 8.8043 9.6114 9.6219 10.9110 10.9133 k = 0.0526 0.0526-0.0000 ( 7359 PWs) bands (ev): -61.0809 -61.0809 -33.9832 -33.9832 -25.3080 -25.3080 -25.3080 -25.3080 -5.1620 -5.1620 -3.8257 -3.8243 -3.7590 -3.7589 -3.7511 -3.7500 1.6504 1.6579 1.6584 1.6663 1.9106 1.9110 3.3797 3.3800 3.5192 3.5220 3.5298 3.5367 3.8130 3.8147 3.9262 3.9490 3.9565 3.9649 4.0866 4.1030 4.1186 4.1463 4.2536 4.2538 4.2812 4.2838 4.2952 4.2979 4.6516 4.6541 4.6677 4.6802 4.6831 4.6865 4.9946 4.9993 5.0313 5.0380 5.0571 5.0715 5.0769 5.0825 5.2860 5.2900 5.4958 5.5260 5.5419 5.5451 6.5428 6.5536 6.6327 6.6479 6.6766 6.6826 8.3356 8.3483 8.4298 8.4466 8.4553 8.4677 8.6962 8.7154 8.7777 8.7878 9.5385 9.5449 10.8780 10.8792 k = 0.0395 0.0395-0.0000 ( 7369 PWs) bands (ev): -61.0809 -61.0809 -33.9832 -33.9832 -25.3080 -25.3080 -25.3080 -25.3080 -5.1684 -5.1684 -3.8218 -3.8212 -3.7539 -3.7538 -3.7494 -3.7490 1.6434 1.6484 1.6490 1.6543 1.9009 1.9010 3.3833 3.3834 3.5239 3.5260 3.5297 3.5349 3.8191 3.8199 3.9376 3.9535 3.9605 3.9678 4.0955 4.1085 4.1205 4.1410 4.2538 4.2539 4.2816 4.2830 4.2890 4.2909 4.6587 4.6619 4.6707 4.6808 4.6839 4.6859 5.0056 5.0084 5.0348 5.0392 5.0554 5.0669 5.0713 5.0746 5.2906 5.2923 5.5134 5.5349 5.5411 5.5447 6.5664 6.5717 6.6497 6.6576 6.6764 6.6813 8.3373 8.3429 8.4292 8.4406 8.4431 8.4522 8.7161 8.7260 8.7658 8.7739 9.4755 9.4787 10.8513 10.8518 k = 0.0263 0.0263-0.0000 ( 7369 PWs) bands (ev): -61.0809 -61.0809 -33.9832 -33.9832 -25.3080 -25.3080 -25.3080 -25.3080 -5.1730 -5.1730 -3.8191 -3.8190 -3.7502 -3.7501 -3.7481 -3.7480 1.6387 1.6414 1.6424 1.6453 1.8938 1.8939 3.3857 3.3858 3.5276 3.5290 3.5299 3.5334 3.8234 3.8236 3.9476 3.9573 3.9625 3.9683 4.1041 4.1135 4.1217 4.1348 4.2534 4.2534 4.2819 4.2826 4.2849 4.2862 4.6648 4.6680 4.6731 4.6798 4.6846 4.6854 5.0134 5.0145 5.0394 5.0415 5.0548 5.0628 5.0656 5.0675 5.2936 5.2941 5.5275 5.5411 5.5413 5.5443 6.5810 6.5826 6.6644 6.6674 6.6765 6.6799 8.3371 8.3388 8.4286 8.4350 8.4355 8.4410 8.7343 8.7384 8.7574 8.7630 9.4260 9.4271 10.8316 10.8317 k = 0.0132 0.0132-0.0000 ( 7395 PWs) bands (ev): -61.0809 -61.0809 -33.9832 -33.9832 -25.3080 -25.3080 -25.3080 -25.3080 -5.1757 -5.1757 -3.8176 -3.8176 -3.7479 -3.7479 -3.7474 -3.7474 1.6363 1.6375 1.6382 1.6394 1.8896 1.8896 3.3871 3.3871 3.5300 3.5305 3.5307 3.5321 3.8258 3.8258 3.9558 3.9601 3.9629 3.9664 4.1123 4.1175 4.1216 4.1277 4.2527 4.2527 4.2822 4.2824 4.2828 4.2834 4.6700 4.6722 4.6744 4.6775 4.6846 4.6848 5.0175 5.0177 5.0449 5.0455 5.0553 5.0593 5.0600 5.0610 5.2951 5.2952 5.5374 5.5420 5.5437 5.5441 6.5882 6.5884 6.6742 6.6750 6.6769 6.6787 8.3361 8.3364 8.4285 8.4307 8.4318 8.4338 8.7472 8.7485 8.7528 8.7557 9.3937 9.3939 10.8195 10.8195 k = 0.0000 0.0000 0.0000 ( 7441 PWs) bands (ev): -61.0810 -61.0810 -33.9833 -33.9833 -25.3081 -25.3081 -25.3081 -25.3081 -5.1767 -5.1767 -3.8172 -3.8172 -3.7471 -3.7471 -3.7471 -3.7471 1.6365 1.6365 1.6365 1.6365 1.8881 1.8881 3.3875 3.3875 3.5311 3.5311 3.5311 3.5311 3.8265 3.8265 3.9620 3.9620 3.9620 3.9620 4.1202 4.1202 4.1202 4.1202 4.2523 4.2523 4.2822 4.2822 4.2822 4.2822 4.6742 4.6742 4.6742 4.6742 4.6845 4.6845 5.0187 5.0187 5.0485 5.0485 5.0568 5.0568 5.0568 5.0568 5.2955 5.2955 5.5429 5.5429 5.5429 5.5429 6.5903 6.5903 6.6777 6.6777 6.6777 6.6777 8.3356 8.3356 8.4299 8.4299 8.4299 8.4299 8.7522 8.7522 8.7522 8.7522 9.3824 9.3824 10.8154 10.8154 k = 0.0000 0.0000 0.0000 ( 7441 PWs) bands (ev): -61.0810 -61.0810 -33.9833 -33.9833 -25.3081 -25.3081 -25.3081 -25.3081 -5.1767 -5.1767 -3.8172 -3.8172 -3.7471 -3.7471 -3.7471 -3.7471 1.6365 1.6365 1.6365 1.6365 1.8881 1.8881 3.3875 3.3875 3.5311 3.5311 3.5311 3.5311 3.8265 3.8265 3.9620 3.9620 3.9620 3.9620 4.1202 4.1202 4.1202 4.1202 4.2523 4.2523 4.2822 4.2822 4.2822 4.2822 4.6742 4.6742 4.6742 4.6742 4.6845 4.6845 5.0187 5.0187 5.0485 5.0485 5.0568 5.0568 5.0568 5.0568 5.2955 5.2955 5.5429 5.5429 5.5429 5.5429 6.5903 6.5903 6.6777 6.6777 6.6777 6.6777 8.3356 8.3356 8.4299 8.4299 8.4299 8.4299 8.7522 8.7522 8.7522 8.7522 9.3824 9.3824 10.8154 10.8154 k = 0.0109 0.0109 0.0109 ( 7390 PWs) bands (ev): -61.0809 -61.0809 -33.9832 -33.9832 -25.3080 -25.3080 -25.3080 -25.3080 -5.1757 -5.1757 -3.8176 -3.8176 -3.7477 -3.7477 -3.7477 -3.7476 1.6363 1.6378 1.6378 1.6395 1.8896 1.8896 3.3871 3.3871 3.5302 3.5304 3.5304 3.5322 3.8258 3.8258 3.9555 3.9616 3.9616 3.9665 4.1120 4.1195 4.1195 4.1281 4.2527 4.2527 4.2823 4.2823 4.2828 4.2835 4.6699 4.6733 4.6733 4.6778 4.6847 4.6847 5.0176 5.0176 5.0452 5.0452 5.0550 5.0595 5.0606 5.0606 5.2951 5.2951 5.5370 5.5430 5.5430 5.5440 6.5883 6.5883 6.6744 6.6744 6.6769 6.6789 8.3363 8.3363 8.4287 8.4313 8.4313 8.4338 8.7475 8.7475 8.7529 8.7561 9.3941 9.3941 10.8196 10.8196 k = 0.0217 0.0217 0.0217 ( 7370 PWs) bands (ev): -61.0809 -61.0809 -33.9832 -33.9832 -25.3080 -25.3080 -25.3080 -25.3080 -5.1729 -5.1729 -3.8191 -3.8191 -3.7492 -3.7492 -3.7492 -3.7490 1.6390 1.6420 1.6420 1.6453 1.8940 1.8940 3.3857 3.3857 3.5284 3.5284 3.5295 3.5335 3.8234 3.8234 3.9469 3.9600 3.9600 3.9684 4.1038 4.1173 4.1173 4.1355 4.2533 4.2533 4.2824 4.2824 4.2850 4.2863 4.6646 4.6704 4.6704 4.6804 4.6849 4.6849 5.0135 5.0135 5.0409 5.0409 5.0541 5.0631 5.0668 5.0668 5.2937 5.2937 5.5263 5.5405 5.5436 5.5436 6.5814 6.5814 6.6654 6.6654 6.6767 6.6807 8.3380 8.3380 8.4300 8.4354 8.4354 8.4399 8.7351 8.7351 8.7580 8.7646 9.4275 9.4275 10.8321 10.8321 k = 0.0326 0.0326 0.0326 ( 7370 PWs) bands (ev): -61.0809 -61.0809 -33.9832 -33.9832 -25.3080 -25.3080 -25.3080 -25.3080 -5.1682 -5.1682 -3.8214 -3.8214 -3.7519 -3.7519 -3.7516 -3.7513 1.6445 1.6488 1.6488 1.6540 1.9013 1.9013 3.3833 3.3833 3.5252 3.5252 3.5290 3.5350 3.8194 3.8194 3.9365 3.9574 3.9574 3.9672 4.0959 4.1137 4.1137 4.1422 4.2530 4.2530 4.2835 4.2835 4.2886 4.2908 4.6582 4.6659 4.6659 4.6820 4.6848 4.6848 5.0052 5.0052 5.0387 5.0387 5.0539 5.0676 5.0733 5.0733 5.2912 5.2912 5.5108 5.5329 5.5450 5.5450 6.5673 6.5673 6.6535 6.6535 6.6767 6.6828 8.3401 8.3401 8.4339 8.4423 8.4423 8.4482 8.7182 8.7182 8.7674 8.7775 9.4789 9.4789 10.8525 10.8525 k = 0.0435 0.0435 0.0435 ( 7364 PWs) bands (ev): -61.0809 -61.0809 -33.9832 -33.9832 -25.3080 -25.3080 -25.3080 -25.3080 -5.1616 -5.1616 -3.8248 -3.8248 -3.7555 -3.7555 -3.7550 -3.7547 1.6526 1.6584 1.6584 1.6654 1.9113 1.9113 3.3797 3.3797 3.5209 3.5209 3.5288 3.5366 3.8138 3.8138 3.9246 3.9536 3.9536 3.9626 4.0887 4.1091 4.1091 4.1481 4.2508 4.2508 4.2865 4.2865 4.2938 4.2968 4.6510 4.6601 4.6601 4.6828 4.6841 4.6841 4.9931 4.9931 5.0386 5.0386 5.0544 5.0729 5.0801 5.0801 5.2872 5.2872 5.4912 5.5220 5.5482 5.5482 6.5432 6.5432 6.6420 6.6420 6.6768 6.6850 8.3416 8.3416 8.4404 8.4522 8.4522 8.4583 8.7008 8.7008 8.7806 8.7946 9.5440 9.5440 10.8804 10.8804 k = 0.0543 0.0543 0.0543 ( 7340 PWs) bands (ev): -61.0809 -61.0809 -33.9832 -33.9832 -25.3080 -25.3080 -25.3080 -25.3080 -5.1532 -5.1532 -3.8290 -3.8290 -3.7601 -3.7601 -3.7593 -3.7589 1.6634 1.6704 1.6704 1.6796 1.9241 1.9241 3.3746 3.3746 3.5158 3.5158 3.5288 3.5384 3.8066 3.8066 3.9112 3.9488 3.9488 3.9543 4.0826 4.1038 4.1038 4.1533 4.2460 4.2460 4.2918 4.2918 4.3005 4.3043 4.6430 4.6532 4.6532 4.6828 4.6831 4.6831 4.9781 4.9781 5.0396 5.0396 5.0555 5.0790 5.0873 5.0873 5.2818 5.2818 5.4680 5.5087 5.5540 5.5540 6.5081 6.5081 6.6327 6.6327 6.6766 6.6871 8.3417 8.3417 8.4494 8.4647 8.4647 8.4700 8.6863 8.6863 8.7973 8.8156 9.6188 9.6188 10.9151 10.9151 k = 0.0652 0.0652 0.0652 ( 7346 PWs) bands (ev): -61.0809 -61.0809 -33.9832 -33.9832 -25.3080 -25.3080 -25.3080 -25.3080 -5.1430 -5.1430 -3.8340 -3.8340 -3.7657 -3.7657 -3.7645 -3.7640 1.6767 1.6849 1.6849 1.6963 1.9395 1.9395 3.3677 3.3677 3.5101 3.5101 3.5290 3.5403 3.7977 3.7977 3.8966 3.9422 3.9427 3.9427 4.0775 4.0978 4.0978 4.1576 4.2386 4.2386 4.2990 4.2990 4.3084 4.3132 4.6341 4.6449 4.6449 4.6816 4.6816 4.6819 4.9607 4.9607 5.0412 5.0412 5.0570 5.0858 5.0947 5.0947 5.2751 5.2751 5.4421 5.4937 5.5629 5.5629 6.4635 6.4635 6.6251 6.6251 6.6759 6.6888 8.3400 8.3400 8.4608 8.4793 8.4793 8.4830 8.6771 8.6771 8.8168 8.8400 9.6996 9.6996 10.9557 10.9557 k = 0.0761 0.0761 0.0761 ( 7358 PWs) bands (ev): -61.0809 -61.0809 -33.9832 -33.9832 -25.3080 -25.3080 -25.3080 -25.3080 -5.1310 -5.1310 -3.8400 -3.8400 -3.7722 -3.7722 -3.7705 -3.7699 1.6923 1.7017 1.7017 1.7155 1.9573 1.9573 3.3586 3.3586 3.5044 3.5044 3.5294 3.5424 3.7872 3.7872 3.8806 3.9264 3.9354 3.9354 4.0736 4.0914 4.0914 4.1612 4.2290 4.2290 4.3074 4.3074 4.3176 4.3233 4.6245 4.6356 4.6356 4.6796 4.6796 4.6803 4.9417 4.9417 5.0427 5.0427 5.0590 5.0930 5.1025 5.1025 5.2673 5.2673 5.4142 5.4780 5.5755 5.5755 6.4111 6.4111 6.6182 6.6182 6.6744 6.6896 8.3365 8.3365 8.4744 8.4949 8.4949 8.4971 8.6747 8.6747 8.8386 8.8671 9.7836 9.7836 11.0011 11.0011 k = 0.0870 0.0870 0.0870 ( 7364 PWs) bands (ev): -61.0809 -61.0809 -33.9832 -33.9832 -25.3081 -25.3081 -25.3080 -25.3080 -5.1172 -5.1172 -3.8467 -3.8467 -3.7795 -3.7795 -3.7773 -3.7767 1.7100 1.7206 1.7206 1.7371 1.9774 1.9774 3.3468 3.3468 3.4988 3.4988 3.5301 3.5445 3.7752 3.7752 3.8635 3.9073 3.9270 3.9270 4.0706 4.0846 4.0846 4.1640 4.2175 4.2175 4.3168 4.3168 4.3278 4.3344 4.6144 4.6252 4.6252 4.6772 4.6772 4.6779 4.9214 4.9214 5.0440 5.0440 5.0613 5.1008 5.1106 5.1106 5.2595 5.2595 5.3854 5.4625 5.5920 5.5920 6.3528 6.3528 6.6112 6.6112 6.6719 6.6894 8.3317 8.3317 8.4901 8.5107 8.5107 8.5119 8.6798 8.6798 8.8622 8.8964 9.8679 9.8679 11.0496 11.0496 k = 0.0978 0.0978 0.0978 ( 7379 PWs) bands (ev): -61.0809 -61.0809 -33.9832 -33.9832 -25.3081 -25.3081 -25.3081 -25.3081 -5.1017 -5.1017 -3.8541 -3.8541 -3.7877 -3.7877 -3.7849 -3.7841 1.7297 1.7414 1.7414 1.7608 1.9996 1.9996 3.3321 3.3321 3.4937 3.4937 3.5311 3.5466 3.7616 3.7616 3.8454 3.8852 3.9172 3.9172 4.0683 4.0774 4.0774 4.1661 4.2043 4.2043 4.3268 4.3268 4.3389 4.3461 4.6038 4.6139 4.6139 4.6745 4.6745 4.6749 4.9006 4.9006 5.0447 5.0447 5.0639 5.1088 5.1190 5.1190 5.2522 5.2522 5.3565 5.4478 5.6123 5.6123 6.2898 6.2898 6.6037 6.6037 6.6684 6.6881 8.3265 8.3265 8.5077 8.5259 8.5259 8.5274 8.6921 8.6921 8.8868 8.9273 9.9500 9.9500 11.0996 11.0996 k = 0.1087 0.1087 0.1087 ( 7391 PWs) bands (ev): -61.0809 -61.0809 -33.9832 -33.9832 -25.3081 -25.3081 -25.3081 -25.3081 -5.0844 -5.0844 -3.8622 -3.8622 -3.7966 -3.7966 -3.7931 -3.7923 1.7511 1.7639 1.7639 1.7864 2.0236 2.0236 3.3142 3.3142 3.4893 3.4893 3.5324 3.5487 3.7466 3.7466 3.8264 3.8608 3.9064 3.9064 4.0665 4.0697 4.0697 4.1677 4.1896 4.1896 4.3370 4.3370 4.3507 4.3584 4.5932 4.6017 4.6017 4.6712 4.6716 4.6716 4.8796 4.8796 5.0450 5.0450 5.0670 5.1169 5.1275 5.1275 5.2464 5.2464 5.3286 5.4345 5.6361 5.6361 6.2235 6.2235 6.5953 6.5953 6.6636 6.6853 8.3217 8.3217 8.5270 8.5405 8.5405 8.5431 8.7107 8.7107 8.9120 8.9593 10.0274 10.0274 11.1488 11.1488 k = 0.1196 0.1196 0.1196 ( 7397 PWs) bands (ev): -61.0809 -61.0809 -33.9833 -33.9833 -25.3082 -25.3082 -25.3081 -25.3081 -5.0656 -5.0656 -3.8710 -3.8710 -3.8061 -3.8061 -3.8020 -3.8012 1.7741 1.7878 1.7878 1.8138 2.0492 2.0492 3.2930 3.2930 3.4857 3.4857 3.5339 3.5505 3.7304 3.7304 3.8066 3.8344 3.8944 3.8944 4.0613 4.0613 4.0651 4.1687 4.1741 4.1741 4.3473 4.3473 4.3631 4.3707 4.5827 4.5888 4.5888 4.6670 4.6685 4.6685 4.8589 4.8589 5.0448 5.0448 5.0705 5.1250 5.1362 5.1362 5.2426 5.2426 5.3024 5.4229 5.6633 5.6633 6.1546 6.1546 6.5859 6.5859 6.6576 6.6811 8.3181 8.3181 8.5478 8.5546 8.5546 8.5590 8.7341 8.7341 8.9372 8.9918 10.0982 10.0982 11.1951 11.1951 k = 0.1304 0.1304 0.1304 ( 7403 PWs) bands (ev): -61.0810 -61.0810 -33.9833 -33.9833 -25.3082 -25.3082 -25.3082 -25.3082 -5.0451 -5.0451 -3.8803 -3.8803 -3.8163 -3.8163 -3.8115 -3.8106 1.7982 1.8128 1.8128 1.8425 2.0760 2.0760 3.2685 3.2685 3.4829 3.4829 3.5357 3.5521 3.7130 3.7130 3.7863 3.8066 3.8814 3.8814 4.0515 4.0515 4.0639 4.1582 4.1582 4.1692 4.3573 4.3573 4.3756 4.3828 4.5727 4.5755 4.5755 4.6623 4.6653 4.6653 4.8391 4.8391 5.0446 5.0446 5.0748 5.1330 5.1448 5.1448 5.2410 5.2410 5.2788 5.4135 5.6935 5.6935 6.0842 6.0842 6.5755 6.5755 6.6504 6.6753 8.3166 8.3166 8.5684 8.5684 8.5700 8.5748 8.7611 8.7611 8.9623 9.0247 10.1606 10.1606 11.2367 11.2367 k = 0.1413 0.1413 0.1413 ( 7403 PWs) bands (ev): -61.0810 -61.0810 -33.9833 -33.9833 -25.3082 -25.3082 -25.3082 -25.3082 -5.0230 -5.0230 -3.8902 -3.8902 -3.8270 -3.8270 -3.8215 -3.8206 1.8231 1.8386 1.8386 1.8725 2.1037 2.1037 3.2408 3.2408 3.4806 3.4806 3.5378 3.5530 3.6949 3.6949 3.7655 3.7781 3.8673 3.8673 4.0398 4.0398 4.0629 4.1429 4.1429 4.1693 4.3668 4.3668 4.3882 4.3941 4.5621 4.5621 4.5639 4.6573 4.6620 4.6620 4.8203 4.8203 5.0450 5.0450 5.0800 5.1406 5.1534 5.1534 5.2416 5.2416 5.2585 5.4061 5.7264 5.7264 6.0130 6.0130 6.5641 6.5641 6.6420 6.6682 8.3177 8.3177 8.5822 8.5822 8.5902 8.5932 8.7907 8.7907 8.9869 9.0576 10.2133 10.2133 11.2725 11.2725 k = 0.1522 0.1522 0.1522 ( 7403 PWs) bands (ev): -61.0810 -61.0810 -33.9833 -33.9833 -25.3082 -25.3082 -25.3082 -25.3082 -4.9995 -4.9995 -3.9005 -3.9005 -3.8382 -3.8382 -3.8320 -3.8310 1.8487 1.8648 1.8648 1.9032 2.1319 2.1319 3.2101 3.2101 3.4787 3.4787 3.5401 3.5528 3.6764 3.6764 3.7445 3.7498 3.8522 3.8522 4.0258 4.0258 4.0619 4.1290 4.1290 4.1688 4.3756 4.3756 4.4005 4.4041 4.5488 4.5488 4.5566 4.6522 4.6587 4.6587 4.8030 4.8030 5.0463 5.0463 5.0864 5.1476 5.1619 5.1619 5.2420 5.2442 5.2442 5.4008 5.7617 5.7617 5.9418 5.9418 6.5517 6.5517 6.6326 6.6596 8.3215 8.3215 8.5960 8.5960 8.6051 8.6173 8.8222 8.8222 9.0110 9.0905 10.2559 10.2559 11.3023 11.3023 k = 0.1630 0.1630 0.1630 ( 7415 PWs) bands (ev): -61.0810 -61.0810 -33.9833 -33.9833 -25.3083 -25.3083 -25.3083 -25.3083 -4.9746 -4.9746 -3.9112 -3.9112 -3.8498 -3.8498 -3.8428 -3.8418 1.8745 1.8911 1.8911 1.9344 2.1600 2.1600 3.1766 3.1766 3.4771 3.4771 3.5427 3.5509 3.6579 3.6579 3.7227 3.7237 3.8361 3.8361 4.0092 4.0092 4.0610 4.1170 4.1170 4.1678 4.3834 4.3834 4.4122 4.4123 4.5360 4.5360 4.5515 4.6472 4.6555 4.6555 4.7871 4.7871 5.0493 5.0493 5.0941 5.1540 5.1700 5.1700 5.2299 5.2484 5.2484 5.3974 5.7984 5.7984 5.8721 5.8721 6.5385 6.5385 6.6222 6.6498 8.3285 8.3285 8.6098 8.6098 8.6193 8.6419 8.8551 8.8551 9.0346 9.1233 10.2883 10.2883 11.3267 11.3267 k = 0.1739 0.1739 0.1739 ( 7415 PWs) bands (ev): -61.0810 -61.0810 -33.9833 -33.9833 -25.3083 -25.3083 -25.3083 -25.3083 -4.9483 -4.9483 -3.9222 -3.9222 -3.8617 -3.8617 -3.8540 -3.8529 1.9001 1.9170 1.9170 1.9657 2.1877 2.1877 3.1407 3.1407 3.4754 3.4754 3.5455 3.5464 3.6401 3.6401 3.6983 3.7032 3.8189 3.8189 3.9906 3.9906 4.0600 4.1070 4.1070 4.1664 4.3899 4.3899 4.4178 4.4232 4.5240 4.5240 4.5491 4.6426 4.6524 4.6524 4.7729 4.7729 5.0541 5.0541 5.1034 5.1597 5.1777 5.1777 5.2223 5.2538 5.2538 5.3958 5.7976 5.7976 5.8433 5.8433 6.5246 6.5246 6.6111 6.6389 8.3385 8.3385 8.6236 8.6236 8.6325 8.6666 8.8891 8.8891 9.0581 9.1562 10.3112 10.3112 11.3466 11.3466 k = 0.1848 0.1848 0.1848 ( 7427 PWs) bands (ev): -61.0810 -61.0810 -33.9833 -33.9833 -25.3084 -25.3084 -25.3083 -25.3083 -4.9208 -4.9208 -3.9334 -3.9334 -3.8738 -3.8738 -3.8654 -3.8643 1.9252 1.9422 1.9422 1.9966 2.2143 2.2143 3.1025 3.1025 3.4734 3.4734 3.5380 3.5485 3.6235 3.6235 3.6783 3.6836 3.8007 3.8007 3.9706 3.9706 4.0589 4.0988 4.0988 4.1643 4.3948 4.3948 4.4209 4.4332 4.5133 4.5133 4.5495 4.6388 4.6495 4.6495 4.7603 4.7603 5.0610 5.0610 5.1144 5.1652 5.1848 5.1848 5.2188 5.2603 5.2603 5.3957 5.7324 5.7324 5.8828 5.8828 6.5101 6.5101 6.5994 6.6271 8.3516 8.3516 8.6373 8.6373 8.6448 8.6912 8.9241 8.9241 9.0816 9.1892 10.3255 10.3255 11.3631 11.3631 k = 0.1957 0.1957 0.1957 ( 7427 PWs) bands (ev): -61.0810 -61.0810 -33.9833 -33.9833 -25.3084 -25.3084 -25.3084 -25.3084 -4.8920 -4.8920 -3.9449 -3.9449 -3.8861 -3.8861 -3.8770 -3.8759 1.9494 1.9661 1.9661 2.0267 2.2391 2.2391 3.0624 3.0624 3.4710 3.4710 3.5251 3.5516 3.6089 3.6089 3.6640 3.6652 3.7817 3.7817 3.9504 3.9504 4.0577 4.0918 4.0918 4.1616 4.3981 4.3981 4.4217 4.4420 4.5042 4.5042 4.5527 4.6359 4.6468 4.6468 4.7492 4.7492 5.0699 5.0699 5.1272 5.1712 5.1911 5.1911 5.2187 5.2675 5.2675 5.3970 5.6682 5.6682 5.9258 5.9258 6.4953 6.4953 6.5874 6.6147 8.3677 8.3677 8.6510 8.6510 8.6559 8.7151 8.9598 8.9598 9.1055 9.2224 10.3326 10.3326 11.3771 11.3771 k = 0.2065 0.2065 0.2065 ( 7415 PWs) bands (ev): -61.0810 -61.0810 -33.9833 -33.9833 -25.3084 -25.3084 -25.3084 -25.3084 -4.8622 -4.8622 -3.9564 -3.9564 -3.8986 -3.8986 -3.8888 -3.8877 1.9723 1.9884 1.9884 2.0555 2.2616 2.2616 3.0207 3.0207 3.4681 3.4681 3.5082 3.5547 3.5967 3.5967 3.6484 3.6554 3.7622 3.7622 3.9307 3.9307 4.0564 4.0857 4.0857 4.1583 4.3997 4.3997 4.4208 4.4496 4.4968 4.4968 4.5579 4.6342 4.6443 4.6443 4.7396 4.7396 5.0805 5.0805 5.1418 5.1784 5.1965 5.1965 5.2212 5.2753 5.2753 5.3995 5.6075 5.6075 5.9705 5.9705 6.4805 6.4805 6.5754 6.6019 8.3865 8.3865 8.6647 8.6647 8.6660 8.7382 8.9962 8.9962 9.1302 9.2560 10.3339 10.3339 11.3892 11.3892 k = 0.2174 0.2174 0.2174 ( 7418 PWs) bands (ev): -61.0810 -61.0810 -33.9833 -33.9833 -25.3084 -25.3084 -25.3084 -25.3084 -4.8315 -4.8315 -3.9681 -3.9681 -3.9111 -3.9111 -3.9007 -3.8995 1.9935 2.0086 2.0086 2.0825 2.2809 2.2809 2.9776 2.9776 3.4647 3.4647 3.4890 3.5576 3.5872 3.5872 3.6339 3.6514 3.7427 3.7427 3.9120 3.9120 4.0548 4.0801 4.0801 4.1543 4.3997 4.3997 4.4190 4.4562 4.4913 4.4913 4.5644 4.6336 4.6421 4.6421 4.7313 4.7313 5.0920 5.0920 5.1580 5.1873 5.2005 5.2005 5.2255 5.2835 5.2835 5.4030 5.5515 5.5515 6.0164 6.0164 6.4660 6.4660 6.5637 6.5891 8.4078 8.4078 8.6749 8.6784 8.6784 8.7600 9.0332 9.0332 9.1560 9.2898 10.3309 10.3309 11.3998 11.3998 k = 0.2283 0.2283 0.2283 ( 7418 PWs) bands (ev): -61.0810 -61.0810 -33.9833 -33.9833 -25.3085 -25.3085 -25.3084 -25.3084 -4.7998 -4.7998 -3.9797 -3.9797 -3.9235 -3.9235 -3.9125 -3.9114 2.0128 2.0263 2.0263 2.1072 2.2963 2.2963 2.9336 2.9336 3.4613 3.4613 3.4693 3.5600 3.5806 3.5806 3.6222 3.6507 3.7239 3.7239 3.8946 3.8946 4.0530 4.0747 4.0747 4.1495 4.3983 4.3983 4.4169 4.4618 4.4875 4.4875 4.5717 4.6342 4.6400 4.6400 4.7241 4.7241 5.1030 5.1030 5.1755 5.1974 5.2035 5.2035 5.2317 5.2923 5.2923 5.4074 5.5017 5.5017 6.0633 6.0633 6.4521 6.4521 6.5526 6.5766 8.4312 8.4312 8.6828 8.6922 8.6922 8.7802 9.0706 9.0706 9.1832 9.3240 10.3250 10.3250 11.4091 11.4091 k = 0.2391 0.2391 0.2391 ( 7427 PWs) bands (ev): -61.0810 -61.0810 -33.9834 -33.9834 -25.3085 -25.3085 -25.3085 -25.3085 -4.7674 -4.7674 -3.9914 -3.9914 -3.9359 -3.9359 -3.9243 -3.9232 2.0297 2.0412 2.0412 2.1292 2.3071 2.3071 2.8889 2.8889 3.4508 3.4584 3.4584 3.5616 3.5766 3.5766 3.6140 3.6522 3.7068 3.7068 3.8787 3.8787 4.0510 4.0694 4.0694 4.1440 4.3960 4.3960 4.4149 4.4669 4.4851 4.4851 4.5793 4.6358 4.6381 4.6381 4.7179 4.7179 5.1108 5.1108 5.1940 5.2060 5.2060 5.2078 5.2404 5.3016 5.3016 5.4127 5.4595 5.4595 6.1110 6.1110 6.4392 6.4392 6.5426 6.5647 8.4564 8.4564 8.6897 8.7062 8.7062 8.7986 9.1083 9.1083 9.2118 9.3583 10.3171 10.3171 11.4172 11.4172 k = 0.2500 0.2500 0.2500 ( 7451 PWs) bands (ev): -61.0810 -61.0810 -33.9834 -33.9834 -25.3086 -25.3086 -25.3085 -25.3085 -4.7344 -4.7344 -4.0029 -4.0029 -3.9481 -3.9481 -3.9361 -3.9349 2.0442 2.0529 2.0529 2.1478 2.3129 2.3129 2.8437 2.8437 3.4346 3.4566 3.4566 3.5619 3.5750 3.5750 3.6097 3.6552 3.6921 3.6921 3.8641 3.8641 4.0486 4.0640 4.0640 4.1378 4.3932 4.3932 4.4135 4.4717 4.4838 4.4838 4.5868 4.6363 4.6363 4.6380 4.7125 4.7125 5.1119 5.1119 5.2101 5.2101 5.2130 5.2167 5.2529 5.3116 5.3116 5.4189 5.4263 5.4263 6.1589 6.1589 6.4281 6.4281 6.5340 6.5541 8.4829 8.4829 8.6957 8.7207 8.7207 8.8152 9.1460 9.1460 9.2419 9.3926 10.3085 10.3085 11.4239 11.4239 k = 0.2609 0.2609 0.2609 ( 7430 PWs) bands (ev): -61.0810 -61.0810 -33.9834 -33.9834 -25.3086 -25.3086 -25.3085 -25.3085 -4.7009 -4.7009 -4.0142 -4.0142 -3.9602 -3.9602 -3.9476 -3.9465 2.0559 2.0615 2.0615 2.1629 2.3131 2.3131 2.7982 2.7982 3.4216 3.4567 3.4567 3.5615 3.5754 3.5754 3.6092 3.6593 3.6808 3.6808 3.8509 3.8509 4.0461 4.0585 4.0585 4.1310 4.3905 4.3905 4.4131 4.4767 4.4834 4.4834 4.5941 4.6346 4.6346 4.6407 4.7080 4.7080 5.1035 5.1035 5.2176 5.2176 5.2235 5.2321 5.2693 5.3223 5.3223 5.4030 5.4030 5.4258 6.2066 6.2066 6.4195 6.4195 6.5275 6.5450 8.5104 8.5104 8.7011 8.7357 8.7357 8.8300 9.1835 9.1835 9.2734 9.4267 10.2998 10.2998 11.4293 11.4293 k = 0.2717 0.2717 0.2717 ( 7418 PWs) bands (ev): -61.0810 -61.0810 -33.9834 -33.9834 -25.3086 -25.3086 -25.3086 -25.3086 -4.6670 -4.6670 -4.0254 -4.0254 -3.9719 -3.9719 -3.9590 -3.9579 2.0649 2.0666 2.0666 2.1742 2.3078 2.3078 2.7524 2.7524 3.4123 3.4588 