Program PWSCF v.5.4.0 starts on 21Mar2017 at 14:44:39 This program is part of the open-source Quantum ESPRESSO suite for quantum simulation of materials; please cite "P. Giannozzi et al., J. Phys.:Condens. Matter 21 395502 (2009); URL http://www.quantum-espresso.org", in publications or presentations arising from this work. More details at http://www.quantum-espresso.org/quote Parallel version (MPI & OpenMP), running on 144 processor cores Number of MPI processes: 72 Threads/MPI process: 2 R & G space division: proc/nbgrp/npool/nimage = 72 Waiting for input... Reading input from standard input Current dimensions of program PWSCF are: Max number of different atomic species (ntypx) = 10 Max number of k-points (npk) = 40000 Max angular momentum in pseudopotentials (lmaxx) = 3 Atomic positions and unit cell read from directory: ./CaSiPt.save/ file Ca.rel-pbe-spn-rrkjus_psl.1.0.0.UPF: wavefunction(s) 3S renormalized file Pt.rel-pbe-n-rrkjus_psl.1.0.0.UPF: wavefunction(s) 6S 5D renormalized Subspace diagonalization in iterative solution of the eigenvalue problem: one sub-group per band group will be used scalapack distributed-memory algorithm (size of sub-group: 6* 6 procs) Parallelization info -------------------- sticks: dense smooth PW G-vecs: dense smooth PW Min 68 28 8 3596 987 150 Max 69 29 9 3601 1005 155 Sum 4905 2085 593 258999 71711 11019 bravais-lattice index = 14 lattice parameter (alat) = 11.9431 a.u. unit-cell volume = 1703.5220 (a.u.)^3 number of atoms/cell = 12 number of atomic types = 3 number of electrons = 96.00 number of Kohn-Sham states= 116 kinetic-energy cutoff = 46.0000 Ry charge density cutoff = 433.0000 Ry Exchange-correlation = PBE ( 1 4 3 4 0 0) Non magnetic calculation with spin-orbit celldm(1)= 11.943068 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 Ca read from file: /users/gautes/Pseudo/Ca.rel-pbe-spn-rrkjus_psl.1.0.0.UPF MD5 check sum: 60bd286d514994a6a955285ae841e6ef Pseudo is Ultrasoft + core correction, Zval = 10.0 Generated using "atomic" code by A. Dal Corso v.5.0.2 svn rev. 9656 Using radial grid of 1169 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 Pt read from file: /users/gautes/Pseudo/Pt.rel-pbe-n-rrkjus_psl.1.0.0.UPF MD5 check sum: 5a767c0d250ba2b616d7addddc548ecc Pseudo is Ultrasoft + core correction, Zval = 10.0 Generated using "atomic" code by A. Dal Corso v.5.0.2 svn rev. 9656 Using radial grid of 1277 points, 10 beta functions with: l(1) = 0 l(2) = 0 l(3) = 1 l(4) = 1 l(5) = 1 l(6) = 1 l(7) = 2 l(8) = 2 l(9) = 2 l(10) = 2 Q(r) pseudized with 0 coefficients PseudoPot. # 3 for Si read from file: /users/gautes/Pseudo/Si.rel-pbe-n-rrkjus_psl.1.0.0.UPF MD5 check sum: b835890840a210e39275f4497a2439d5 Pseudo is Ultrasoft + core correction, Zval = 4.0 Generated using "atomic" code by A. Dal Corso v.5.0.2 svn rev. 9656 Using radial grid of 1141 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 Ca 10.00 40.07800 Ca( 1.00) Pt 10.00 195.08400 Pt( 1.00) Si 4.00 28.08550 Si( 1.00) 12 Sym. Ops. (no inversion) found ( 9 have fractional translation) 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 ) f =( 0.5000000 ) ( 0 -1 0 ) ( 0.0000000 ) ( 0 0 1 ) ( 0.5000000 ) cart. s( 2) = ( -1.0000000 0.0000000 0.0000000 ) f =( 0.5000000 ) ( 0.0000000 -1.0000000 0.0000000 ) ( 0.0000000 ) ( 0.0000000 0.0000000 1.0000000 ) ( 0.5000000 ) isym = 3 180 deg rotation - cart. axis [0,1,0] cryst. s( 3) = ( -1 0 0 ) f =( 0.0000000 ) ( 0 1 0 ) ( -0.5000000 ) ( 0 0 -1 ) ( 0.5000000 ) cart. s( 3) = ( -1.0000000 0.0000000 -0.0000000 ) f =( 0.0000000 ) ( 0.0000000 1.0000000 -0.0000000 ) ( -0.5000000 ) ( 0.0000000 0.0000000 -1.0000000 ) ( 0.5000000 ) isym = 4 180 deg rotation - cart. axis [1,0,0] cryst. s( 4) = ( 1 0 0 ) f =( 0.5000000 ) ( 0 -1 0 ) ( -0.5000000 ) ( 0 0 -1 ) ( 0.0000000 ) cart. s( 4) = ( 1.0000000 -0.0000000 -0.0000000 ) f =( 0.5000000 ) ( 0.0000000 -1.0000000 