3.4588 3.5611 3.5775 3.5775 3.6116 3.6641 3.6732 3.6732 3.8389 3.8389 4.0433 4.0528 4.0528 4.1236 4.3880 4.3880 4.4137 4.4821 4.4835 4.4835 4.6010 4.6329 4.6329 4.6438 4.7040 4.7040 5.0859 5.0859 5.2279 5.2279 5.2284 5.2506 5.2887 5.3336 5.3336 5.3891 5.3891 5.4335 6.2530 6.2530 6.4149 6.4149 6.5235 6.5382 8.5381 8.5381 8.7059 8.7516 8.7516 8.8430 9.2206 9.2206 9.3060 9.4603 10.2918 10.2918 11.4330 11.4330 k = 0.2826 0.2826 0.2826 ( 7394 PWs) bands (ev): -61.0809 -61.0809 -33.9833 -33.9833 -25.3086 -25.3086 -25.3085 -25.3085 -4.6329 -4.6329 -4.0363 -4.0363 -3.9834 -3.9834 -3.9702 -3.9691 2.0685 2.0685 2.0711 2.1815 2.2971 2.2971 2.7062 2.7062 3.4070 3.4634 3.4634 3.5616 3.5812 3.5812 3.6161 3.6693 3.6699 3.6699 3.8280 3.8280 4.0402 4.0470 4.0470 4.1158 4.3860 4.3860 4.4155 4.4840 4.4840 4.4880 4.6077 4.6312 4.6312 4.6469 4.7007 4.7007 5.0620 5.0620 5.2323 5.2393 5.2393 5.2679 5.3099 5.3442 5.3442 5.3844 5.3844 5.4418 6.2957 6.2957 6.4167 6.4167 6.5226 6.5340 8.5657 8.5657 8.7104 8.7685 8.7685 8.8543 9.2569 9.2569 9.3393 9.4929 10.2850 10.2850 11.4341 11.4341 k = 0.2935 0.2935 0.2935 ( 7400 PWs) bands (ev): -61.0809 -61.0809 -33.9834 -33.9834 -25.3086 -25.3086 -25.3086 -25.3086 -4.5988 -4.5988 -4.0470 -4.0470 -3.9945 -3.9945 -3.9810 -3.9800 2.0672 2.0672 2.0747 2.1849 2.2815 2.2815 2.6596 2.6596 3.4058 3.4703 3.4703 3.5635 3.5865 3.5865 3.6219 3.6706 3.6706 3.6748 3.8179 3.8179 4.0369 4.0409 4.0409 4.1075 4.3844 4.3844 4.4184 4.4848 4.4848 4.4945 4.6138 4.6294 4.6294 4.6499 4.6976 4.6976 5.0350 5.0350 5.2352 5.2502 5.2502 5.2837 5.3317 5.3516 5.3516 5.3890 5.3890 5.4505 6.3306 6.3306 6.4297 6.4297 6.5254 6.5331 8.5926 8.5926 8.7145 8.7868 8.7868 8.8643 9.2920 9.2920 9.3727 9.5241 10.2798 10.2798 11.4025 11.4302 k = 0.3043 0.3043 0.3043 ( 7391 PWs) bands (ev): -61.0809 -61.0809 -33.9834 -33.9834 -25.3086 -25.3086 -25.3086 -25.3086 -4.5649 -4.5649 -4.0573 -4.0573 -4.0052 -4.0052 -3.9915 -3.9905 2.0629 2.0629 2.0757 2.1845 2.2617 2.2617 2.6125 2.6125 3.4085 3.4794 3.4794 3.5669 3.5930 3.5930 3.6287 3.6755 3.6755 3.6806 3.8089 3.8089 4.0334 4.0346 4.0346 4.0989 4.3833 4.3833 4.4225 4.4859 4.4859 4.5018 4.6195 4.6275 4.6275 4.6529 4.6949 4.6949 5.0071 5.0071 5.2376 5.2597 5.2597 5.2976 5.3534 5.3556 5.3556 5.4012 5.4012 5.4593 6.3541 6.3541 6.4578 6.4578 6.5325 6.5361 8.6184 8.6184 8.7186 8.8065 8.8065 8.8730 9.3255 9.3255 9.4057 9.5535 10.2765 10.2765 11.3550 11.4132 k = 0.3152 0.3152 0.3152 ( 7385 PWs) bands (ev): -61.0809 -61.0809 -33.9834 -33.9834 -25.3086 -25.3086 -25.3086 -25.3086 -4.5312 -4.5312 -4.0673 -4.0673 -4.0155 -4.0155 -4.0017 -4.0007 2.0559 2.0559 2.0744 2.1807 2.2386 2.2386 2.5649 2.5649 3.4149 3.4904 3.4904 3.5718 3.6007 3.6007 3.6363 3.6840 3.6840 3.6864 3.8007 3.8007 4.0282 4.0282 4.0298 4.0901 4.3827 4.3827 4.4279 4.4872 4.4872 4.5098 4.6248 4.6256 4.6256 4.6556 4.6924 4.6924 4.9800 4.9800 5.2395 5.2678 5.2678 5.3095 5.3583 5.3583 5.3742 5.4168 5.4168 5.4674 6.3701 6.3701 6.4972 6.4972 6.5435 6.5443 8.6427 8.6427 8.7228 8.8280 8.8280 8.8807 9.3569 9.3569 9.4377 9.5803 10.2754 10.2754 11.2998 11.3733 k = 0.3261 0.3261 0.3261 ( 7394 PWs) bands (ev): -61.0809 -61.0809 -33.9834 -33.9834 -25.3087 -25.3087 -25.3087 -25.3087 -4.4980 -4.4980 -4.0769 -4.0769 -4.0253 -4.0253 -4.0114 -4.0105 2.0467 2.0467 2.0712 2.1739 2.2131 2.2131 2.5170 2.5170 3.4245 3.5029 3.5029 3.5779 3.6091 3.6091 3.6444 3.6922 3.6959 3.6959 3.7935 3.7935 4.0217 4.0217 4.0261 4.0813 4.3824 4.3824 4.4345 4.4886 4.4886 4.5185 4.6236 4.6236 4.6297 4.6580 4.6900 4.6900 4.9546 4.9546 5.2411 5.2746 5.2746 5.3195 5.3608 5.3608 5.3933 5.4329 5.4329 5.4744 6.3851 6.3851 6.5420 6.5420 6.5557 6.5612 8.6652 8.6652 8.7271 8.8510 8.8510 8.8877 9.3856 9.3856 9.4677 9.6040 10.2764 10.2764 11.2377 11.3178 k = 0.3370 0.3370 0.3370 ( 7400 PWs) bands (ev): -61.0809 -61.0809 -33.9834 -33.9834 -25.3087 -25.3087 -25.3087 -25.3087 -4.4655 -4.4655 -4.0860 -4.0860 -4.0345 -4.0345 -4.0208 -4.0199 2.0354 2.0354 2.0662 2.1644 2.1862 2.1862 2.4689 2.4689 3.4370 3.5167 3.5167 3.5850 3.6180 3.6180 3.6530 3.6979 3.7102 3.7102 3.7875 3.7875 4.0152 4.0152 4.0223 4.0724 4.3825 4.3825 4.4421 4.4902 4.4902 4.5278 4.6215 4.6215 4.6344 4.6601 4.6877 4.6877 4.9315 4.9315 5.2424 5.2803 5.2803 5.3278 5.3634 5.3634 5.4102 5.4479 5.4479 5.4796 6.4024 6.4024 6.5731 6.5834 6.5887 6.5887 8.6861 8.6861 8.7318 8.8754 8.8754 8.8940 9.4111 9.4111 9.4950 9.6237 10.2799 10.2799 11.1699 11.2537 k = 0.3478 0.3478 0.3478 ( 7391 PWs) bands (ev): -61.0809 -61.0809 -33.9834 -33.9834 -25.3087 -25.3087 -25.3087 -25.3087 -4.4339 -4.4339 -4.0947 -4.0947 -4.0432 -4.0432 -4.0296 -4.0287 2.0227 2.0227 2.0600 2.1529 2.1586 2.1586 2.4210 2.4210 3.4516 3.5312 3.5312 3.5928 3.6273 3.6273 3.6618 3.7034 3.7257 3.7257 3.7835 3.7835 4.0087 4.0087 4.0185 4.0636 4.3828 4.3828 4.4509 4.4918 4.4918 4.5376 4.6194 4.6194 4.6387 4.6620 4.6854 4.6854 4.9111 4.9111 5.2437 5.2851 5.2851 5.3347 5.3660 5.3660 5.4244 5.4608 5.4608 5.4827 6.4235 6.4235 6.5958 6.6108 6.6358 6.6358 8.7054 8.7054 8.7371 8.9001 8.9009 8.9009 9.4326 9.4326 9.5184 9.6387 10.2858 10.2858 11.0981 11.1843 k = 0.3587 0.3587 0.3587 ( 7397 PWs) bands (ev): -61.0809 -61.0809 -33.9834 -33.9834 -25.3088 -25.3088 -25.3087 -25.3087 -4.4034 -4.4034 -4.1030 -4.1030 -4.0513 -4.0513 -4.0379 -4.0371 2.0087 2.0087 2.0527 2.1312 2.1312 2.1399 2.3735 2.3735 3.4679 3.5461 3.5461 3.6011 3.6367 3.6367 3.6707 3.7085 3.7397 3.7397 3.7834 3.7834 4.0024 4.0024 4.0148 4.0550 4.3832 4.3832 4.4606 4.4935 4.4935 4.5477 4.6173 4.6173 4.6427 4.6635 4.6831 4.6831 4.8934 4.8934 5.2449 5.2893 5.2893 5.3403 5.3686 5.3686 5.4357 5.4710 5.4710 5.4831 6.4487 6.4487 6.6237 6.6433 6.6826 6.6826 8.7236 8.7236 8.7432 8.9061 8.9270 8.9270 9.4494 9.4494 9.5368 9.6480 10.2941 10.2941 11.0245 11.1120 k = 0.3696 0.3696 0.3696 ( 7406 PWs) bands (ev): -61.0809 -61.0809 -33.9834 -33.9834 -25.3088 -25.3088 -25.3088 -25.3088 -4.3742 -4.3742 -4.1107 -4.1107 -4.0587 -4.0587 -4.0458 -4.0450 1.9939 1.9939 2.0448 2.1047 2.1047 2.1258 2.3271 2.3271 3.4854 3.5610 3.5610 3.6096 3.6462 3.6462 3.6795 3.7133 3.7475 3.7475 3.7909 3.7909 3.9963 3.9963 4.0112 4.0467 4.3836 4.3836 4.4712 4.4952 4.4952 4.5581 4.6152 4.6152 4.6465 4.6647 4.6809 4.6809 4.8785 4.8785 5.2463 5.2930 5.2930 5.3450 5.3711 5.3711 5.4440 5.4781 5.4781 5.4809 6.4781 6.4781 6.6567 6.6802 6.7286 6.7286 8.7409 8.7409 8.7501 8.9122 8.9533 8.9533 9.4606 9.4606 9.5489 9.6507 10.3051 10.3051 10.9516 11.0392 k = 0.3804 0.3804 0.3804 ( 7406 PWs) bands (ev): -61.0809 -61.0809 -33.9834 -33.9834 -25.3088 -25.3088 -25.3088 -25.3088 -4.3464 -4.3464 -4.1180 -4.1180 -4.0654 -4.0654 -4.0530 -4.0523 1.9785 1.9785 2.0366 2.0795 2.0795 2.1111 2.2820 2.2820 3.5037 3.5755 3.5755 3.6181 3.6558 3.6558 3.6880 3.7177 3.7488 3.7488 3.8057 3.8057 3.9906 3.9906 4.0077 4.0387 4.3839 4.3839 4.4826 4.4968 4.4968 4.5685 4.6133 4.6133 4.6499 4.6656 4.6787 4.6787 4.8663 4.8663 5.2479 5.2963 5.2963 5.3490 5.3735 5.3735 5.4494 5.4761 5.4823 5.4823 6.5109 6.5109 6.6940 6.7210 6.7733 6.7733 8.7577 8.7577 8.7583 8.9188 8.9792 8.9792 9.4655 9.4655 9.5534 9.6460 10.3186 10.3186 10.8821 10.9681 k = 0.3913 0.3913 0.3913 ( 7394 PWs) bands (ev): -61.0809 -61.0809 -33.9834 -33.9834 -25.3088 -25.3088 -25.3088 -25.3088 -4.3204 -4.3204 -4.1247 -4.1247 -4.0715 -4.0715 -4.0597 -4.0591 1.9630 1.9630 2.0283 2.0561 2.0561 2.0962 2.2387 2.2387 3.5224 3.5894 3.5894 3.6265 3.6653 3.6653 3.6959 3.7215 3.7470 3.7470 3.8236 3.8236 3.9855 3.9855 4.0044 4.0311 4.3841 4.3841 4.4946 4.4982 4.4982 4.5786 4.6116 4.6116 4.6532 4.6662 4.6767 4.6767 4.8567 4.8567 5.2499 5.2995 5.2995 5.3525 5.3759 5.3759 5.4521 5.4689 5.4835 5.4835 6.5464 6.5464 6.7350 6.7646 6.8165 6.8165 8.7678 8.7746 8.7746 8.9260 9.0042 9.0042 9.4634 9.4634 9.5491 9.6332 10.3350 10.3350 10.8185 10.9009 k = 0.4022 0.4022 0.4022 ( 7400 PWs) bands (ev): -61.0809 -61.0809 -33.9834 -33.9834 -25.3088 -25.3088 -25.3088 -25.3088 -4.2964 -4.2964 -4.1309 -4.1309 -4.0768 -4.0768 -4.0659 -4.0653 1.9477 1.9477 2.0204 2.0348 2.0348 2.0814 2.1977 2.1977 3.5409 3.6025 3.6025 3.6345 3.6746 3.6746 3.7031 3.7247 3.7443 3.7443 3.8417 3.8417 3.9811 3.9811 4.0013 4.0240 4.3841 4.3841 4.4995 4.4995 4.5070 4.5883 4.6101 4.6101 4.6562 4.6665 4.6748 4.6748 4.8492 4.8492 5.2525 5.3025 5.3025 5.3554 5.3783 5.3783 5.4523 5.4597 5.4823 5.4823 6.5835 6.5835 6.7786 6.8100 6.8578 6.8578 8.7792 8.7917 8.7917 8.9341 9.0279 9.0279 9.4539 9.4539 9.5351 9.6122 10.3542 10.3542 10.7629 10.8396 k = 0.4130 0.4130 0.4130 ( 7418 PWs) bands (ev): -61.0810 -61.0810 -33.9834 -33.9834 -25.3089 -25.3089 -25.3089 -25.3089 -4.2744 -4.2744 -4.1366 -4.1366 -4.0812 -4.0812 -4.0714 -4.0709 1.9329 1.9329 2.0129 2.0160 2.0160 2.0671 2.1594 2.1594 3.5591 3.6144 3.6144 3.6421 3.6836 3.6836 3.7094 3.7273 3.7415 3.7415 3.8586 3.8586 3.9778 3.9778 3.9986 4.0175 4.3839 4.3839 4.5005 4.5005 4.5198 4.5972 4.6088 4.6088 4.6588 4.6666 4.6731 4.6731 4.8435 4.8435 5.2558 5.3053 5.3053 5.3580 5.3807 5.3807 5.4488 5.4504 5.4788 5.4788 6.6210 6.6210 6.8238 6.8560 6.8970 6.8970 8.7925 8.8097 8.8097 8.9434 9.0496 9.0496 9.4371 9.4371 9.5113 9.5831 10.3766 10.3766 10.7169 10.7853 k = 0.4239 0.4239 0.4239 ( 7427 PWs) bands (ev): -61.0810 -61.0810 -33.9835 -33.9835 -25.3089 -25.3089 -25.3089 -25.3089 -4.2548 -4.2548 -4.1418 -4.1418 -4.0849 -4.0849 -4.0763 -4.0758 1.9189 1.9189 1.9997 1.9997 2.0062 2.0535 2.1242 2.1242 3.5767 3.6252 3.6252 3.6492 3.6921 3.6921 3.7146 3.7292 3.7388 3.7388 3.8731 3.8731 3.9760 3.9760 3.9961 4.0116 4.3834 4.3834 4.5012 4.5012 4.5326 4.6051 4.6080 4.6080 4.6612 4.6664 4.6717 4.6717 4.8394 4.8394 5.2599 5.3081 5.3081 5.3602 5.3833 5.3833 5.4370 5.4469 5.4736 5.4736 6.6576 6.6576 6.8692 6.9010 6.9337 6.9337 8.8083 8.8288 8.8288 8.9540 9.0687 9.0687 9.4136 9.4136 9.4784 9.5467 10.4021 10.4021 10.6810 10.7391 k = 0.4348 0.4348 0.4348 ( 7421 PWs) bands (ev): -61.0810 -61.0810 -33.9835 -33.9835 -25.3089 -25.3089 -25.3089 -25.3089 -4.2375 -4.2375 -4.1464 -4.1464 -4.0878 -4.0878 -4.0805 -4.0801 1.9062 1.9062 1.9859 1.9859 2.0004 2.0409 2.0924 2.0924 3.5933 3.6348 3.6348 3.6555 3.7000 3.7000 3.7187 3.7305 3.7364 3.7364 3.8848 3.8848 3.9759 3.9759 3.9940 4.0065 4.3829 4.3829 4.5018 4.5018 4.5454 4.6075 4.6075 4.6117 4.6633 4.6662 4.6706 4.6706 4.8366 4.8366 5.2651 5.3107 5.3107 5.3616 5.3861 5.3861 5.4249 5.4422 5.4672 5.4672 6.6921 6.6921 6.9135 6.9438 6.9675 6.9675 8.8268 8.8494 8.8494 8.9660 9.0842 9.0842 9.3849 9.3849 9.4380 9.5046 10.4311 10.4311 10.6551 10.7011 k = 0.4457 0.4457 0.4457 ( 7427 PWs) bands (ev): -61.0810 -61.0810 -33.9835 -33.9835 -25.3089 -25.3089 -25.3089 -25.3089 -4.2229 -4.2229 -4.1506 -4.1506 -4.0898 -4.0898 -4.0842 -4.0838 1.8950 1.8950 1.9747 1.9747 1.9958 2.0294 2.0643 2.0643 3.6089 3.6430 3.6430 3.6609 3.7070 3.7070 3.7217 3.7311 3.7342 3.7342 3.8933 3.8933 3.9775 3.9775 3.9923 4.0020 4.3822 4.3822 4.5021 4.5021 4.5578 4.6073 4.6073 4.6164 4.6650 4.6660 4.6697 4.6697 4.8348 4.8348 5.2713 5.3131 5.3131 5.3618 5.3892 5.3892 5.4136 5.4366 5.4598 5.4598 6.7234 6.7234 6.9552 6.9829 6.9978 6.9978 8.8484 8.8719 8.8719 8.9792 9.0951 9.0951 9.3535 9.3535 9.3929 9.4585 10.4634 10.4634 10.6382 10.6710 k = 0.4565 0.4565 0.4565 ( 7445 PWs) bands (ev): -61.0810 -61.0810 -33.9835 -33.9835 -25.3090 -25.3090 -25.3090 -25.3090 -4.2108 -4.2108 -4.1542 -4.1542 -4.0912 -4.0912 -4.0871 -4.0869 1.8856 1.8856 1.9662 1.9662 1.9924 2.0192 2.0403 2.0403 3.6232 3.6499 3.6499 3.6650 3.7129 3.7129 3.7237 3.7312 3.7324 3.7324 3.8988 3.8988 3.9804 3.9804 3.9909 3.9982 4.3814 4.3814 4.5023 4.5023 4.5697 4.6072 4.6072 4.6191 4.6660 4.6664 4.6690 4.6690 4.8336 4.8336 5.2787 5.3153 5.3153 5.3593 5.3928 5.3928 5.4050 5.4305 5.4520 5.4520 6.7503 6.7503 6.9927 7.0166 7.0240 7.0240 8.8732 8.8963 8.8963 8.9928 9.0996 9.0996 9.3225 9.3225 9.3466 9.4109 10.4988 10.4988 10.6289 10.6483 k = 0.4674 0.4674 0.4674 ( 7448 PWs) bands (ev): -61.0810 -61.0810 -33.9835 -33.9835 -25.3090 -25.3090 -25.3090 -25.3090 -4.2012 -4.2012 -4.1574 -4.1574 -4.0919 -4.0919 -4.0894 -4.0892 1.8782 1.8782 1.9601 1.9601 1.9903 2.0104 2.0207 2.0207 3.6358 3.6552 3.6552 3.6676 3.7178 3.7178 3.7250 3.7307 3.7309 3.7309 3.9020 3.9020 3.9839 3.9839 3.9900 3.9951 4.3808 4.3808 4.5024 4.5024 4.5808 4.6073 4.6073 4.6195 4.6664 4.6675 4.6686 4.6686 4.8329 4.8329 5.2874 5.3171 5.3171 5.3529 5.3968 5.3968 5.4005 5.4242 5.4442 5.4442 6.7721 6.7721 7.0246 7.0437 7.0454 7.0454 8.9011 8.9226 8.9226 9.0046 9.0959 9.0959 9.2958 9.2958 9.3039 9.3643 10.5366 10.5366 10.6257 10.6323 k = 0.4783 0.4783 0.4783 ( 7442 PWs) bands (ev): -61.0810 -61.0810 -33.9835 -33.9835 -25.3090 -25.3090 -25.3090 -25.3090 -4.1942 -4.1942 -4.1600 -4.1600 -4.0922 -4.0922 -4.0911 -4.0909 1.8728 1.8728 1.9563 1.9563 1.9898 2.0032 2.0059 2.0059 3.6467 3.6591 3.6591 3.6682 3.7216 3.7216 3.7259 3.7296 3.7296 3.7298 3.9036 3.9036 3.9871 3.9871 3.9895 3.9928 4.3802 4.3802 4.5025 4.5025 4.5910 4.6074 4.6074 4.6176 4.6670 4.6681 4.6683 4.6683 4.8326 4.8326 5.2972 5.3184 5.3184 5.3431 5.4003 5.4011 5.4011 5.4180 5.4369 5.4369 6.7880 6.7880 7.0496 7.0614 7.0614 7.0629 8.9311 8.9500 8.9500 9.0107 9.0835 9.0835 9.2715 9.2765 9.2765 9.3214 10.5741 10.5741 10.6235 10.6235 k = 0.4891 0.4891 0.4891 ( 7400 PWs) bands (ev): -61.0809 -61.0809 -33.9834 -33.9834 -25.3089 -25.3089 -25.3089 -25.3089 -4.1898 -4.1898 -4.1618 -4.1618 -4.0923 -4.0923 -4.0921 -4.0920 1.8696 1.8696 1.9545 1.9545 1.9908 1.9966 1.9966 1.9974 3.6557 3.6616 3.6616 3.6665 3.7243 3.7243 3.7268 3.7285 3.7285 3.7288 3.9044 3.9044 3.9893 3.9893 3.9896 3.9912 4.3800 4.3800 4.5026 4.5026 4.6001 4.6077 4.6077 4.6136 4.6678 4.6683 4.6683 4.6684 4.8325 4.8325 5.3080 5.3193 5.3193 5.3316 5.4028 5.4051 5.4051 5.4122 5.4310 5.4310 6.7978 6.7978 7.0666 7.0713 7.0713 7.0734 8.9615 8.9754 8.9754 9.0060 9.0657 9.0657 9.2565 9.2657 9.2657 9.2859 10.5988 10.5988 10.6293 10.6293 k = 0.5000 0.5000 0.5000 ( 7400 PWs) bands (ev): -61.0809 -61.0809 -33.9834 -33.9834 -25.3089 -25.3089 -25.3089 -25.3089 -4.1883 -4.1883 -4.1625 -4.1625 -4.0924 -4.0924 -4.0924 -4.0924 1.8685 1.8685 1.9540 1.9540 1.9933 1.9933 1.9933 1.9933 3.6623 3.6623 3.6623 3.6623 3.7256 3.7256 3.7277 3.7277 3.7277 3.7277 3.9046 3.9046 3.9901 3.9901 3.9901 3.9901 4.3799 4.3799 4.5026 4.5026 4.6077 4.6077 4.6077 4.6077 4.6682 4.6682 4.6682 4.6682 4.8325 4.8325 5.3196 5.3196 5.3196 5.3196 5.4070 5.4070 5.4070 5.4070 5.4285 5.4285 6.8010 6.8010 7.0746 7.0746 7.0746 7.0746 8.9883 8.9883 8.9883 8.9883 9.0551 9.0551 9.2624 9.2624 9.2624 9.2624 10.6024 10.6024 10.6418 10.6418 k = 0.5000 0.5000 0.5000 ( 7400 PWs) bands (ev): -61.0809 -61.0809 -33.9834 -33.9834 -25.3089 -25.3089 -25.3089 -25.3089 -4.1883 -4.1883 -4.1625 -4.1625 -4.0924 -4.0924 -4.0924 -4.0924 1.8685 1.8685 1.9540 1.9540 1.9933 1.9933 1.9933 1.9933 3.6623 3.6623 3.6623 3.6623 3.7256 3.7256 3.7277 3.7277 3.7277 3.7277 3.9046 3.9046 3.9901 3.9901 3.9901 3.9901 4.3799 4.3799 4.5026 4.5026 4.6077 4.6077 4.6077 4.6077 4.6682 4.6682 4.6682 4.6682 4.8325 4.8325 5.3196 5.3196 5.3196 5.3196 5.4070 5.4070 5.4070 5.4070 5.4285 5.4285 6.8010 6.8010 7.0746 7.0746 7.0746 7.0746 8.9883 8.9883 8.9883 8.9883 9.0551 9.0551 9.2624 9.2624 9.2624 9.2624 10.6024 10.6024 10.6418 10.6418 k = 0.4868 0.5000 0.4868 ( 7400 PWs) bands (ev): -61.0809 -61.0809 -33.9834 -33.9834 -25.3089 -25.3089 -25.3089 -25.3089 -4.1898 -4.1897 -4.1619 -4.1617 -4.0924 -4.0923 -4.0920 -4.0920 1.8695 1.8696 1.9544 1.9546 1.9910 1.9956 1.9969 1.9977 3.6560 3.6602 3.6629 3.6663 3.7240 3.7247 3.7269 3.7278 3.7288 3.7291 3.9044 3.9044 3.9892 3.9896 3.9896 3.9911 4.3800 4.3800 4.5026 4.5026 4.6005 4.6059 4.6093 4.6134 4.6678 4.6682 4.6683 4.6685 4.8325 4.8325 5.3085 5.3164 5.3224 5.3311 5.4028 5.4041 5.4066 5.4118 5.4309 5.4310 6.7978 6.7979 7.0668 7.0705 7.0719 7.0737 8.9607 8.9721 8.9807 9.0057 9.0655 9.0656 9.2561 9.2627 9.2694 9.2850 10.5976 10.6007 10.6281 10.6297 k = 0.4737 0.5000 0.4737 ( 7422 PWs) bands (ev): -61.0810 -61.0810 -33.9835 -33.9835 -25.3090 -25.3090 -25.3089 -25.3089 -4.1943 -4.1936 -4.1608 -4.1595 -4.0929 -4.0919 -4.0910 -4.0908 1.8725 1.8730 1.9555 1.9570 1.9905 2.0029 2.0040 2.0068 3.6475 3.6565 3.6618 3.6679 3.7200 3.7234 3.7257 3.7278 3.7298 3.7315 3.9036 3.9038 3.9868 3.9878 3.9895 3.9925 4.3803 4.3803 4.5025 4.5025 4.5919 4.6039 4.6106 4.6175 4.6671 4.6680 4.6682 4.6687 4.8326 4.8326 5.2978 5.3127 5.3244 5.3424 5.3986 5.4004 5.4048 5.4169 5.4365 5.4370 6.7882 6.7884 7.0500 7.0603 7.0607 7.0658 8.9251 8.9476 8.9576 9.0139 9.0821 9.0859 9.2644 9.2769 9.2804 9.3200 10.5704 10.5856 10.6143 10.6246 k = 0.4605 0.5000 0.4605 ( 7462 PWs) bands (ev): -61.0810 -61.0810 -33.9835 -33.9835 -25.3090 -25.3090 -25.3090 -25.3090 -4.2013 -4.1996 -4.1598 -4.1560 -4.0939 -4.0909 -4.0894 -4.0887 1.8772 1.8787 1.9578 1.9619 1.9916 2.0106 2.0179 2.0208 3.6371 3.6515 3.6591 3.6672 3.7143 3.7221 3.7232 3.7284 3.7305 3.7344 3.9018 3.9025 3.9833 3.9851 3.9898 3.9945 4.3807 4.3808 4.5023 4.5024 4.5821 4.6018 4.6113 4.6201 4.6662 4.6673 4.6682 4.6690 4.8327 4.8329 5.2876 5.3088 5.3254 5.3528 5.3933 5.3995 5.4034 5.4222 5.4430 5.4447 6.7722 6.7728 7.0249 7.0408 7.0445 7.0524 8.8877 8.9211 8.9305 9.0127 9.0939 9.1093 9.2803 9.2928 9.3089 9.3632 10.5343 10.5534 10.6153 10.6260 k = 0.4474 0.5000 0.4474 ( 7440 PWs) bands (ev): -61.0810 -61.0810 -33.9835 -33.9835 -25.3090 -25.3090 -25.3089 -25.3089 -4.2104 -4.2074 -4.1593 -4.1515 -4.0958 -4.0889 -4.0872 -4.0856 1.8837 1.8868 1.9619 1.9695 1.9946 2.0203 2.0363 2.0390 3.6250 3.6453 3.6549 3.6646 3.7072 3.7187 3.7212 3.7297 3.7308 3.7379 3.8985 3.9002 3.9791 3.9820 3.9907 3.9972 4.3814 4.3815 4.5022 4.5025 4.5716 4.5998 4.6111 4.6217 4.6657 4.6664 4.6684 4.6695 4.8332 4.8336 5.2782 5.3046 5.3254 5.3601 5.3892 5.4021 5.4032 5.4276 5.4496 5.4530 6.7501 6.7516 6.9927 7.0130 7.0237 7.0340 8.8518 8.8937 8.9032 9.0035 9.1013 9.1343 9.3023 9.3045 9.3516 9.4108 10.5007 10.5215 10.6215 10.6272 k = 0.4342 0.5000 0.4342 ( 7436 PWs) bands (ev): -61.0810 -61.0810 -33.9835 -33.9835 -25.3090 -25.3090 -25.3089 -25.3089 -4.2212 -4.2172 -4.1597 -4.1463 -4.0985 -4.0858 -4.0841 -4.0813 1.8918 1.8971 1.9680 1.9797 1.9994 2.0321 2.0586 2.0611 3.6114 3.6380 3.6494 3.6603 3.6986 3.7131 3.7197 3.7304 3.7313 3.7417 3.8931 3.8960 3.9750 3.9792 3.9922 4.0005 4.3821 4.3824 4.5019 4.5024 4.5603 4.5977 4.6095 4.6230 4.6652 4.6654 4.6685 4.6702 4.8339 4.8347 5.2694 5.3001 5.3244 5.3618 5.3879 5.4040 5.4089 5.4333 5.4556 5.4615 6.7225 6.7250 6.9547 6.9786 6.9986 7.0112 8.8186 8.8661 8.8773 8.9889 9.1050 9.1600 9.3138 9.3287 9.3975 9.4598 10.4725 10.4940 10.6308 10.6319 k = 0.4211 0.5000 0.4211 ( 7432 PWs) bands (ev): -61.0810 -61.0810 -33.9835 -33.9835 -25.3090 -25.3090 -25.3089 -25.3089 -4.2337 -4.2287 -4.1611 -4.1404 -4.1020 -4.0817 -4.0800 -4.0760 1.9014 1.9092 1.9765 1.9920 2.0062 2.0464 2.0844 2.0868 3.5963 3.6295 3.6427 3.6548 3.6890 3.7061 3.7175 3.7293 3.7333 3.7457 3.8849 3.8890 3.9717 3.9773 3.9942 4.0044 4.3827 4.3833 4.5015 4.5022 4.5487 4.5957 4.6061 4.6244 4.6642 4.6650 4.6685 4.6709 4.8349 4.8365 5.2614 5.2954 5.3226 5.3582 5.3889 5.4056 5.4195 5.4397 5.4604 5.4697 6.6900 6.6938 6.9123 6.9388 6.9697 6.9847 8.7884 8.8389 8.8535 8.9712 9.1046 9.1853 9.3194 9.3572 9.4420 9.5076 10.4510 10.4728 10.6409 10.6434 k = 0.4079 0.5000 0.4079 ( 7424 PWs) bands (ev): -61.0810 -61.0810 -33.9835 -33.9835 -25.3089 -25.3089 -25.3089 -25.3089 -4.2476 -4.2420 -4.1636 -4.1343 -4.1061 -4.0767 -4.0745 -4.0697 1.9127 1.9225 1.9875 2.0062 2.0152 2.0633 2.1131 2.1157 3.5799 3.6201 3.6350 3.6481 3.6784 3.6978 3.7146 3.7274 3.7355 3.7499 3.8736 3.8788 3.9699 3.9768 3.9968 4.0090 4.3832 4.3840 4.5008 4.5016 4.5372 4.5939 4.6013 4.6262 4.6631 4.6649 4.6684 4.6718 4.8366 4.8390 5.2540 5.2905 5.3202 5.3518 5.3907 5.4071 5.4319 5.4470 5.4637 5.4776 6.6536 6.6588 6.8671 6.8951 6.9377 6.9548 8.7612 8.8124 8.8321 8.9522 9.0995 9.2087 9.3203 9.3856 9.4818 9.5520 10.4369 10.4591 10.6551 10.6597 k = 0.3947 0.5000 0.3947 ( 7428 PWs) bands (ev): -61.0810 -61.0810 -33.9835 -33.9835 -25.3089 -25.3089 -25.3089 -25.3089 -4.2629 -4.2567 -4.1674 -4.1292 -4.1094 -4.0708 -4.0676 -4.0623 1.9253 1.9362 2.0011 2.0219 2.0270 2.0829 2.1444 2.1476 3.5621 3.6096 3.6265 3.6404 3.6673 3.6886 3.7107 3.7248 3.7379 3.7544 3.8593 3.8651 3.9699 3.9779 4.0001 4.0142 4.3835 4.3844 4.4999 4.5001 4.5266 4.5921 4.5956 4.6281 4.6621 4.6647 4.6682 4.6728 4.8388 4.8426 5.2473 5.2854 5.3176 5.3441 5.3925 5.4080 5.4441 5.4553 5.4654 