0.0000000 ) ( -0.5000000 ) ( 0.0000000 0.0000000 -1.0000000 ) ( 0.0000000 ) 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 ) f =( 0.0000000 ) ( -1 0 0 ) ( -0.5000000 ) ( 0 1 0 ) ( -0.5000000 ) cart. s( 6) = ( -0.0000000 -1.0000000 0.0000000 ) f =( -0.0000000 ) ( -0.0000000 0.0000000 1.0000000 ) ( -0.5000000 ) ( -1.0000000 0.0000000 0.0000000 ) ( -0.5000000 ) isym = 7 120 deg rotation - cart. axis [1,1,-1] cryst. s( 7) = ( 0 0 -1 ) f =( 0.5000000 ) ( 1 0 0 ) ( -0.5000000 ) ( 0 -1 0 ) ( 0.0000000 ) cart. s( 7) = ( -0.0000000 1.0000000 -0.0000000 ) f =( 0.5000000 ) ( -0.0000000 0.0000000 -1.0000000 ) ( -0.5000000 ) ( -1.0000000 0.0000000 0.0000000 ) ( 0.0000000 ) isym = 8 120 deg rotation - cart. axis [1,-1,1] cryst. s( 8) = ( 0 0 1 ) f =( 0.5000000 ) ( -1 0 0 ) ( 0.0000000 ) ( 0 -1 0 ) ( 0.5000000 ) cart. s( 8) = ( 0.0000000 -1.0000000 -0.0000000 ) f =( 0.5000000 ) ( 0.0000000 -0.0000000 -1.0000000 ) ( 0.0000000 ) ( 1.0000000 -0.0000000 -0.0000000 ) ( 0.5000000 ) 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 ) f =( 0.5000000 ) ( 0 0 -1 ) ( -0.5000000 ) ( 1 0 0 ) ( 0.0000000 ) cart. s(10) = ( -0.0000000 -0.0000000 1.0000000 ) f =( 0.5000000 ) ( -1.0000000 0.0000000 0.0000000 ) ( -0.5000000 ) ( 0.0000000 -1.0000000 0.0000000 ) ( 0.0000000 ) isym = 11 120 deg rotation - cart. axis [1,-1,-1] cryst. s(11) = ( 0 -1 0 ) f =( 0.5000000 ) ( 0 0 1 ) ( 0.0000000 ) ( -1 0 0 ) ( 0.5000000 ) cart. s(11) = ( -0.0000000 0.0000000 -1.0000000 ) f =( 0.5000000 ) ( -1.0000000 0.0000000 0.0000000 ) ( 0.0000000 ) ( 0.0000000 1.0000000 -0.0000000 ) ( 0.5000000 ) isym = 12 120 deg rotation - cart. axis [-1,-1,1] cryst. s(12) = ( 0 1 0 ) f =( 0.0000000 ) ( 0 0 -1 ) ( -0.5000000 ) ( -1 0 0 ) ( -0.5000000 ) cart. s(12) = ( 0.0000000 -0.0000000 -1.0000000 ) f =( -0.0000000 ) ( 1.0000000 -0.0000000 -0.0000000 ) ( -0.5000000 ) ( 0.0000000 -1.0000000 0.0000000 ) ( -0.5000000 ) double point group T (23) there are 7 classes and 3 irreducible representations the character table: E -E 3C2 4C3 -4C3 4C3' -4C3' -3C2 G_5 2.00 -2.00 0.00 1.00 -1.00 1.00 -1.00 G_6 2.00 -2.00 0.00 -0.50 0.50 -0.50 0.50 G_7 2.00 -2.00 0.00 -0.50 0.50 -0.50 0.50 imaginary part E -E 3C2 4C3 -4C3 4C3' -4C3' -3C2 G_5 0.00 0.00 0.00 0.00 0.00 0.00 0.00 G_6 0.00 0.00 0.00 0.87 -0.87 -0.87 0.87 G_7 0.00 0.00 0.00 -0.87 0.87 0.87 -0.87 the symmetry operations in each class and the name of the first element: E 1 identity -E -1 identity E 3C2 -3C2 2 -2 3 -3 4 -4 180 deg rotation - cart. axis [0,0,1] 4C3 9 12 10 11 120 deg rotation - cart. axis [1,1,1] -4C3 -9 -12 -10 -11 120 deg rotation - cart. axis [1,1,1] E 4C3' 5 7 8 6 120 deg rotation - cart. axis [-1,-1,-1] -4C3' -5 -7 -8 -6 120 deg rotation - cart. axis [-1,-1,-1] E Cartesian axes number of k points= 197 Fermi-Dirac smearing, width (Ry)= 0.0010 cart. coord. in units 2pi/alat k( 1) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0050761 k( 2) = ( 0.0000000 0.0200000 -0.0000000), wk = 0.0050761 k( 3) = ( 0.0000000 0.0400000 -0.0000000), wk = 0.0050761 k( 4) = ( 0.0000000 0.0600000 -0.0000000), wk = 0.0050761 k( 5) = ( 0.0000000 0.0800000 -0.0000000), wk = 0.0050761 k( 6) = ( 0.0000000 0.1000000 -0.0000000), wk = 0.0050761 k( 7) = ( 0.0000000 0.1200000 -0.0000000), wk = 0.0050761 k( 8) = ( 0.0000000 0.1400000 -0.0000000), wk = 0.0050761 k( 9) = ( 0.0000000 0.1600000 -0.0000000), wk = 0.0050761 k( 10) = ( 0.0000000 0.1800000 -0.0000000), wk = 0.0050761 k( 11) = ( 0.0000000 0.2000000 -0.0000000), wk = 0.0050761 k( 12) = ( 0.0000000 0.2200000 -0.0000000), wk = 0.0050761 k( 13) = ( 0.0000000 0.2400000 -0.0000000), wk = 0.0050761 k( 14) = ( 0.0000000 0.2600000 -0.0000000), wk = 0.0050761 k( 15) = ( 0.0000000 0.2800000 -0.0000000), wk = 0.0050761 k( 16) = ( 0.0000000 0.3000000 -0.0000000), wk = 0.0050761 k( 17) = ( 0.0000000 0.3200000 -0.0000000), wk = 0.0050761 k( 18) = ( 0.0000000 0.3400000 -0.0000000), wk = 0.0050761 k( 19) = ( 0.0000000 0.3600000 -0.0000000), wk = 0.0050761 k( 20) = ( 0.0000000 0.3800000 -0.0000000), wk = 0.0050761 k( 21) = ( 0.0000000 0.4000000 -0.0000000), wk = 0.0050761 k( 22) = ( 0.0000000 0.4200000 -0.0000000), wk = 0.0050761 k( 23) = ( 0.0000000 0.4400000 -0.0000000), wk = 0.0050761 k( 24) = ( 0.0000000 0.4600000 -0.0000000), wk = 0.0050761 k( 25) = ( 0.0000000 0.4800000 -0.0000000), wk = 0.0050761 k( 26) = ( 0.0000000 0.5000000 -0.0000000), wk = 0.0050761 k( 27) = ( 0.0000000 0.5000000 -0.0000000), wk = 0.0050761 k( 28) = ( 0.0200000 0.5000000 -0.0000000), wk = 0.0050761 k( 29) = ( 0.0400000 0.5000000 -0.0000000), wk = 0.0050761 k( 30) = ( 0.0600000 0.5000000 -0.0000000), wk = 0.0050761 k( 31) = ( 0.0800000 0.5000000 -0.0000000), wk = 0.0050761 k( 32) = ( 0.1000000 0.5000000 -0.0000000), wk = 0.0050761 k( 33) = ( 0.1200000 0.5000000 -0.0000000), wk = 0.0050761 k( 34) = ( 0.1400000 0.5000000 -0.0000000), wk = 0.0050761 k( 35) = ( 0.1600000 0.5000000 -0.0000000), wk = 0.0050761 k( 36) = ( 0.1800000 0.5000000 -0.0000000), wk = 0.0050761 k( 37) = ( 0.2000000 0.5000000 -0.0000000), wk = 0.0050761 k( 38) = ( 0.2200000 0.5000000 -0.0000000), wk = 0.0050761 k( 39) = ( 0.2400000 0.5000000 -0.0000000), wk = 0.0050761 k( 40) = ( 0.2600000 0.5000000 -0.0000000), wk = 0.0050761 k( 41) = ( 0.2800000 0.5000000 -0.0000000), wk = 0.0050761 k( 42) = ( 0.3000000 0.5000000 -0.0000000), wk = 0.0050761 k( 43) = ( 0.3200000 0.5000000 -0.0000000), wk = 0.0050761 k( 44) = ( 0.3400000 0.5000000 -0.0000000), wk = 0.0050761 k( 45) = ( 0.3600000 0.5000000 -0.0000000), wk = 0.0050761 k( 46) = ( 0.3800000 0.5000000 -0.0000000), wk = 0.0050761 k( 47) = ( 0.4000000 0.5000000 -0.0000000), wk = 0.0050761 k( 48) = ( 0.4200000 0.5000000 -0.0000000), wk = 0.0050761 k( 49) = ( 0.4400000 0.5000000 -0.0000000), wk = 0.0050761 k( 50) = ( 0.4600000 0.5000000 -0.0000000), wk = 0.0050761 k( 51) = ( 0.4800000 0.5000000 -0.0000000), wk = 0.0050761 k( 52) = ( 0.5000000 0.5000000 -0.0000000), wk = 0.0050761 k( 53) = ( 0.5000000 0.5000000 -0.0000000), wk = 0.0050761 k( 54) = ( 0.4861111 0.4861111 -0.0000000), wk = 0.0050761 k( 55) = ( 0.4722222 0.4722222 -0.0000000), wk = 0.0050761 k( 56) = ( 0.4583333 0.4583333 -0.0000000), wk = 0.0050761 k( 57) = ( 0.4444444 0.4444444 -0.0000000), wk = 0.0050761 k( 58) = ( 0.4305556 0.4305556 -0.0000000), wk = 0.0050761 k( 59) = ( 0.4166667 0.4166667 -0.0000000), wk = 0.0050761 k( 60) = ( 0.4027778 0.4027778 -0.0000000), wk = 0.0050761 k( 61) = ( 0.3888889 0.3888889 -0.0000000), wk = 0.0050761 k( 62) = ( 0.3750000 0.3750000 -0.0000000), wk = 0.0050761 k( 63) = ( 0.3611111 0.3611111 -0.0000000), wk = 0.0050761 k( 64) = ( 0.3472222 0.3472222 -0.0000000), wk = 0.0050761 k( 65) = ( 0.3333333 0.3333333 -0.0000000), wk = 0.0050761 k( 66) = ( 0.3194444 0.3194444 -0.0000000), wk = 0.0050761 k( 67) = ( 0.3055556 0.3055556 -0.0000000), wk = 0.0050761 k( 68) = ( 0.2916667 0.2916667 -0.0000000), wk = 0.0050761 k( 69) = ( 0.2777778 0.2777778 -0.0000000), wk = 0.0050761 k( 70) = ( 0.2638889 0.2638889 -0.0000000), wk = 0.0050761 k( 71) = ( 0.2500000 0.2500000 -0.0000000), wk = 0.0050761 k( 72) = ( 0.2361111 0.2361111 -0.0000000), wk = 0.0050761 k( 73) = ( 0.2222222 0.2222222 -0.0000000), wk = 0.0050761 k( 74) = ( 0.2083333 0.2083333 -0.0000000), wk = 0.0050761 k( 75) = ( 0.1944444 0.1944444 -0.0000000), wk = 0.0050761 k( 76) = ( 0.1805556 0.1805556 -0.0000000), wk = 0.0050761 k( 77) = ( 0.1666667 0.1666667 -0.0000000), wk = 0.0050761 k( 78) = ( 0.1527778 0.1527778 -0.0000000), wk = 0.0050761 k( 79) = ( 0.1388889 0.1388889 -0.0000000), wk = 0.0050761 k( 80) = ( 0.1250000 0.1250000 -0.0000000), wk = 0.0050761 k( 81) = ( 0.1111111 0.1111111 -0.0000000), wk = 0.0050761 k( 82) = ( 0.0972222 0.0972222 -0.0000000), wk = 0.0050761 k( 83) = ( 0.0833333 0.0833333 -0.0000000), wk = 0.0050761 k( 84) = ( 0.0694444 0.0694444 -0.0000000), wk = 0.0050761 k( 85) = ( 0.0555556 0.0555556 -0.0000000), wk = 0.0050761 k( 86) = ( 0.0416667 0.0416667 -0.0000000), wk = 0.0050761 k( 87) = ( 0.0277778 0.0277778 -0.0000000), wk = 0.0050761 k( 88) = ( 0.0138889 0.0138889 -0.0000000), wk = 0.0050761 k( 89) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0050761 k( 90) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0050761 k( 91) = ( 0.0113636 0.0113636 0.0113636), wk = 0.0050761 k( 92) = ( 0.0227273 0.0227273 0.0227273), wk = 0.0050761 k( 93) = ( 0.0340909 0.0340909 0.0340909), wk = 0.0050761 k( 94) = ( 0.0454546 0.0454545 0.0454545), wk = 0.0050761 k( 95) = ( 0.0568182 0.0568182 0.0568182), wk = 0.0050761 k( 96) = ( 0.0681818 0.0681818 0.0681818), wk = 0.0050761 k( 97) = ( 0.0795455 0.0795454 0.0795454), wk = 0.0050761 k( 98) = ( 0.0909091 0.0909091 0.0909091), wk = 0.0050761 k( 99) = ( 0.1022727 0.1022727 0.1022727), wk = 0.0050761 k( 100) = ( 0.1136364 0.1136364 0.1136364), wk = 0.0050761 k( 101) = ( 0.1250000 0.1250000 0.1250000), wk = 0.0050761 k( 102) = ( 0.1363636 0.1363636 0.1363636), wk = 0.0050761 k( 103) = ( 0.1477273 0.1477273 0.1477273), wk = 0.0050761 k( 104) = ( 0.1590909 0.1590909 0.1590909), wk = 0.0050761 k( 105) = ( 0.1704546 0.1704545 0.1704545), wk = 0.0050761 k( 106) = ( 0.1818182 0.1818182 0.1818182), wk = 0.0050761 k( 107) = ( 0.1931818 0.1931818 0.1931818), wk = 0.0050761 k( 108) = ( 0.2045454 0.2045454 0.2045454), wk = 0.0050761 k( 109) = ( 0.2159091 0.2159091 0.2159091), wk = 0.0050761 k( 110) = ( 0.2272727 0.2272727 0.2272727), wk = 0.0050761 k( 111) = ( 0.2386364 0.2386364 0.2386364), wk = 0.0050761 k( 112) = ( 0.2500000 0.2500000 0.2500000), wk = 0.0050761 k( 113) = ( 0.2613636 0.2613636 0.2613636), wk = 0.0050761 k( 114) = ( 0.2727273 0.2727273 0.2727273), wk = 0.0050761 k( 115) = ( 0.2840909 0.2840909 0.2840909), wk = 0.0050761 k( 116) = ( 0.2954545 0.2954545 0.2954545), wk = 0.0050761 k( 117) = ( 0.3068182 0.3068182 0.3068182), wk = 0.0050761 k( 118) = ( 0.3181818 0.3181818 0.3181818), wk = 0.0050761 k( 119) = ( 0.3295455 0.3295454 0.3295454), wk = 0.0050761 k( 120) = ( 0.3409091 0.3409091 0.3409091), wk = 0.0050761 k( 121) = ( 0.3522727 0.3522727 0.3522727), wk = 0.0050761 k( 122) = ( 0.3636364 0.3636364 0.3636364), wk = 0.0050761 k( 123) = ( 0.3750000 0.3750000 0.3750000), wk = 0.0050761 k( 124) = ( 0.3863636 0.3863636 0.3863636), wk = 0.0050761 k( 125) = ( 0.3977273 0.3977273 0.3977273), wk = 0.0050761 k( 126) = ( 0.4090909 0.4090909 0.4090909), wk = 0.0050761 k( 127) = ( 0.4204545 0.4204545 0.4204545), wk = 0.0050761 k( 128) = ( 0.4318182 0.4318182 0.4318182), wk = 0.0050761 k( 129) = ( 0.4431818 0.4431818 0.4431818), wk = 0.0050761 k( 130) = ( 0.4545455 0.4545454 0.4545454), wk = 0.0050761 k( 131) = ( 0.4659091 0.4659091 0.4659091), wk = 0.0050761 k( 132) = ( 0.4772727 0.4772727 0.4772727), wk = 0.0050761 k( 133) = ( 0.4886364 0.4886364 0.4886364), wk = 0.0050761 k( 134) = ( 0.5000000 0.5000000 0.5000000), wk = 0.0050761 k( 135) = ( 0.5000000 0.5000000 0.5000000), wk = 0.0050761 k( 136) = ( 0.4861111 0.5000000 0.4861111), wk = 0.0050761 k( 137) = ( 0.4722222 0.5000000 0.4722222), wk = 0.0050761 k( 138) = ( 0.4583333 0.5000000 0.4583333), wk = 0.0050761 k( 139) = ( 0.4444444 0.5000000 0.4444444), wk = 0.0050761 k( 140) = ( 0.4305556 0.5000000 0.4305556), wk = 0.0050761 k( 141) = ( 0.4166667 0.5000000 0.4166667), wk = 0.0050761 k( 142) = ( 0.4027778 0.5000000 0.4027778), wk = 0.0050761 k( 143) = ( 0.3888889 0.5000000 0.3888889), wk = 0.0050761 k( 144) = ( 0.3750000 0.5000000 0.3750000), wk = 0.0050761 k( 145) = ( 0.3611111 0.5000000 0.3611111), wk = 0.0050761 k( 146) = ( 0.3472222 0.5000000 0.3472222), wk = 0.0050761 k( 147) = ( 0.3333333 0.5000000 0.3333333), wk = 0.0050761 k( 148) = ( 0.3194444 0.5000000 0.3194444), wk = 0.0050761 k( 149) = ( 0.3055556 0.5000000 0.3055556), wk = 0.0050761 k( 