5.4855 6.6146 6.6211 6.8204 6.8487 6.9029 6.9218 8.7370 8.7870 8.8130 8.9328 9.0889 9.2284 9.3160 9.4119 9.5147 9.5915 10.4306 10.4535 10.6752 10.6804 k = 0.3816 0.5000 0.3816 ( 7426 PWs) bands (ev): -61.0810 -61.0810 -33.9835 -33.9835 -25.3089 -25.3089 -25.3088 -25.3088 -4.2793 -4.2729 -4.1724 -4.1289 -4.1081 -4.0639 -4.0596 -4.0540 1.9391 1.9497 2.0172 2.0388 2.0419 2.1053 2.1778 2.1821 3.5432 3.5981 3.6173 3.6318 3.6559 3.6784 3.7058 3.7214 3.7406 3.7591 3.8426 3.8482 3.9716 3.9804 4.0041 4.0200 4.3833 4.3844 4.4965 4.4986 4.5184 4.5894 4.5905 4.6303 4.6613 4.6643 4.6681 4.6739 4.8419 4.8474 5.2410 5.2802 5.3147 5.3356 5.3939 5.4076 5.4539 5.4606 5.4692 5.4946 6.5741 6.5816 6.7734 6.8008 6.8657 6.8862 8.7157 8.7630 8.7961 8.9137 9.0728 9.2420 9.3070 9.4343 9.5396 9.6249 10.4323 10.4566 10.7020 10.7061 k = 0.3684 0.5000 0.3684 ( 7418 PWs) bands (ev): -61.0810 -61.0810 -33.9834 -33.9834 -25.3089 -25.3089 -25.3088 -25.3088 -4.2968 -4.2903 -4.1787 -4.1344 -4.1012 -4.0559 -4.0504 -4.0447 1.9540 1.9624 2.0351 2.0568 2.0608 2.1304 2.2127 2.2186 3.5231 3.5857 3.6072 3.6223 3.6447 3.6674 3.6997 3.7173 3.7434 3.7641 3.8243 3.8287 3.9747 3.9842 4.0088 4.0263 4.3825 4.3836 4.4897 4.4969 4.5139 4.5834 4.5890 4.6326 4.6609 4.6638 4.6681 4.6753 4.8461 4.8536 5.2351 5.2750 5.3116 5.3266 5.3945 5.4057 5.4575 5.4591 5.4802 5.5064 6.5335 6.5416 6.7271 6.7525 6.8262 6.8480 8.6969 8.7405 8.7812 8.8955 9.0511 9.2458 9.2956 9.4511 9.5561 9.6516 10.4417 10.4684 10.7360 10.7376 k = 0.3553 0.5000 0.3553 ( 7422 PWs) bands (ev): -61.0810 -61.0810 -33.9834 -33.9834 -25.3089 -25.3089 -25.3088 -25.3088 -4.3151 -4.3087 -4.1860 -4.1425 -4.0918 -4.0469 -4.0403 -4.0345 1.9696 1.9741 2.0542 2.0759 2.0839 2.1580 2.2489 2.2566 3.5019 3.5724 3.5961 3.6122 3.6337 3.6558 3.6920 3.7123 3.7463 3.7691 3.8056 3.8074 3.9790 3.9891 4.0142 4.0331 4.3810 4.3820 4.4810 4.4947 4.5120 4.5780 4.5876 4.6350 4.6607 4.6628 4.6682 4.6770 4.8513 4.8614 5.2294 5.2699 5.3082 5.3172 5.3940 5.4020 5.4504 5.4594 5.4935 5.5208 6.4939 6.5018 6.6823 6.7045 6.7849 6.8075 8.6807 8.7197 8.7680 8.8785 9.0245 9.2351 9.2858 9.4611 9.5646 9.6713 10.4587 10.4884 10.7753 10.7773 k = 0.3421 0.5000 0.3421 ( 7434 PWs) bands (ev): -61.0810 -61.0810 -33.9834 -33.9834 -25.3089 -25.3089 -25.3088 -25.3088 -4.3342 -4.3280 -4.1944 -4.1521 -4.0811 -4.0370 -4.0292 -4.0236 1.9849 1.9857 2.0742 2.0962 2.1109 2.1878 2.2857 2.2956 3.4797 3.5583 3.5838 3.6017 3.6232 3.6435 3.6823 3.7060 3.7489 3.7743 3.7854 3.7883 3.9843 3.9949 4.0201 4.0402 4.3787 4.3792 4.4721 4.4921 4.5113 4.5736 4.5864 4.6373 4.6609 4.6617 4.6686 4.6790 4.8579 4.8709 5.2236 5.2650 5.3042 5.3075 5.3921 5.3963 5.4402 5.4558 5.5082 5.5370 6.4563 6.4631 6.6396 6.6574 6.7422 6.7651 8.6668 8.7008 8.7562 8.8627 8.9936 9.2107 9.2772 9.4635 9.5661 9.6842 10.4826 10.5162 10.8193 10.8257 k = 0.3289 0.5000 0.3289 ( 7434 PWs) bands (ev): -61.0810 -61.0810 -33.9834 -33.9834 -25.3089 -25.3089 -25.3087 -25.3087 -4.3539 -4.3479 -4.2036 -4.1627 -4.0695 -4.0263 -4.0173 -4.0119 1.9949 2.0019 2.0954 2.1176 2.1410 2.2195 2.3226 2.3349 3.4567 3.5435 3.5701 3.5912 3.6133 3.6300 3.6701 3.6974 3.7504 3.7642 3.7752 3.7800 3.9907 4.0015 4.0267 4.0479 4.3753 4.3755 4.4640 4.4890 4.5111 4.5706 4.5852 4.6396 4.6604 4.6612 4.6691 4.6817 4.8659 4.8823 5.2177 5.2604 5.2974 5.2995 5.3884 5.3885 5.4273 5.4491 5.5238 5.5541 6.4213 6.4259 6.5994 6.6114 6.6986 6.7215 8.6550 8.6839 8.7452 8.8482 8.9598 9.1773 9.2654 9.4578 9.5618 9.6907 10.5127 10.5506 10.8697 10.8806 k = 0.3158 0.5000 0.3158 ( 7426 PWs) bands (ev): -61.0810 -61.0810 -33.9834 -33.9834 -25.3089 -25.3089 -25.3087 -25.3087 -4.3740 -4.3684 -4.2135 -4.1740 -4.0572 -4.0149 -4.0047 -3.9995 2.0043 2.0179 2.1177 2.1403 2.1733 2.2526 2.3591 2.3740 3.4330 3.5280 3.5547 3.5807 3.6038 3.6140 3.6561 3.6851 3.7468 3.7491 3.7692 3.7855 3.9980 4.0090 4.0337 4.0558 4.3701 4.3713 4.4571 4.4856 4.5111 4.5691 4.5841 4.6417 4.6588 4.6618 4.6701 4.6851 4.8755 4.8957 5.2114 5.2558 5.2872 5.2931 5.3778 5.3829 5.4127 5.4408 5.5402 5.5716 6.3894 6.3902 6.5618 6.5664 6.6551 6.6775 8.6454 8.6691 8.7338 8.8350 8.9250 9.1380 9.2488 9.4443 9.5528 9.6914 10.5482 10.5907 10.9258 10.9410 k = 0.3026 0.5000 0.3026 ( 7418 PWs) bands (ev): -61.0810 -61.0810 -33.9834 -33.9834 -25.3089 -25.3089 -25.3086 -25.3086 -4.3945 -4.3893 -4.2241 -4.1860 -4.0442 -4.0029 -3.9915 -3.9866 2.0128 2.0334 2.1412 2.1642 2.2071 2.2868 2.3947 2.4123 3.4090 3.5118 3.5379 3.5703 3.5939 3.5945 3.6423 3.6684 3.7348 3.7463 3.7699 3.7913 4.0063 4.0172 4.0413 4.0642 4.3639 4.3662 4.4515 4.4820 4.5109 4.5691 4.5831 4.6436 4.6571 4.6624 4.6715 4.6893 4.8867 4.9111 5.2049 5.2510 5.2769 5.2848 5.3642 5.3751 5.3974 5.4317 5.5570 5.5892 6.3554 6.3607 6.5216 6.5267 6.6128 6.6348 8.6376 8.6566 8.7204 8.8229 8.8918 9.0944 9.2271 9.4233 9.5404 9.6871 10.5881 10.6353 10.9868 11.0056 k = 0.2895 0.5000 0.2895 ( 7430 PWs) bands (ev): -61.0810 -61.0810 -33.9834 -33.9834 -25.3089 -25.3089 -25.3086 -25.3086 -4.4152 -4.4103 -4.2351 -4.1985 -4.0306 -3.9903 -3.9777 -3.9732 2.0207 2.0481 2.1657 2.1892 2.2420 2.3216 2.4288 2.4490 3.3848 3.4947 3.5199 3.5586 3.5703 3.5845 3.6305 3.6493 3.7281 3.7450 3.7732 3.7972 4.0156 4.0261 4.0493 4.0728 4.3569 4.3603 4.4471 4.4783 4.5106 4.5704 4.5819 4.6451 4.6552 4.6629 4.6735 4.6943 4.8994 4.9283 5.1982 5.2451 5.2662 5.2741 5.3477 5.3654 5.3823 5.4230 5.5742 5.6067 6.3207 6.3351 6.4756 6.4935 6.5735 6.5951 8.6315 8.6464 8.7020 8.8116 8.8641 9.0478 9.2008 9.3959 9.5253 9.6784 10.6316 10.6833 11.0519 11.0731 k = 0.2763 0.5000 0.2763 ( 7430 PWs) bands (ev): -61.0810 -61.0810 -33.9834 -33.9834 -25.3089 -25.3089 -25.3086 -25.3086 -4.4359 -4.4315 -4.2465 -4.2113 -4.0166 -3.9773 -3.9635 -3.9593 2.0276 2.0616 2.1912 2.2153 2.2773 2.3566 2.4612 2.4836 3.3609 3.4762 3.5009 3.5358 3.5543 3.5727 3.6209 3.6316 3.7252 3.7463 3.7778 3.8032 4.0259 4.0357 4.0577 4.0818 4.3494 4.3538 4.4437 4.4747 4.5101 4.5730 4.5807 4.6461 4.6532 4.6634 4.6762 4.7002 4.9137 4.9474 5.1913 5.2374 5.2535 5.2625 5.3301 5.3541 5.3675 5.4153 5.5917 5.6241 6.2847 6.3123 6.4270 6.4619 6.5392 6.5606 8.6267 8.6385 8.6757 8.8018 8.8448 8.9992 9.1706 9.3632 9.5081 9.6661 10.6776 10.7334 11.1196 11.1419 k = 0.2632 0.5000 0.2632 ( 7406 PWs) bands (ev): -61.0809 -61.0809 -33.9834 -33.9834 -25.3088 -25.3088 -25.3085 -25.3085 -4.4565 -4.4526 -4.2581 -4.2243 -4.0022 -3.9640 -3.9489 -3.9451 2.0337 2.0738 2.2175 2.2422 2.3125 2.3912 2.4913 2.5156 3.3377 3.4559 3.4810 3.5051 3.5446 3.5587 3.6132 3.6179 3.7253 3.7501 3.7831 3.8094 4.0374 4.0461 4.0667 4.0913 4.3420 4.3468 4.4411 4.4713 4.5093 4.5766 4.5793 4.6465 4.6512 4.6638 4.6797 4.7070 4.9292 4.9680 5.1843 5.2266 5.2365 5.2527 5.3137 5.3417 5.3529 5.4089 5.6093 5.6412 6.2459 6.2919 6.3752 6.4318 6.5113 6.5323 8.6231 8.6328 8.6408 8.7951 8.8337 8.9499 9.1373 9.3264 9.4892 9.6509 10.7251 10.7847 11.1886 11.2104 k = 0.2500 0.5000 0.2500 ( 7398 PWs) bands (ev): -61.0809 -61.0809 -33.9834 -33.9834 -25.3088 -25.3088 -25.3085 -25.3085 -4.4770 -4.4734 -4.2698 -4.2375 -3.9876 -3.9504 -3.9341 -3.9307 2.0387 2.0844 2.2442 2.2698 2.3473 2.4250 2.5189 2.5447 3.3154 3.4333 3.4586 3.4745 3.5361 3.5434 3.6068 3.6088 3.7278 3.7559 3.7890 3.8156 4.0500 4.0571 4.0762 4.1012 4.3348 4.3396 4.4391 4.4681 4.5083 4.5776 4.5807 4.6456 4.6500 4.6642 4.6839 4.7144 4.9456 4.9897 5.1762 5.2130 5.2156 5.2449 5.3001 5.3282 5.3384 5.4039 5.6270 5.6579 6.2032 6.2723 6.3216 6.4040 6.4899 6.5102 8.5994 8.6207 8.6282 8.7924 8.8283 8.9012 9.1017 9.2866 9.4691 9.6333 10.7732 10.8361 11.2574 11.2768 k = 0.2368 0.5000 0.2368 ( 7404 PWs) bands (ev): -61.0809 -61.0809 -33.9834 -33.9834 -25.3088 -25.3088 -25.3084 -25.3084 -4.4972 -4.4940 -4.2816 -4.2508 -3.9727 -3.9367 -3.9192 -3.9162 2.0425 2.0931 2.2713 2.2978 2.3811 2.4575 2.5439 2.5706 3.2944 3.4084 3.4299 3.4500 3.5284 3.5287 3.6014 3.6029 3.7324 3.7633 3.7953 3.8218 4.0635 4.0687 4.0864 4.1116 4.3281 4.3324 4.4377 4.4651 4.5069 4.5756 4.5852 4.6432 4.6498 4.6645 4.6888 4.7223 4.9622 5.0120 5.1645 5.1926 5.2006 5.2389 5.2884 5.3138 5.3248 5.4002 5.6446 5.6741 6.1564 6.2437 6.2768 6.3796 6.4742 6.4937 8.5541 8.6197 8.6232 8.7931 8.8267 8.8552 9.0646 9.2448 9.4481 9.6139 10.8209 10.8865 11.3244 11.3394 k = 0.2237 0.5000 0.2237 ( 7396 PWs) bands (ev): -61.0809 -61.0809 -33.9834 -33.9834 -25.3088 -25.3088 -25.3084 -25.3084 -4.5169 -4.5141 -4.2932 -4.2639 -3.9578 -3.9230 -3.9042 -3.9016 2.0451 2.0998 2.2984 2.3258 2.4135 2.4881 2.5662 2.5934 3.2750 3.3818 3.3972 3.4303 3.5159 3.5214 3.5969 3.5991 3.7391 3.7719 3.8022 3.8280 4.0776 4.0809 4.0977 4.1226 4.3222 4.3254 4.4367 4.4624 4.5053 4.5733 4.5896 4.6399 4.6501 4.6649 4.6943 4.7305 4.9782 5.0340 5.1465 5.1688 5.1943 5.2349 5.2763 5.2987 5.3138 5.3978 5.6622 5.6898 6.1057 6.1907 6.2569 6.3592 6.4631 6.4819 8.5071 8.6143 8.6209 8.7963 8.8150 8.8281 9.0267 9.2019 9.4264 9.5930 10.8671 10.9352 11.3879 11.3962 k = 0.2105 0.5000 0.2105 ( 7400 PWs) bands (ev): -61.0809 -61.0809 -33.9834 -33.9834 -25.3088 -25.3088 -25.3084 -25.3084 -4.5361 -4.5336 -4.3047 -4.2770 -3.9428 -3.9094 -3.8893 -3.8870 2.0465 2.1044 2.3253 2.3537 2.4440 2.5162 2.5859 2.6132 3.2574 3.3544 3.3643 3.4125 3.5055 3.5151 3.5931 3.5964 3.7475 3.7812 3.8095 3.8342 4.0914 4.0934 4.1109 4.1344 4.3173 4.3188 4.4361 4.4600 4.5036 4.5706 4.5937 4.6362 4.6508 4.6653 4.7000 4.7388 4.9923 5.0539 5.1252 5.1455 5.1944 5.2325 5.2615 5.2839 5.3065 5.3965 5.6794 5.7046 6.0523 6.1296 6.2465 6.3428 6.4556 6.4739 8.4599 8.5987 8.6234 8.7847 8.8012 8.8320 8.9887 9.1590 9.4044 9.5710 10.9110 10.9809 11.4453 11.4461 k = 0.1974 0.5000 0.1974 ( 7402 PWs) bands (ev): -61.0809 -61.0809 -33.9834 -33.9834 -25.3087 -25.3087 -25.3083 -25.3083 -4.5546 -4.5525 -4.3158 -4.2897 -3.9280 -3.8960 -3.8746 -3.8727 2.0466 2.1066 2.3517 2.3809 2.4722 2.5415 2.6032 2.6304 3.2416 3.3274 3.3325 3.3960 3.4973 3.5098 3.5900 3.5945 3.7573 3.7909 3.8173 3.8403 4.1043 4.1061 4.1268 4.1471 4.3130 4.3136 4.4357 4.4580 4.5018 4.5675 4.5972 4.6321 4.6518 4.6656 4.7058 4.7468 5.0027 5.0652 5.1093 5.1242 5.1995 5.2305 5.2443 5.2720 5.3025 5.3960 5.6962 5.7185 5.9972 6.0665 6.2403 6.3303 6.4509 6.4689 8.4135 8.5730 8.6276 8.7673 8.8070 8.8378 8.9512 9.1168 9.3823 9.5482 10.9515 11.0230 