150) = ( 0.2916667 0.5000000 0.2916667), wk = 0.0050761 k( 151) = ( 0.2777778 0.5000000 0.2777778), wk = 0.0050761 k( 152) = ( 0.2638889 0.5000000 0.2638889), wk = 0.0050761 k( 153) = ( 0.2500000 0.5000000 0.2500000), wk = 0.0050761 k( 154) = ( 0.2361111 0.5000000 0.2361111), wk = 0.0050761 k( 155) = ( 0.2222222 0.5000000 0.2222222), wk = 0.0050761 k( 156) = ( 0.2083333 0.5000000 0.2083333), wk = 0.0050761 k( 157) = ( 0.1944444 0.5000000 0.1944444), wk = 0.0050761 k( 158) = ( 0.1805556 0.5000000 0.1805556), wk = 0.0050761 k( 159) = ( 0.1666667 0.5000000 0.1666667), wk = 0.0050761 k( 160) = ( 0.1527778 0.5000000 0.1527778), wk = 0.0050761 k( 161) = ( 0.1388889 0.5000000 0.1388889), wk = 0.0050761 k( 162) = ( 0.1250000 0.5000000 0.1250000), wk = 0.0050761 k( 163) = ( 0.1111111 0.5000000 0.1111111), wk = 0.0050761 k( 164) = ( 0.0972222 0.5000000 0.0972222), wk = 0.0050761 k( 165) = ( 0.0833333 0.5000000 0.0833333), wk = 0.0050761 k( 166) = ( 0.0694444 0.5000000 0.0694444), wk = 0.0050761 k( 167) = ( 0.0555556 0.5000000 0.0555556), wk = 0.0050761 k( 168) = ( 0.0416667 0.5000000 0.0416667), wk = 0.0050761 k( 169) = ( 0.0277778 0.5000000 0.0277778), wk = 0.0050761 k( 170) = ( 0.0138889 0.5000000 0.0138889), wk = 0.0050761 k( 171) = ( 0.0000000 0.5000000 -0.0000000), wk = 0.0050761 k( 172) = ( 0.5000000 0.5000000 -0.0000000), wk = 0.0050761 k( 173) = ( 0.5000000 0.5000000 0.0200000), wk = 0.0050761 k( 174) = ( 0.5000000 0.5000000 0.0400000), wk = 0.0050761 k( 175) = ( 0.5000000 0.5000000 0.0600000), wk = 0.0050761 k( 176) = ( 0.5000000 0.5000000 0.0800000), wk = 0.0050761 k( 177) = ( 0.5000000 0.5000000 0.1000000), wk = 0.0050761 k( 178) = ( 0.5000000 0.5000000 0.1200000), wk = 0.0050761 k( 179) = ( 0.5000000 0.5000000 0.1400000), wk = 0.0050761 k( 180) = ( 0.5000000 0.5000000 0.1600000), wk = 0.0050761 k( 181) = ( 0.5000000 0.5000000 0.1800000), wk = 0.0050761 k( 182) = ( 0.5000000 0.5000000 0.2000000), wk = 0.0050761 k( 183) = ( 0.5000000 0.5000000 0.2200000), wk = 0.0050761 k( 184) = ( 0.5000000 0.5000000 0.2400000), wk = 0.0050761 k( 185) = ( 0.5000000 0.5000000 0.2600000), wk = 0.0050761 k( 186) = ( 0.5000000 0.5000000 0.2800000), wk = 0.0050761 k( 187) = ( 0.5000000 0.5000000 0.3000000), wk = 0.0050761 k( 188) = ( 0.5000000 0.5000000 0.3200000), wk = 0.0050761 k( 189) = ( 0.5000000 0.5000000 0.3400000), wk = 0.0050761 k( 190) = ( 0.5000000 0.5000000 0.3600000), wk = 0.0050761 k( 191) = ( 0.5000000 0.5000000 0.3800000), wk = 0.0050761 k( 192) = ( 0.5000000 0.5000000 0.4000000), wk = 0.0050761 k( 193) = ( 0.5000000 0.5000000 0.4200000), wk = 0.0050761 k( 194) = ( 0.5000000 0.5000000 0.4400000), wk = 0.0050761 k( 195) = ( 0.5000000 0.5000000 0.4600000), wk = 0.0050761 k( 196) = ( 0.5000000 0.5000000 0.4800000), wk = 0.0050761 k( 197) = ( 0.5000000 0.5000000 0.5000000), wk = 0.0050761 cryst. coord. k( 1) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0050761 k( 2) = ( 0.0000000 0.0200000 0.0000000), wk = 0.0050761 k( 3) = ( 0.0000000 0.0400000 0.0000000), wk = 0.0050761 k( 4) = ( 0.0000000 0.0600000 0.0000000), wk = 0.0050761 k( 5) = ( 0.0000000 0.0800000 0.0000000), wk = 0.0050761 k( 6) = ( 0.0000000 0.1000000 0.0000000), wk = 0.0050761 k( 7) = ( 0.0000000 0.1200000 0.0000000), wk = 0.0050761 k( 8) = ( 0.0000000 0.1400000 0.0000000), wk = 0.0050761 k( 9) = ( 0.0000000 0.1600000 0.0000000), wk = 0.0050761 k( 10) = ( 0.0000000 0.1800000 0.0000000), wk = 0.0050761 k( 11) = ( 0.0000000 0.2000000 0.0000000), wk = 0.0050761 k( 12) = ( 0.0000000 0.2200000 0.0000000), wk = 0.0050761 k( 13) = ( 0.0000000 0.2400000 0.0000000), wk = 0.0050761 k( 14) = ( 0.0000000 0.2600000 0.0000000), wk = 0.0050761 k( 15) = ( 0.0000000 0.2800000 0.0000000), wk = 0.0050761 k( 16) = ( 0.0000000 0.3000000 0.0000000), wk = 0.0050761 k( 17) = ( 0.0000000 0.3200000 0.0000000), wk = 0.0050761 k( 18) = ( 0.0000000 0.3400000 0.0000000), wk = 0.0050761 k( 19) = ( 0.0000000 0.3600000 0.0000000), wk = 0.0050761 k( 20) = ( 0.0000000 0.3800000 0.0000000), wk = 0.0050761 k( 21) = ( 0.0000000 0.4000000 0.0000000), wk = 0.0050761 k( 22) = ( 0.0000000 0.4200000 0.0000000), wk = 0.0050761 k( 23) = ( 0.0000000 0.4400000 0.0000000), wk = 0.0050761 k( 24) = ( 0.0000000 0.4600000 0.0000000), wk = 0.0050761 k( 25) = ( 0.0000000 0.4800000 0.0000000), wk = 0.0050761 k( 26) = ( 0.0000000 0.5000000 0.0000000), wk = 0.0050761 k( 27) = ( 0.0000000 0.5000000 0.0000000), wk = 0.0050761 k( 28) = ( 0.0200000 0.5000000 0.0000000), wk = 0.0050761 k( 29) = ( 0.0400000 0.5000000 0.0000000), wk = 0.0050761 k( 30) = ( 0.0600000 0.5000000 0.0000000), wk = 0.0050761 k( 31) = ( 0.0800000 0.5000000 0.0000000), wk = 0.0050761 k( 32) = ( 0.1000000 0.5000000 0.0000000), wk = 0.0050761 k( 33) = ( 0.1200000 0.5000000 0.0000000), wk = 0.0050761 k( 34) = ( 0.1400000 0.5000000 0.0000000), wk = 0.0050761 k( 35) = ( 0.1600000 0.5000000 0.0000000), wk = 0.0050761 k( 36) = ( 0.1800000 0.5000000 0.0000000), wk = 0.0050761 k( 37) = ( 0.2000000 0.5000000 0.0000000), wk = 0.0050761 k( 38) = ( 0.2200000 0.5000000 0.0000000), wk = 0.0050761 k( 39) = ( 0.2400000 0.5000000 0.0000000), wk = 0.0050761 k( 40) = ( 0.2600000 0.5000000 0.0000000), wk = 0.0050761 k( 41) = ( 0.2800000 0.5000000 0.0000000), wk = 0.0050761 k( 42) = ( 0.3000000 0.5000000 0.0000000), wk = 0.0050761 k( 43) = ( 0.3200000 0.5000000 0.0000000), wk = 0.0050761 k( 44) = ( 0.3400000 0.5000000 0.0000000), wk = 0.0050761 k( 45) = ( 0.3600000 0.5000000 0.0000000), wk = 0.0050761 k( 46) = ( 0.3800000 0.5000000 0.0000000), wk = 0.0050761 k( 47) = ( 0.4000000 0.5000000 0.0000000), wk = 0.0050761 k( 48) = ( 0.4200000 0.5000000 0.0000000), wk = 0.0050761 k( 49) = ( 0.4400000 0.5000000 0.0000000), wk = 0.0050761 k( 50) = ( 0.4600000 0.5000000 0.0000000), wk = 0.0050761 k( 51) = ( 0.4800000 0.5000000 0.0000000), wk = 0.0050761 k( 52) = ( 0.5000000 0.5000000 0.0000000), wk = 0.0050761 k( 53) = ( 0.5000000 0.5000000 0.0000000), wk = 0.0050761 k( 54) = ( 0.4861111 0.4861111 0.0000000), wk = 0.0050761 k( 55) = ( 0.4722222 0.4722222 0.0000000), wk = 0.0050761 k( 56) = ( 0.4583333 0.4583333 0.0000000), wk = 0.0050761 k( 57) = ( 0.4444444 0.4444444 0.0000000), wk = 0.0050761 k( 58) = ( 0.4305556 0.4305556 0.0000000), wk = 0.0050761 k( 59) = ( 0.4166667 0.4166667 0.0000000), wk = 0.0050761 k( 60) = ( 0.4027778 0.4027778 0.0000000), wk = 0.0050761 k( 61) = ( 0.3888889 0.3888889 -0.0000000), wk = 0.0050761 k( 62) = ( 0.3750000 0.3750000 -0.0000000), wk = 0.0050761 k( 63) = ( 0.3611111 0.3611111 0.0000000), wk = 0.0050761 k( 64) = ( 0.3472222 0.3472222 0.0000000), wk = 0.0050761 k( 65) = ( 0.3333333 0.3333333 0.0000000), wk = 0.0050761 k( 66) = ( 0.3194444 0.3194444 0.0000000), wk = 0.0050761 k( 67) = ( 0.3055556 0.3055556 -0.0000000), wk = 0.0050761 k( 68) = ( 0.2916667 0.2916667 -0.0000000), wk = 0.0050761 k( 69) = ( 0.2777778 0.2777778 -0.0000000), wk = 0.0050761 k( 70) = ( 0.2638889 0.2638889 0.0000000), wk = 0.0050761 k( 71) = ( 0.2500000 0.2500000 0.0000000), wk = 0.0050761 k( 72) = ( 0.2361111 0.2361111 0.0000000), wk = 0.0050761 k( 73) = ( 0.2222222 0.2222222 0.0000000), wk = 0.0050761 k( 74) = ( 0.2083333 0.2083333 0.0000000), wk = 0.0050761 k( 75) = ( 0.1944444 0.1944444 0.0000000), wk = 0.0050761 k( 76) = ( 0.1805556 0.1805556 0.0000000), wk = 0.0050761 k( 77) = ( 0.1666667 0.1666667 0.0000000), wk = 0.0050761 k( 78) = ( 0.1527778 0.1527778 -0.0000000), wk = 0.0050761 k( 79) = ( 0.1388889 0.1388889 -0.0000000), wk = 0.0050761 k( 80) = ( 0.1250000 0.1250000 0.0000000), wk = 0.0050761 k( 81) = ( 0.1111111 0.1111111 0.0000000), wk = 0.0050761 k( 82) = ( 0.0972222 0.0972222 0.0000000), wk = 0.0050761 k( 83) = ( 0.0833333 0.0833333 -0.0000000), wk = 0.0050761 k( 84) = ( 0.0694444 0.0694444 0.0000000), wk = 0.0050761 k( 85) = ( 0.0555556 0.0555556 0.0000000), wk = 0.0050761 k( 86) = ( 0.0416667 0.0416667 0.0000000), wk = 0.0050761 k( 87) = ( 0.0277778 0.0277778 0.0000000), wk = 0.0050761 k( 88) = ( 0.0138889 0.0138889 0.0000000), wk = 0.0050761 k( 89) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0050761 k( 90) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0050761 k( 91) = ( 0.0113636 0.0113636 0.0113636), wk = 0.0050761 k( 92) = ( 0.0227273 0.0227273 0.0227273), wk = 0.0050761 k( 93) = ( 0.0340909 0.0340909 0.0340909), wk = 0.0050761 k( 94) = ( 0.0454546 0.0454546 0.0454546), wk = 0.0050761 k( 95) = ( 0.0568182 0.0568182 0.0568182), wk = 0.0050761 k( 96) = ( 0.0681818 0.0681818 0.0681818), wk = 0.0050761 k( 97) = ( 0.0795455 0.0795455 0.0795455), wk = 0.0050761 k( 98) = ( 0.0909091 0.0909091 0.0909091), wk = 0.0050761 k( 99) = ( 0.1022727 0.1022727 0.1022727), wk = 0.0050761 k( 100) = ( 0.1136364 0.1136364 0.1136364), wk = 0.0050761 k( 101) = ( 0.1250000 0.1250000 0.1250000), wk = 0.0050761 k( 102) = ( 0.1363636 0.1363636 0.1363636), wk = 0.0050761 k( 103) = ( 0.1477273 0.1477273 0.1477273), wk = 0.0050761 k( 104) = ( 0.1590909 0.1590909 0.1590909), wk = 0.0050761 k( 105) = ( 0.1704546 0.1704546 0.1704546), wk = 0.0050761 k( 106) = ( 0.1818182 0.1818182 0.1818182), wk = 0.0050761 k( 107) = ( 0.1931818 0.1931818 0.1931818), wk = 0.0050761 k( 108) = ( 0.2045454 0.2045454 0.2045454), wk = 0.0050761 k( 109) = ( 0.2159091 0.2159091 0.2159091), wk = 0.0050761 k( 110) = ( 0.2272727 0.2272727 0.2272727), wk = 0.0050761 k( 111) = ( 0.2386364 0.2386364 0.2386364), wk = 0.0050761 k( 112) = ( 0.2500000 0.2500000 0.2500000), wk = 0.0050761 k( 113) = ( 0.2613636 0.2613636 0.2613636), wk = 0.0050761 k( 114) = ( 0.2727273 0.2727273 0.2727273), wk = 0.0050761 k( 115) = ( 0.2840909 0.2840909 0.2840909), wk = 0.0050761 k( 116) = ( 0.2954545 0.2954545 0.2954545), wk = 0.0050761 k( 117) = ( 0.3068182 0.3068182 0.3068182), wk = 0.0050761 k( 118) = ( 0.3181818 0.3181818 0.3181818), wk = 0.0050761 k( 119) = ( 0.3295455 0.3295455 0.3295455), wk = 0.0050761 k( 120) = ( 0.3409091 0.3409091 0.3409091), wk = 0.0050761 k( 121) = ( 0.3522727 0.3522727 0.3522727), wk = 0.0050761 k( 122) = ( 0.3636364 0.3636364 0.3636364), wk = 0.0050761 k( 123) = ( 0.3750000 0.3750000 0.3750000), wk = 0.0050761 k( 124) = ( 0.3863636 0.3863636 0.3863636), wk = 0.0050761 k( 125) = ( 0.3977273 0.3977273 0.3977273), wk = 0.0050761 k( 126) = ( 0.4090909 0.4090909 0.4090909), wk = 0.0050761 k( 127) = ( 0.4204545 0.4204545 0.4204545), wk = 0.0050761 k( 128) = ( 0.4318182 0.4318182 0.4318182), wk = 0.0050761 k( 129) = ( 0.4431818 0.4431818 0.4431818), wk = 0.0050761 k( 130) = ( 0.4545455 0.4545455 0.4545455), wk = 0.0050761 k( 131) = ( 0.4659091 0.4659091 0.4659091), wk = 0.0050761 k( 132) = ( 0.4772727 0.4772727 0.4772727), wk = 0.0050761 k( 133) = ( 0.4886364 0.4886364 0.4886364), wk = 0.0050761 k( 134) = ( 0.5000000 0.5000000 0.5000000), wk = 0.0050761 k( 135) = ( 0.5000000 0.5000000 0.5000000), wk = 0.0050761 k( 136) = ( 0.4861111 0.5000000 0.4861111), wk = 0.0050761 k( 137) = ( 0.4722222 0.5000000 0.4722222), wk = 0.0050761 k( 138) = ( 0.4583333 0.5000000 0.4583333), wk = 0.0050761 k( 139) = ( 0.4444444 0.5000000 0.4444444), wk = 0.0050761 k( 140) = ( 0.4305556 0.5000000 0.4305556), wk = 0.0050761 k( 141) = ( 0.4166667 0.5000000 0.4166667), wk = 0.0050761 k( 142) = ( 0.4027778 0.5000000 0.4027778), wk = 0.0050761 k( 143) = ( 0.3888889 0.5000000 0.3888889), wk = 0.0050761 k( 144) = ( 0.3750000 0.5000000 0.3750000), wk = 0.0050761 k( 145) = ( 0.3611111 0.5000000 0.3611111), wk = 0.0050761 k( 146) = ( 0.3472222 0.5000000 0.3472222), wk = 0.0050761 k( 147) = ( 0.3333333 0.5000000 0.3333333), wk = 0.0050761 k( 148) = ( 0.3194444 0.5000000 0.3194444), wk = 0.0050761 k( 149) = ( 0.3055556 0.5000000 0.3055556), wk = 0.0050761 k( 150) = ( 0.2916667 0.5000000 0.2916667), wk = 0.0050761 k( 