11.4843 11.4971 k = 0.1842 0.5000 0.1842 ( 7408 PWs) bands (ev): -61.0810 -61.0810 -33.9834 -33.9834 -25.3087 -25.3087 -25.3083 -25.3083 -4.5724 -4.5706 -4.3266 -4.3021 -3.9134 -3.8829 -3.8602 -3.8586 2.0455 2.1066 2.3772 2.4071 2.4977 2.5632 2.6184 2.6455 3.2275 3.3020 3.3026 3.3808 3.4912 3.5052 3.5875 3.5930 3.7681 3.8004 3.8254 3.8462 4.1160 4.1188 4.1451 4.1608 4.3079 4.3114 4.4356 4.4562 4.4998 4.5641 4.5998 4.6278 4.6531 4.6658 4.7114 4.7541 5.0072 5.0549 5.1062 5.1125 5.2080 5.2259 5.2268 5.2675 5.3005 5.3962 5.7121 5.7311 5.9414 6.0027 6.2378 6.3215 6.4484 6.4663 8.3686 8.5382 8.6332 8.7620 8.8126 8.8455 8.9151 9.0766 9.3604 9.5247 10.9878 11.0605 11.5109 11.5383 k = 0.1711 0.5000 0.1711 ( 7400 PWs) bands (ev): -61.0809 -61.0809 -33.9833 -33.9833 -25.3087 -25.3087 -25.3083 -25.3083 -4.5894 -4.5878 -4.3369 -4.3140 -3.8991 -3.8702 -3.8462 -3.8448 2.0432 2.1043 2.4017 2.4320 2.5200 2.5809 2.6319 2.6590 3.2147 3.2751 3.2795 3.3669 3.4868 3.5014 3.5856 3.5919 3.7794 3.8097 3.8338 3.8519 4.1269 4.1310 4.1652 4.1757 4.3040 4.3111 4.4357 4.4547 4.4979 4.5605 4.6012 4.6234 4.6550 4.6659 4.7163 4.7606 5.0039 5.0327 5.0919 5.1244 5.2047 5.2188 5.2256 5.2721 5.2997 5.3971 5.7269 5.7420 5.8861 5.9392 6.2391 6.3167 6.4474 6.4656 8.3259 8.4978 8.6399 8.7654 8.8166 8.8546 8.8815 9.0401 9.3389 9.5009 11.0191 11.0926 11.5226 11.5669 k = 0.1579 0.5000 0.1579 ( 7408 PWs) bands (ev): -61.0810 -61.0810 -33.9833 -33.9833 -25.3087 -25.3087 -25.3082 -25.3082 -4.6055 -4.6041 -4.3467 -4.3255 -3.8852 -3.8580 -3.8327 -3.8316 2.0399 2.1000 2.4248 2.4551 2.5388 2.5946 2.6442 2.6714 3.2027 3.2504 3.2611 3.3543 3.4838 3.4985 3.5843 3.5911 3.7909 3.8185 3.8422 3.8573 4.1372 4.1427 4.1865 4.1918 4.3015 4.3128 4.4359 4.4535 4.4960 4.5567 4.6011 4.6191 4.6572 4.6657 4.7202 4.7657 4.9933 5.0083 5.0792 5.1311 5.1946 5.2142 5.2401 5.2828 5.3001 5.3983 5.7400 5.7508 5.8322 5.8763 6.2443 6.3158 6.4477 6.4663 8.2858 8.4550 8.6471 8.7731 8.8167 8.8524 8.8647 9.0095 9.3180 9.4768 11.0448 11.1187 11.5172 11.5791 k = 0.1447 0.5000 0.1447 ( 7396 PWs) bands (ev): -61.0809 -61.0809 -33.9833 -33.9833 -25.3087 -25.3087 -25.3082 -25.3082 -4.6205 -4.6194 -4.3559 -4.3364 -3.8718 -3.8465 -3.8198 -3.8189 2.0358 2.0939 2.4462 2.4761 2.5538 2.6043 2.6558 2.6829 3.1910 3.2289 3.2475 3.3430 3.4822 3.4962 3.5836 3.5906 3.8023 3.8268 3.8503 3.8624 4.1469 4.1535 4.2083 4.2089 4.3007 4.3173 4.4362 4.4526 4.4943 4.5528 4.5994 4.6155 4.6598 4.6652 4.7231 4.7696 4.9781 4.9840 5.0647 5.1233 5.1981 5.2156 5.2560 5.2968 5.3019 5.4002 5.7507 5.7572 5.7805 5.8150 6.2535 6.3190 6.4487 6.4680 8.2488 8.4119 8.6536 8.7790 8.8103 8.8334 8.8754 8.9876 9.2979 9.4525 11.0644 11.1385 11.4941 11.5712 k = 0.1316 0.5000 0.1316 ( 7408 PWs) bands (ev): -61.0810 -61.0810 -33.9833 -33.9833 -25.3087 -25.3087 -25.3082 -25.3082 -4.6345 -4.6336 -4.3644 -4.3466 -3.8591 -3.8357 -3.8077 -3.8070 2.0310 2.0863 2.4658 2.4946 2.5650 2.6105 2.6668 2.6933 3.1799 3.2107 3.2388 3.3328 3.4815 3.4946 3.5833 3.5903 3.8133 3.8347 3.8578 3.8672 4.1558 4.1631 4.2268 4.2299 4.3019 4.3247 4.4364 4.4520 4.4927 4.5490 4.5959 4.6123 4.6626 4.6642 4.7250 4.7720 4.9602 4.9606 5.0467 5.1041 5.2122 5.2239 5.2710 5.3062 5.3123 5.4026 5.7319 5.7541 5.7585 5.7622 6.2665 6.3263 6.4504 6.4705 8.2151 8.3697 8.6576 8.7746 8.7957 8.8338 8.8862 8.9763 9.2790 9.4282 11.0779 11.1514 11.4545 11.5416 k = 0.1184 0.5000 0.1184 ( 7416 PWs) bands (ev): -61.0810 -61.0810 -33.9833 -33.9833 -25.3087 -25.3087 -25.3082 -25.3082 -4.6474 -4.6466 -4.3722 -4.3561 -3.8471 -3.8257 -3.7964 -3.7958 2.0259 2.0775 2.4835 2.5103 2.5727 2.6140 2.6775 2.7025 3.1702 3.1959 3.2342 3.3236 3.4815 3.4934 3.5834 3.5903 3.8237 3.8420 3.8647 3.8715 4.1638 4.1715 4.2453 4.2507 4.3054 4.3357 4.4364 4.4516 4.4914 4.5454 4.5910 4.6094 4.6624 4.6655 4.7261 4.7733 4.9374 4.9422 5.0257 5.0802 5.2288 5.2378 5.2848 5.3141 5.3276 5.4059 5.6872 5.6989 5.7613 5.7627 6.2830 6.3376 6.4524 6.4734 8.1850 8.3291 8.6564 8.7665 8.7738 8.8491 8.8964 8.9748 9.2614 9.4040 11.0852 11.1576 11.4022 11.4927 k = 0.1053 0.5000 0.1053 ( 7416 PWs) bands (ev): -61.0810 -61.0810 -33.9833 -33.9833 -25.3087 -25.3087 -25.3081 -25.3081 -4.6590 -4.6584 -4.3793 -4.3649 -3.8359 -3.8166 -3.7859 -3.7855 2.0207 2.0680 2.4991 2.5232 2.5775 2.6153 2.6875 2.7105 3.1624 3.1844 3.2326 3.3154 3.4821 3.4926 3.5840 3.5905 3.8334 3.8489 3.8707 3.8753 4.1708 4.1784 4.2638 4.2703 4.3115 4.3502 4.4364 4.4515 4.4905 4.5420 4.5851 4.6063 4.6596 4.6683 4.7265 4.7737 4.9156 4.9235 5.0033 5.0542 5.2418 5.2555 5.3011 5.3248 5.3412 5.4107 5.6462 5.6471 5.7584 5.7632 6.3024 6.3524 6.4546 6.4768 8.1588 8.2908 8.6485 8.7474 8.7647 8.8702 8.9051 8.9802 9.2456 9.3800 11.0870 11.1570 11.3421 11.4306 k = 0.0921 0.5000 0.0921 ( 7420 PWs) bands (ev): -61.0810 -61.0810 -33.9833 -33.9833 -25.3087 -25.3087 -25.3081 -25.3081 -4.6695 -4.6690 -4.3855 -4.3728 -3.8256 -3.8085 -3.7765 -3.7762 2.0157 2.0581 2.5126 2.5333 2.5801 2.6150 2.6969 2.7171 3.1569 3.1758 3.2333 3.3079 3.4831 3.4921 3.5849 3.5909 3.8423 3.8552 3.8758 3.8786 4.1766 4.1839 4.2818 4.2886 4.3206 4.3678 4.4361 4.4516 4.4903 4.5390 4.5785 4.6026 4.6557 4.6707 4.7269 4.7738 4.8950 4.9049 4.9808 5.0272 5.2484 5.2754 5.3228 5.3365 5.3514 5.4176 5.5985 5.6121 5.7524 5.7598 6.3238 6.3699 6.4570 6.4804 8.1365 8.2552 8.6356 8.7194 8.7702 8.8939 8.9117 8.9899 9.2317 9.3562 11.0840 11.1500 11.2792 11.3623 k = 0.0789 0.5000 0.0789 ( 7422 PWs) bands (ev): -61.0810 -61.0810 -33.9833 -33.9833 -25.3087 -25.3087 -25.3081 -25.3081 -4.6786 -4.6782 -4.3908 -4.3799 -3.8163 -3.8015 -3.7682 -3.7680 2.0112 2.0482 2.5241 2.5407 2.5812 2.6134 2.7053 2.7225 3.1537 3.1697 3.2356 3.3010 3.4842 3.4917 3.5860 3.5914 3.8504 3.8609 3.8799 3.8814 4.1814 4.1879 4.2986 4.3055 4.3327 4.3873 4.4361 4.4520 4.4908 4.5364 4.5711 4.5984 4.6507 4.6724 4.7278 4.7741 4.8760 4.8863 4.9592 5.0002 5.2508 5.2953 5.3437 5.3526 5.3570 5.4272 5.5574 5.5823 5.7434 5.7527 6.3459 6.3887 6.4594 6.4841 8.1184 8.2224 8.6208 8.6917 8.7808 8.9156 8.9187 9.0017 9.2202 9.3329 11.0773 11.1372 11.2182 11.2942 k = 0.0658 0.5000 0.0658 ( 7410 PWs) bands (ev): -61.0810 -61.0810 -33.9833 -33.9833 -25.3087 -25.3087 -25.3081 -25.3081 -4.6864 -4.6861 -4.3952 -4.3862 -3.8081 -3.7957 -3.7610 -3.7608 2.0074 2.0386 2.5335 2.5459 2.5816 2.6109 2.7128 2.7268 3.1524 3.1657 3.2391 3.2945 3.4854 3.4915 3.5873 3.5920 3.8576 3.8659 3.8831 3.8836 4.1852 4.1908 4.3135 4.3211 4.3476 4.4057 4.4373 4.4527 4.4926 4.5344 4.5629 4.5938 4.6448 4.6725 4.7298 4.7750 4.8589 4.8679 4.9394 4.9738 5.2515 5.3130 5.3537 5.3573 5.3802 5.4394 5.5249 5.5575 5.7321 5.7423 6.3675 6.4072 6.4624 6.4878 8.1044 8.1927 8.6066 8.6656 8.7944 8.9163 8.9437 9.0142 9.2113 9.3103 11.0681 11.1191 11.1631 11.2313 k = 0.0526 0.5000 0.0526 ( 7404 PWs) bands (ev): -61.0810 -61.0810 -33.9833 -33.9833 -25.3087 -25.3087 -25.3080 -25.3080 -4.6928 -4.6926 -4.3987 -4.3914 -3.8011 -3.7911 -3.7550 -3.7549 2.0045 2.0298 2.5408 2.5492 2.5822 2.6078 2.7191 2.7301 3.1525 3.1631 3.2435 3.2883 3.4865 3.4913 3.5887 3.5925 3.8639 3.8703 3.8852 3.8853 4.1882 4.1927 4.3266 4.3351 4.3640 4.4181 4.4431 4.4537 4.4958 4.5336 4.5538 4.5888 4.6386 4.6703 4.7339 4.7769 4.8439 4.8497 4.9222 4.9490 5.2525 5.3244 5.3547 5.3606 5.4092 5.4532 5.5028 5.5374 5.7193 5.7295 6.3874 6.4232 6.4664 6.4913 8.0947 8.1664 8.5947 8.6420 8.8096 8.9135 8.9680 9.0259 9.2052 9.2885 11.0569 11.0965 11.1178 11.1780 k = 0.0395 0.5000 0.0395 ( 7404 PWs) bands (ev): -61.0810 -61.0810 -33.9833 -33.9833 -25.3087 -25.3087 -25.3080 -25.3080 -4.6978 -4.6977 -4.4012 -4.3958 -3.7953 -3.7877 -3.7503 -3.7503 2.0027 2.0219 2.5460 2.5511 2.5834 2.6042 2.7242 2.7323 3.1536 3.1615 3.2484 3.2823 3.4875 3.4910 3.5899 3.5929 3.8692 3.8739 3.8862 3.8866 4.1905 4.1939 4.3379 4.3466 4.3804 4.4218 4.4536 4.4553 4.5002 4.5355 4.5436 4.5836 4.6332 4.6649 4.7404 4.7798 4.8314 4.8322 4.9081 4.9271 5.2551 5.3221 5.3564 5.3655 5.4367 5.4666 5.4917 5.5212 5.7060 5.7155 6.4045 6.4340 6.4726 6.4943 8.0892 8.1436 8.5859 8.6216 8.8257 8.9073 8.9904 9.0354 9.2025 9.2678 11.0430 11.0705 11.0868 11.1370 k = 0.0263 0.5000 0.0263 ( 7416 PWs) bands (ev): -61.0810 -61.0810 -33.9833 -33.9833 -25.3087 -25.3087 -25.3080 -25.3080 -4.7014 -4.7013 -4.4028 -4.3992 -3.7907 -3.7856 -3.7469 -3.7469 2.0023 2.0151 2.5493 2.5521 2.5855 2.6002 2.7283 2.7335 3.1551 3.1603 3.2537 3.2764 3.4884 3.4907 3.5911 3.5930 3.8735 3.8766 3.8868 3.8871 4.1922 4.1944 4.3473 4.3547 4.3953 4.4215 4.4577 4.4621 4.5039 4.5329 4.5423 4.5780 4.6302 4.6564 4.7496 4.7829 4.8163 4.8211 4.8978 4.9095 5.2603 5.3091 5.3621 5.3685 5.4608 5.4767 5.4900 5.5083 5.6942 5.7018 6.4183 6.4389 6.4807 6.4961 8.0879 8.1245 8.5810 8.6048 8.8419 8.8981 9.0100 9.0412 9.2035 9.2489 11.0273 11.0450 11.0725 11.1078 k = 0.0132 0.5000 0.0132 ( 7416 PWs) bands (ev): -61.0810 -61.0810 -33.9833 -33.9833 -25.3087 -25.3087 -25.3080 -25.3080 -4.7036 -4.7035 -4.4034 -4.4016 -3.7875 -3.7849 -3.7449 -3.7449 2.0033 2.0097 2.5511 2.5523 2.5886 2.5962 2.7312 2.7338 3.1566 3.1593 3.2592 3.2706 3.4892 3.4903 3.5920 3.5930 3.8765 3.8781 3.8870 3.8872 4.1934 4.1945 4.3544 4.3587 4.4072 4.4194 4.4610 4.4657 4.5075 4.5225 4.5528 4.5716 4.6313 4.6463 4.7610 4.7824 4.8060 4.8127 4.8920 4.8974 5.2684 5.2938 5.3666 5.3698 5.4793 5.4830 5.4927 5.4980 5.6865 5.6908 6.4286 6.4389 6.4883 6.4962 8.0909 8.1093 8.5803 8.5923 8.8578 8.8864 9.0258 9.0418 9.2089 9.2322 11.0165 11.0255 11.0699 11.0879 k = 0.0000 0.5000-0.0000 ( 7368 PWs) bands (ev): -61.0809 -61.0809 -33.9833 -33.9833 -25.3086 -25.3086 -25.3080 -25.3080 -4.7043 -4.7043 -4.4030 -4.4030 -3.7855 -3.7855 -3.7442 -3.7442 2.0058 2.0058 2.5521 2.5521 2.5923 2.5923 2.7330 2.7330 3.1581 3.1581 3.2649 3.2649 3.4899 3.4899 3.5928 3.5928 3.8782 3.8782 3.8871 3.8871 4.1943 4.1943 4.3585 4.3585 4.4151 4.4151 4.4646 4.4646 4.5136 4.5136 4.5633 4.5633 4.6371 4.6371 4.7733 4.7733 4.8066 4.8066 4.8917 4.8917 5.2798 5.2798 5.3692 5.3692 5.4886 5.4886 5.4914 5.4914 5.6853 5.6853 6.4354 6.4354 6.4937 6.4937 8.0981 8.0981 8.5841 8.5841 8.8728 8.8728 9.0367 9.0367 9.2186 9.2186 11.0156 11.0156 11.0753 11.0753 k = 0.5000 0.5000-0.0000 ( 7380 PWs) bands (ev): -61.0809 -61.0809 -33.9833 -33.9833 -25.3089 -25.3089 -25.3083 -25.3083 -4.3472 -4.3472 -4.1718 -4.1718 -4.1166 -4.1166 -4.0394 -4.0394 2.2152 2.2152 2.3664 2.3664 2.5014 2.5014 3.0634 3.0634 3.1105 3.1105 3.4026 3.4026 3.4370 3.4370 3.5008 3.5008 3.5854 3.5854 3.8569 3.8569 3.9772 3.9772 3.9788 3.9788 4.3481 4.3481 4.4904 4.4904 4.5011 4.5011 4.6326 4.6326 4.6819 4.6819 4.7172 4.7172 4.8676 4.8676 5.0653 5.0653 5.2545 5.2545 5.2926 5.2926 5.3113 5.3113 5.4970 5.4970 6.0732 6.0732 6.1936 6.1936 6.7255 6.7255 8.4211 8.4211 8.7764 8.7764 9.1834 9.1834 9.3519 9.3519 9.3928 9.3928 11.1496 11.1496 11.1779 11.1779 k = 0.5000 0.5000 0.0185 ( 7388 PWs) bands (ev): -61.0809 -61.0809 -33.9834 -33.9834 -25.3089 -25.3089 -25.3083 -25.3083 -4.3468 -4.3468 -4.1717 -4.1717 -4.1165 -4.1165 -4.0395 -4.0395 2.2138 2.2138 2.3645 2.3645 2.4988 2.4988 3.0270 3.0270 3.1448 3.1448 3.4054 3.4054 3.4384 3.4384 3.5018 3.5018 3.5856 3.5856 3.8566 3.8566 3.9758 3.9758 3.9802 3.9802 4.3486 4.3486 4.4900 4.4900 4.5012 4.5012 4.6325 4.6325 4.6816 4.6816 4.7162 4.7162 4.8672 4.8672 5.0658 5.0658 5.2559 5.2559 5.2950 5.2950 5.3135 5.3135 5.4967 5.4967 6.0739 6.0739 6.1945 6.1945 6.7264 6.7264 8.4199 8.4199 8.7799 8.7799 9.1836 9.1836 9.3515 9.3515 9.3941 9.3941 11.1480 11.1480 11.1762 11.1762 k = 0.5000 0.5000 0.0370 ( 7408 PWs) bands (ev): -61.0810 -61.0810 -33.9834 -33.9834 -25.3089 -25.3089 -25.3083 -25.3083 -4.3457 -4.3457 -4.1714 -4.1714 -4.1163 -4.1163 -4.0397 -4.0397 2.2098 2.2098 2.3588 2.3588 2.4910 2.4910 2.9727 2.9727 3.1924 3.1924 3.4139 3.4139 3.4425 3.4425 3.5045 3.5045 3.5864 3.5864 3.8556 3.8556 3.9739 3.9739 3.9821 3.9821 4.3504 4.3504 4.4889 4.4889 4.5012 4.5012 4.6324 4.6324 4.6807 4.6807 4.7135 4.7135 4.8659 4.8659 5.0671 5.0671 5.2602 5.2602 5.3018 5.3018 5.3200 5.3200 5.4956 5.4956 6.0758 6.0758 6.1973 6.1973 6.7290 6.7290 8.4165 8.4165 8.7901 8.7901 9.1842 9.1842 9.3503 9.3503 9.3979 9.3979 11.1431 11.1431 11.1709 11.1709 k = 0.5000 0.5000 0.0556 ( 7400 PWs) bands (ev): -61.0809 -61.0809 -33.9834 -33.9834 -25.3089 -25.3089 -25.3083 -25.3083 -4.3438 -4.3438 -4.1710 -4.1710 -4.1159 -4.1159 -4.0401 -4.0401 2.2032 2.2032 2.3495 2.3495 2.4785 2.4785 2.9160 2.9160 3.2374 3.2374 3.4280 3.4280 3.4495 3.4495 3.5091 3.5091 3.5878 3.5878 3.8542 3.8542 3.9720 3.9720 3.9840 3.9840 4.3534 4.3534 4.4872 4.4872 4.5014 4.5014 4.6323 4.6323 4.6794 4.6794 4.7093 4.7093 4.8641 4.8641 5.0693 5.0693 5.2675 5.2675 5.3125 5.3125 5.3302 5.3302 5.4939 5.4939 6.0793 6.0793 6.2023 6.2023 6.7334 6.7334 8.4115 8.4115 8.8065 8.8065 9.1849 9.1849 9.3487 9.3487 9.4039 9.4039 11.1349 11.1349 11.1619 11.1619 k = 0.5000 0.5000 0.0741 ( 7396 PWs) bands (ev): -61.0809 -61.0809 -33.9834 -33.9834 -25.3089 -25.3089 -25.3084 -25.3084 -4.3412 -4.3412 -4.1705 -4.1705 -4.1153 -4.1153 -4.0406 -4.0406 2.1941 2.1941 2.3369 2.3369 2.4617 2.4617 2.8585 2.8585 3.2777 3.2777 3.4469 3.4469 3.4598 3.4598 3.5155 3.5155 3.5899 3.5899 3.8521 3.8521 3.9701 3.9701 3.9859 3.9859 4.3574 4.3574 4.4850 4.4850 4.5017 4.5017 4.6322 4.6322 4.6778 4.6778 4.7041 4.7041 4.8618 4.8618 5.0723 5.0723 5.2776 5.2776 5.3264 5.3264 5.3433 5.3433 5.4915 5.4915 6.0847 6.0847 6.2096 6.2096 6.7395 6.7395 8.4058 8.4058 8.8282 8.8282 9.1857 9.1857 9.3470 9.3470 9.4117 9.4117 11.1232 11.1232 11.1492 11.1492 k = 0.5000 0.5000 0.0926 ( 7396 PWs) bands (ev): -61.0809 -61.0809 -33.9834 -33.9834 -25.3089 -25.3089 -25.3084 -25.3084 -4.3379 -4.3379 -4.1698 -4.1698 -4.1146 -4.1146 -4.0414 -4.0414 2.1828 2.1828 2.3212 2.3212 2.4412 2.4412 2.8008 2.8008 3.3128 3.3128 3.4650 3.4650 3.4781 3.4781 3.5239 3.5239 3.5929 3.5929 3.8495 3.8495 3.9684 3.9684 3.9877 3.9877 4.3623 4.3623 4.4823 4.4823 4.5019 4.5019 4.6322 4.6322 4.6759 4.6759 4.6982 4.6982 4.8591 4.8591 5.0759 5.0759 5.2902 5.2902 5.3425 5.3425 5.3586 5.3586 5.4884 5.4884 6.0924 6.0924 6.2199 6.2199 6.7471 6.7471 8.4002 8.4002 8.8543 8.8543 9.1861 9.1861 9.3456 9.3456 9.4211 9.4211 11.1078 11.1078 11.1325 11.1325 k = 0.5000 0.5000 0.1111 ( 7400 PWs) bands (ev): -61.0809 -61.0809 -33.9834 -33.9834 -25.3089 -25.3089 -25.3084 -25.3084 -4.3338 -4.3338 -4.1690 -4.1690 -4.1138 -4.1138 -4.0422 -4.0422 2.1694 2.1694 2.3030 2.3030 2.4176 2.4176 2.7432 2.7432 3.3427 3.3427 3.4793 3.4793 3.5045 3.5045 3.5350 3.5350 3.5973 3.5973 3.8463 3.8463 3.9668 3.9668 3.9893 3.9893 4.3680 4.3680 4.4794 4.4794 4.5022 4.5022 4.6321 4.6321 4.6738 4.6738 4.6920 4.6920 4.8564 4.8564 5.0803 5.0803 5.3047 5.3047 5.3596 5.3596 5.3751 5.3751 5.4848 5.4848 6.1032 6.1032 6.2336 6.2336 6.7564 6.7564 8.3956 8.3956 8.8838 8.8838 9.1857 9.1857 9.3446 9.3446 9.4316 9.4316 11.0886 11.0886 11.1116 11.1116 k = 0.5000 0.5000 0.1296 ( 7408 PWs) bands (ev): -61.0810 -61.0810 -33.9834 -33.9834 -25.3089 -25.3089 -25.3084 -25.3084 -4.3292 -4.3292 -4.1680 -4.1680 -4.1128 -4.1128 -4.0433 -4.0433 2.1542 2.1542 2.2825 2.2825 2.3916 2.3916 2.6863 2.6863 3.3687 3.3687 3.4938 3.4938 3.5290 3.5290 3.5512 3.5512 3.6044 3.6044 3.8426 3.8426 3.9652 3.9652 3.9908 3.9908 4.3741 4.3741 4.4765 4.4765 4.5025 4.5025 4.6323 4.6323 4.6716 4.6716 4.6860 4.6860 4.8536 4.8536 5.0856 5.0856 5.3204 5.3204 5.3768 5.3768 5.3919 5.3919 5.4807 5.4807 6.1175 6.1175 6.2513 6.2513 6.7670 6.7670 8.3927 8.3927 8.9161 8.9161 9.1842 9.1842 9.3445 9.3445 9.4429 9.4429 11.0654 11.0654 11.0867 11.0867 k = 0.5000 0.5000 0.1481 ( 7420 PWs) bands (ev): -61.0810 -61.0810 -33.9834 -33.9834 -25.3090 -25.3090 -25.3085 -25.3085 -4.3239 -4.3239 -4.1670 -4.1670 -4.1118 -4.1118 -4.0446 -4.0446 2.1374 2.1374 2.2602 2.2602 2.3639 2.3639 2.6303 2.6303 3.3919 3.3919 3.5090 3.5090 3.5459 3.5459 3.5718 3.5718 3.6177 3.6177 3.8384 3.8384 3.9639 3.9639 3.9921 3.9921 4.3804 4.3804 4.4740 4.4740 4.5027 4.5027 4.6326 4.6326 4.6690 4.6690 4.6808 4.6808 4.8510 4.8510 5.0919 5.0919 5.3366 5.3366 5.3931 5.3931 5.4080 5.4080 5.4762 5.4762 6.1361 6.1361 6.2736 6.2736 6.7790 6.7790 8.3922 8.3922 8.9502 8.9502 9.1814 9.1814 9.3454 9.3454 9.4545 9.4545 11.0382 11.0382 11.0577 11.0577 k = 0.5000 0.5000 0.1667 ( 7404 PWs) bands (ev): -61.0809 -61.0809 -33.9834 -33.9834 -25.3089 -25.3089 -25.3085 -25.3085 -4.3180 -4.3180 -4.1658 -4.1658 -4.1106 -4.1106 -4.0461 -4.0461 2.1194 2.1194 2.2365 2.2365 2.3349 2.3349 2.5753 2.5753 3.4133 3.4133 3.5248 3.5248 3.5595 3.5595 3.5873 3.5873 3.6411 3.6411 3.8338 3.8338 3.9626 3.9626 3.9932 3.9932 4.3865 4.3865 4.4725 4.4725 4.5030 4.5030 4.6332 4.6332 4.6657 4.6657 4.6769 4.6769 4.8486 4.8486 5.0995 5.0995 5.3525 5.3525 5.4077 5.4077 5.4226 5.4226 5.4714 5.4714 6.1594 6.1594 6.3009 6.3009 6.7923 6.7923 8.3945 8.3945 8.9854 8.9854 9.1772 9.1772 9.3473 9.3473 9.4658 9.4658 11.0069 11.0069 11.0252 11.0252 k = 0.5000 0.5000 0.1852 ( 7404 PWs) bands (ev): -61.0809 -61.0809 -33.9834 -33.9834 -25.3089 -25.3089 -25.3085 -25.3085 -4.3115 -4.3115 -4.1646 -4.1646 -4.1093 -4.1093 -4.0477 -4.0477 2.1004 2.1004 2.2120 2.2120 2.3052 2.3052 2.5218 2.5218 3.4334 3.4334 3.5409 3.5409 3.5721 3.5721 3.5974 3.5974 3.6706 3.6706 3.8288 3.8288 3.9616 3.9616 3.9941 3.9941 4.3916 4.3916 4.4723 4.4723 4.5033 4.5033 4.6340 4.6340 4.6617 4.6617 4.6744 4.6744 4.8464 4.8464 5.1082 5.1082 5.3674 5.3674 5.4200 5.4200 5.4348 5.4348 5.4666 5.4666 6.1878 6.1878 6.3334 6.3334 6.8066 6.8066 8.4000 8.4000 9.0204 9.0204 9.1719 9.1719 9.3502 9.3502 9.4763 9.4763 10.9716 10.9716 10.9899 10.9899 k = 0.5000 0.5000 0.2037 ( 7416 PWs) bands (ev): -61.0810 -61.0810 -33.9834 -33.9834 -25.3090 -25.3090 -25.3085 -25.3085 -4.3046 -4.3046 -4.1634 -4.1634 -4.1080 -4.1080 -4.0497 -4.0497 2.0808 2.0808 2.1869 2.1869 2.2754 2.2754 2.4699 2.4699 3.4527 3.4527 3.5571 3.5571 3.5837 3.5837 3.6064 3.6064 3.7014 3.7014 3.8235 3.8235 3.9606 3.9606 3.9948 3.9948 4.3954 4.3954 4.4740 4.4740 4.5035 4.5035 4.6351 4.6351 4.6575 4.6575 4.6730 4.6730 4.8443 4.8443 5.1181 5.1181 5.3806 5.3806 5.4299 5.4299 5.4439 5.4439 5.4621 5.4621 6.2212 6.2212 6.3712 6.3712 6.8219 6.8219 8.4092 8.4092 9.0537 9.0537 9.1664 9.1664 9.3538 9.3538 9.4853 9.4853 10.9326 10.9326 10.9528 10.9528 k = 0.5000 0.5000 0.2222 ( 7416 PWs) bands (ev): -61.0810 -61.0810 -33.9834 -33.9834 -25.3090 -25.3090 -25.3086 -25.3086 -4.2972 -4.2972 -4.1621 -4.1621 -4.1067 -4.1067 -4.0518 -4.0518 2.0607 2.0607 2.1617 2.1617 2.2457 2.2457 2.4199 2.4199 3.4715 3.4715 3.5730 3.5730 3.5939 3.5939 3.6162 3.6162 3.7312 3.7312 3.8179 3.8179 3.9599 3.9599 3.9953 3.9953 4.3976 4.3976 4.4780 4.4780 4.5038 4.5038 4.6362 4.6362 4.6536 4.6536 4.6721 4.6721 4.8425 4.8425 5.1292 5.1292 5.3913 5.3913 5.4373 5.4373 5.4482 5.4482 5.4597 5.4597 6.2596 6.2596 6.4142 6.4142 6.8381 6.8381 8.4222 8.4222 9.0819 9.0819 9.1630 9.1630 9.3580 9.3580 9.4922 9.4922 10.8902 10.8902 10.9146 10.9146 k = 0.5000 0.5000 0.2407 ( 7408 PWs) bands (ev): -61.0809 -61.0809 -33.9834 -33.9834 -25.3090 -25.3090 -25.3086 -25.3086 -4.2894 -4.2894 -4.1609 -4.1609 -4.1053 -4.1053 -4.0542 -4.0542 2.0406 2.0406 2.1368 2.1368 2.2166 2.2166 2.3718 2.3718 3.4897 3.4897 3.5884 3.5884 3.6027 3.6027 3.6274 3.6274 3.7588 3.7588 3.8123 3.8123 3.9595 3.9595 3.9956 3.9956 4.3982 4.3982 4.4838 4.4838 4.5043 4.5043 4.6371 4.6371 4.6505 4.6505 4.6716 4.6716 4.8410 4.8410 5.1414 5.1414 5.3988 5.3988 5.4415 5.4415 5.4475 5.4475 5.4611 5.4611 6.3024 6.3024 6.4618 6.4618 6.8549 6.8549 8.4394 8.4394 9.0992 9.0992 9.1667 9.1667 9.3627 9.3627 9.4963 9.4963 10.8452 10.8452 10.8762 10.8762 k = 0.5000 0.5000 0.2593 ( 7412 PWs) bands (ev): -61.0810 -61.0810 -33.9834 -33.9834 -25.3090 -25.3090 -25.3086 -25.3086 -4.2813 -4.2813 -4.1597 -4.1597 -4.1039 -4.1039 -4.0568 -4.0568 2.0206 2.0206 2.1125 2.1125 2.1884 2.1884 2.3259 2.3259 3.5074 3.5074 3.6025 3.6025 3.6113 3.6113 3.6393 3.6393 3.7825 3.7825 3.8081 3.8081 3.9593 3.9593 3.9958 3.9958 4.3975 4.3975 4.4910 4.4910 4.5052 4.5052 4.6372 4.6372 4.6489 4.6489 4.6714 4.6714 4.8396 4.8396 5.1546 5.1546 5.4029 5.4029 5.4388 5.4388 5.4489 5.4489 5.4631 5.4631 6.3488 6.3488 6.5135 6.5135 6.8724 6.8724 8.4608 8.4608 9.1019 9.1019 9.1797 9.1797 9.3680 9.3680 9.4971 9.4971 10.7980 10.7980 10.8383 10.8383 k = 0.5000 0.5000 0.2778 ( 7428 PWs) bands (ev): -61.0810 -61.0810 -33.9834 -33.9834 -25.3090 -25.3090 -25.3087 -25.3087 -4.2730 -4.2730 -4.1586 -4.1586 -4.1025 -4.1025 -4.0596 -4.0596 2.0011 2.0011 2.0891 2.0891 2.1614 2.1614 2.2824 2.2824 3.5246 3.5246 3.6131 3.6131 3.6223 3.6223 3.6515 3.6515 3.7926 3.7926 3.8147 3.8147 3.9595 3.9595 3.9957 3.9957 4.3959 4.3959 4.4974 4.4974 4.5079 4.5079 4.6361 4.6361 4.6489 4.6489 4.6712 4.6712 4.8383 4.8383 5.1686 5.1686 5.4036 5.4036 5.4330 5.4330 5.4500 5.4500 5.4650 5.4650 6.3979 6.3979 6.5684 6.5684 6.8903 6.8903 8.4866 8.4866 9.0955 9.0955 9.1949 9.1949 9.3739 9.3739 9.4942 9.4942 10.7487 10.7487 10.8018 10.8018 k = 0.5000 0.5000 0.2963 ( 7440 PWs) bands (ev): -61.0810 -61.0810 -33.9835 -33.9835 -25.3090 -25.3090 -25.3088 -25.3088 -4.2644 -4.2644 -4.1575 -4.1575 -4.1011 -4.1011 -4.0627 -4.0627 1.9822 1.9822 2.0669 2.0669 2.1357 2.1357 2.2414 2.2414 3.5413 3.5413 3.6206 3.6206 3.6355 3.6355 3.6633 3.6633 3.7886 3.7886 3.8325 3.8325 3.9601 3.9601 3.9954 3.9954 4.3939 4.3939 4.5006 4.5006 4.5147 4.5147 4.6343 4.6343 4.6503 4.6503 4.6711 4.6711 4.8373 4.8373 5.1832 5.1832 5.4018 5.4018 5.4263 5.4263 5.4487 5.4487 5.4670 5.4670 6.4487 6.4487 6.6255 6.6255 6.9087 6.9087 8.5166 8.5166 9.0855 9.0855 9.2056 9.2056 9.3799 9.3799 9.4877 9.4877 10.6976 10.6976 10.7673 10.7673 k = 0.5000 0.5000 0.3148 ( 7420 PWs) bands (ev): -61.0810 -61.0810 -33.9834 -33.9834 -25.3090 -25.3090 -25.3088 -25.3088 -4.2557 -4.2557 -4.1566 -4.1566 -4.0997 -4.0997 -4.0660 -4.0660 1.9642 1.9642 2.0462 2.0462 2.1117 2.1117 2.2030 2.2030 3.5573 3.5573 3.6274 3.6274 3.6488 3.6488 3.6745 3.6745 3.7823 3.7823 3.8497 3.8497 3.9614 3.9614 3.9951 3.9951 4.3918 4.3918 4.5017 4.5017 4.5242 4.5242 4.6324 4.6324 4.6524 4.6524 4.6711 4.6711 4.8364 4.8364 5.1982 5.1982 5.3983 5.3983 5.4190 5.4190 5.4454 5.4454 5.4685 5.4685 6.5000 6.5000 6.6839 6.6839 6.9275 6.9275 8.5508 8.5508 9.0741 9.0741 9.2093 9.2093 9.3844 9.3844 9.4781 9.4781 10.6469 10.6469 10.7354 10.7354 k = 0.5000 0.5000 0.3333 ( 7404 PWs) bands (ev): -61.0809 -61.0809 -33.9834 -33.9834 -25.3089 -25.3089 -25.3088 -25.3088 -4.2470 -4.2470 -4.1559 -4.1559 -4.0985 -4.0985 -4.0694 -4.0694 1.9474 1.9474 2.0273 2.0273 2.0895 2.0895 2.1675 2.1675 3.5725 3.5725 3.6340 3.6340 3.6615 3.6615 3.6849 3.6849 3.7755 3.7755 3.8645 3.8645 3.9633 3.9633 3.9946 3.9946 4.3897 4.3897 4.5021 4.5021 4.5343 4.5343 4.6305 4.6305 4.6547 4.6547 4.6710 4.6710 4.8356 4.8356 5.2134 5.2134 5.3935 5.3935 5.4115 5.4115 5.4409 5.4409 5.4690 5.4690 6.5506 6.5506 6.7424 6.7424 6.9465 6.9465 8.5891 8.5891 9.0623 9.0623 9.2058 9.2058 9.3844 9.3844 9.4666 9.4666 10.6006 10.6006 10.7068 10.7068 k = 0.5000 0.5000 0.3519 ( 7412 PWs) bands (ev): -61.0810 -61.0810 -33.9834 -33.9834 -25.3089 -25.3089 -25.3088 -25.3088 -4.2383 -4.2383 -4.1555 -4.1555 -4.0973 -4.0973 -4.0729 -4.0729 1.9317 1.9317 2.0103 2.0103 2.0693 2.0693 2.1348 2.1348 3.5869 3.5869 3.6403 3.6403 3.6734 3.6734 3.6942 3.6942 3.7684 3.7684 3.8765 3.8765 3.9660 3.9660 3.9941 3.9941 4.3877 4.3877 4.5023 4.5023 4.5445 4.5445 4.6286 4.6286 4.6570 4.6570 4.6708 4.6708 4.8349 4.8349 5.2284 5.2284 5.3875 5.3875 5.4045 5.4045 5.4357 5.4357 5.4680 5.4680 6.5991 6.5991 6.7999 6.7999 6.9657 6.9657 8.6310 8.6310 9.0508 9.0508 9.1961 9.1961 9.3771 9.3771 9.4541 9.4541 10.5627 10.5627 10.6821 10.6821 k = 0.5000 0.5000 0.3704 ( 7412 PWs) bands (ev): -61.0810 -61.0810 -33.9834 -33.9834 -25.3089 -25.3089 -25.3088 -25.3088 -4.2297 -4.2297 -4.1553 -4.1553 -4.0962 -4.0962 -4.0764 -4.0764 1.9176 1.9176 1.9955 1.9955 2.0511 2.0511 2.1051 2.1051 3.6003 3.6003 3.6465 3.6465 3.6843 3.6843 3.7025 3.7025 3.7614 3.7614 3.8858 3.8858 3.9694 3.9694 3.9935 3.9935 4.3858 4.3858 4.5024 4.5024 4.5546 4.5546 4.6268 4.6268 4.6593 4.6593 4.6706 4.6706 4.8343 4.8343 5.2430 5.2430 5.3803 5.3803 5.3987 5.3987 5.4306 5.4306 5.4655 5.4655 6.6443 6.6443 6.8551 6.8551 6.9850 6.9850 8.6761 8.6761 9.0399 9.0399 9.1817 9.1817 9.3621 9.3621 9.4397 9.4397 10.5361 10.5361 10.6616 10.6616 k = 0.5000 0.5000 0.3889 ( 7428 PWs) bands (ev): -61.0810 -61.0810 -33.9835 -33.9835 -25.3090 -25.3090 -25.3089 -25.3089 -4.2213 -4.2213 -4.1555 -4.1555 -4.0952 -4.0952 -4.0799 -4.0799 1.9050 1.9050 1.9829 1.9829 2.0352 2.0352 2.0785 2.0785 3.6127 3.6127 3.6522 3.6522 3.6942 3.6942 3.7095 3.7095 3.7545 3.7545 3.8926 3.8926 3.9733 3.9733 3.9928 3.9928 4.3842 4.3842 4.5024 4.5024 4.5642 4.5642 4.6249 4.6249 4.6614 4.6614 4.6703 4.6703 4.8338 4.8338 5.2570 5.2570 5.3720 5.3720 5.3948 5.3948 5.4256 5.4256 5.4616 5.4616 6.6851 6.6851 6.9068 6.9068 7.0041 7.0041 8.7240 8.7240 9.0298 9.0298 9.1641 9.1641 9.3414 9.3414 9.4214 9.4214 10.5224 10.5224 10.6454 10.6454 k = 0.5000 0.5000 0.4074 ( 7420 PWs) bands (ev): -61.0810 -61.0810 -33.9834 -33.9834 -25.3090 -25.3090 -25.3089 -25.3089 -4.2133 -4.2133 -4.1561 -4.1561 -4.0944 -4.0944 -4.0832 -4.0832 1.8941 1.8941 1.9727 1.9727 2.0216 2.0216 2.0552 2.0552 3.6240 3.6240 3.6574 3.6574 3.7030 3.7030 3.7154 3.7154 3.7479 3.7479 3.8974 3.8974 3.9774 3.9774 3.9922 3.9922 4.3828 4.3828 4.5025 4.5025 4.5734 4.5734 4.6231 4.6231 4.6633 4.6633 4.6699 4.6699 4.8334 4.8334 5.2701 5.2701 5.3631 5.3631 5.3928 5.3928 5.4212 5.4212 5.4565 5.4565 6.7204 6.7204 6.9537 6.9537 7.0226 7.0226 8.7738 8.7738 9.0209 9.0209 9.1448 9.1448 9.3184 9.3184 9.3976 9.3976 10.5217 10.5217 10.6329 10.6329 k = 0.5000 0.5000 0.4259 ( 7436 PWs) bands (ev): -61.0810 -61.0810 -33.9835 -33.9835 -25.3090 -25.3090 -25.3089 -25.3089 -4.2059 -4.2059 -4.1572 -4.1572 -4.0937 -4.0937 -4.0862 -4.0862 1.8850 1.8850 1.9649 1.9649 2.0104 2.0104 2.0352 2.0352 3.6342 3.6342 3.6615 3.6615 3.7104 3.7104 3.7201 3.7201 3.7417 3.7417 3.9006 3.9006 3.9814 3.9814 3.9916 3.9916 4.3817 4.3817 4.5025 4.5025 4.5818 4.5818 4.6209 4.6209 4.6649 4.6649 4.6695 4.6695 4.8330 4.8330 5.2820 5.2820 5.3540 5.3540 5.3929 5.3929 5.4173 5.4173 5.4503 5.4503 6.7495 6.7495 6.9943 6.9943 7.0398 7.0398 8.8244 8.8244 9.0133 9.0133 9.1249 9.1249 9.2959 9.2959 9.3687 9.3687 10.5332 10.5332 10.6240 10.6240 k = 0.5000 0.5000 0.4444 ( 7448 PWs) bands (ev): -61.0810 -61.0810 -33.9835 -33.9835 -25.3090 -25.3090 -25.3090 -25.3090 -4.1992 -4.1992 -4.1587 -4.1587 -4.0931 -4.0931 -4.0888 -4.0888 1.8778 1.8778 1.9595 1.9595 2.0018 2.0018 2.0188 2.0188 3.6433 3.6433 3.6645 3.6645 3.7165 3.7165 3.7236 3.7236 3.7363 3.7363 3.9025 3.9025 3.9848 3.9848 3.9912 3.9912 4.3808 4.3808 4.5025 4.5025 4.5895 4.5895 4.6184 4.6184 4.6662 4.6662 4.6690 4.6690 4.8327 4.8327 5.2927 5.2927 5.3450 5.3450 5.3949 5.3949 5.4142 5.4142 5.4435 5.4435 6.7722 6.7722 7.0276 7.0276 7.0548 7.0548 8.8746 8.8746 9.0070 9.0070 9.1049 9.1049 9.2765 9.2765 9.3367 9.3367 10.5546 10.5546 10.6182 10.6182 k = 0.5000 0.5000 0.4630 ( 7440 PWs) bands (ev): -61.0810 -61.0810 -33.9835 -33.9835 -25.3090 -25.3090 -25.3090 -25.3090 -4.1936 -4.1936 -4.1603 -4.1603 -4.0927 -4.0927 -4.0907 -4.0907 1.8727 1.8727 1.9562 1.9562 1.9958 1.9958 2.0062 2.0062 3.6512 3.6512 3.6658 3.6658 3.7211 3.7211 3.7259 3.7259 3.7320 3.7320 3.9037 3.9037 3.9875 3.9875 3.9908 3.9908 4.3802 4.3802 4.5025 4.5025 4.5964 4.5964 4.6155 4.6155 4.6672 4.6672 4.6686 4.6686 4.8325 4.8325 5.3024 5.3024 5.3363 5.3363 5.3985 5.3985 5.4117 5.4117 5.4366 5.4366 6.7883 6.7883 7.0524 7.0524 7.0664 7.0664 8.9218 8.9218 9.0020 9.0020 9.0848 9.0848 9.2628 9.2628 9.3052 9.3052 10.5815 10.5815 10.6167 10.6167 k = 0.5000 0.5000 0.4815 ( 7400 PWs) bands (ev): -61.0809 -61.0809 -33.9834 -33.9834 -25.3089 -25.3089 -25.3089 -25.3089 -4.1897 -4.1897 -4.1618 -4.1618 -4.0924 -4.0924 -4.0919 -4.0919 1.8696 1.8696 1.9545 1.9545 1.9929 1.9929 1.9977 1.9977 3.6576 3.6576 3.6651 3.6651 3.7243 3.7243 3.7272 3.7272 3.7292 3.7292 3.9044 3.9044 3.9892 3.9892 3.9905 3.9905 4.3800 4.3800 4.5026 4.5026 4.6025 4.6025 4.6120 4.6120 4.6679 4.6679 4.6685 4.6685 4.8325 4.8325 5.3113 5.3113 5.3279 5.3279 5.4030 5.4030 5.4097 5.4097 5.4309 5.4309 6.7979 6.7979 7.0681 7.0681 7.0735 7.0735 8.9623 8.9623 8.9975 8.9975 9.0655 9.0655 9.2573 9.2573 9.2790 9.2790 10.5996 10.5996 10.6271 10.6271 k = 0.5000 0.5000 0.5000 ( 7400 PWs) bands (ev): -61.0809 -61.0809 -33.9834 -33.9834 -25.3089 -25.3089 -25.3089 -25.3089 -4.1883 -4.1883 -4.1625 -4.1625 -4.0924 -4.0924 -4.0924 -4.0924 1.8685 1.8685 1.9540 1.9540 1.9933 1.9933 1.9933 1.9933 3.6623 3.6623 3.6623 3.6623 3.7256 3.7256 3.7277 3.7277 3.7277 3.7277 3.9046 3.9046 3.9901 3.9901 3.9901 3.9901 4.3799 4.3799 4.5026 4.5026 4.6077 4.6077 4.6077 4.6077 4.6682 4.6682 4.6682 4.6682 4.8325 4.8325 5.3196 5.3196 5.3196 5.3196 5.4070 5.4070 5.4070 5.4070 5.4285 5.4285 6.8010 6.8010 7.0746 7.0746 7.0746 7.0746 8.9883 8.9883 8.9883 8.9883 9.0551 9.0551 9.2624 9.2624 9.2624 9.2624 10.6024 10.6024 10.6418 10.6418 Writing output data file TaCu3Te4.save init_run : 4.22s CPU 13.93s WALL ( 1 calls) electrons : 1077.12s CPU 1088.40s WALL ( 1 calls) Called by init_run: wfcinit : 0.00s CPU 0.00s WALL ( 1 calls) potinit : 0.27s CPU 1.40s WALL ( 1 calls) Called by electrons: c_bands : 1077.10s CPU 1088.09s WALL ( 1 calls) v_of_rho : 0.05s CPU 0.97s WALL ( 1 calls) v_h : 0.00s CPU 0.00s WALL ( 1 calls) v_xc : 0.04s CPU 0.58s WALL ( 1 calls) newd : 0.64s CPU 0.76s WALL ( 1 calls) Called by c_bands: init_us_2 : 0.05s CPU 0.16s WALL ( 209 calls) cegterg : 1010.42s CPU 1018.92s WALL ( 407 calls) Called by sum_band: Called by *egterg: h_psi : 445.86s CPU 451.95s WALL ( 5874 calls) s_psi : 42.77s CPU 42.91s WALL ( 5874 calls) g_psi : 1.02s CPU 1.08s WALL ( 5258 calls) cdiaghg : 389.15s CPU 388.69s WALL ( 5467 calls) cegterg:over : 87.99s CPU 87.49s WALL ( 5258 calls) cegterg:upda : 31.00s CPU 32.10s WALL ( 5258 calls) cegterg:last : 24.00s CPU 24.28s WALL ( 1035 calls) Called by h_psi: h_psi:vloc : 352.40s CPU 356.68s WALL ( 5874 calls) h_psi:vnl : 92.82s CPU 94.24s WALL ( 5874 calls) add_vuspsi : 36.98s CPU 38.67s WALL ( 5874 calls) General routines calbec : 55.80s CPU 55.47s WALL ( 5874 calls) fft : 0.30s CPU 1.03s WALL ( 19 calls) ffts : 0.01s CPU 0.01s WALL ( 4 calls) fftw : 335.95s CPU 338.72s WALL ( 1083780 calls) interpolate : 0.02s CPU 0.04s WALL ( 4 calls) davcio : 0.02s CPU 2.58s WALL ( 418 calls) Parallel routines fft_scatter : 192.87s CPU 190.37s WALL ( 1083803 calls) PWSCF : 19m 8.15s CPU 21m19.80s WALL This run was terminated on: 6:57:38 2Nov2015 =------------------------------------------------------------------------------= JOB DONE. 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