151) = ( 0.2777778 0.5000000 0.2777778), wk = 0.0050761 k( 152) = ( 0.2638889 0.5000000 0.2638889), wk = 0.0050761 k( 153) = ( 0.2500000 0.5000000 0.2500000), wk = 0.0050761 k( 154) = ( 0.2361111 0.5000000 0.2361111), wk = 0.0050761 k( 155) = ( 0.2222222 0.5000000 0.2222222), wk = 0.0050761 k( 156) = ( 0.2083333 0.5000000 0.2083333), wk = 0.0050761 k( 157) = ( 0.1944444 0.5000000 0.1944444), wk = 0.0050761 k( 158) = ( 0.1805556 0.5000000 0.1805556), wk = 0.0050761 k( 159) = ( 0.1666667 0.5000000 0.1666667), wk = 0.0050761 k( 160) = ( 0.1527778 0.5000000 0.1527778), wk = 0.0050761 k( 161) = ( 0.1388889 0.5000000 0.1388889), wk = 0.0050761 k( 162) = ( 0.1250000 0.5000000 0.1250000), wk = 0.0050761 k( 163) = ( 0.1111111 0.5000000 0.1111111), wk = 0.0050761 k( 164) = ( 0.0972222 0.5000000 0.0972222), wk = 0.0050761 k( 165) = ( 0.0833333 0.5000000 0.0833333), wk = 0.0050761 k( 166) = ( 0.0694444 0.5000000 0.0694444), wk = 0.0050761 k( 167) = ( 0.0555556 0.5000000 0.0555556), wk = 0.0050761 k( 168) = ( 0.0416667 0.5000000 0.0416667), wk = 0.0050761 k( 169) = ( 0.0277778 0.5000000 0.0277778), wk = 0.0050761 k( 170) = ( 0.0138889 0.5000000 0.0138889), wk = 0.0050761 k( 171) = ( 0.0000000 0.5000000 0.0000000), wk = 0.0050761 k( 172) = ( 0.5000000 0.5000000 0.0000000), wk = 0.0050761 k( 173) = ( 0.5000000 0.5000000 0.0200000), wk = 0.0050761 k( 174) = ( 0.5000000 0.5000000 0.0400000), wk = 0.0050761 k( 175) = ( 0.5000000 0.5000000 0.0600000), wk = 0.0050761 k( 176) = ( 0.5000000 0.5000000 0.0800000), wk = 0.0050761 k( 177) = ( 0.5000000 0.5000000 0.1000000), wk = 0.0050761 k( 178) = ( 0.5000000 0.5000000 0.1200000), wk = 0.0050761 k( 179) = ( 0.5000000 0.5000000 0.1400000), wk = 0.0050761 k( 180) = ( 0.5000000 0.5000000 0.1600000), wk = 0.0050761 k( 181) = ( 0.5000000 0.5000000 0.1800000), wk = 0.0050761 k( 182) = ( 0.5000000 0.5000000 0.2000000), wk = 0.0050761 k( 183) = ( 0.5000000 0.5000000 0.2200000), wk = 0.0050761 k( 184) = ( 0.5000000 0.5000000 0.2400000), wk = 0.0050761 k( 185) = ( 0.5000000 0.5000000 0.2600000), wk = 0.0050761 k( 186) = ( 0.5000000 0.5000000 0.2800000), wk = 0.0050761 k( 187) = ( 0.5000000 0.5000000 0.3000000), wk = 0.0050761 k( 188) = ( 0.5000000 0.5000000 0.3200000), wk = 0.0050761 k( 189) = ( 0.5000000 0.5000000 0.3400000), wk = 0.0050761 k( 190) = ( 0.5000000 0.5000000 0.3600000), wk = 0.0050761 k( 191) = ( 0.5000000 0.5000000 0.3800000), wk = 0.0050761 k( 192) = ( 0.5000000 0.5000000 0.4000000), wk = 0.0050761 k( 193) = ( 0.5000000 0.5000000 0.4200000), wk = 0.0050761 k( 194) = ( 0.5000000 0.5000000 0.4400000), wk = 0.0050761 k( 195) = ( 0.5000000 0.5000000 0.4600000), wk = 0.0050761 k( 196) = ( 0.5000000 0.5000000 0.4800000), wk = 0.0050761 k( 197) = ( 0.5000000 0.5000000 0.5000000), wk = 0.0050761 Dense grid: 258999 G-vectors FFT dimensions: ( 80, 80, 80) Smooth grid: 71711 G-vectors FFT dimensions: ( 54, 54, 54) Largest allocated arrays est. size (Mb) dimensions Kohn-Sham Wavefunctions 0.47 Mb ( 266, 116) NL pseudopotentials 0.83 Mb ( 133, 408) Each V/rho on FFT grid 0.20 Mb ( 12800) Each G-vector array 0.03 Mb ( 3598) G-vector shells 0.01 Mb ( 908) Largest temporary arrays est. size (Mb) dimensions Auxiliary wavefunctions 1.88 Mb ( 266, 464) Each subspace H/S matrix 0.09 Mb ( 77, 77) Each matrix 1.44 Mb ( 408, 2, 116) The potential is recalculated from file : ./CaSiPt.save/charge-density.dat Starting wfc are 168 randomized atomic wfcs Band Structure Calculation Davidson diagonalization with overlap Computing kpt #: 1 total cpu time spent up to now is 13.7 secs Computing kpt #: 2 total cpu time spent up to now is 21.9 secs Computing kpt #: 3 total cpu time spent up to now is 30.1 secs Computing kpt #: 4 total cpu time spent up to now is 38.1 secs Computing kpt #: 5 total cpu time spent up to now is 46.1 secs Computing kpt #: 6 total cpu time spent up to now is 54.2 secs Computing kpt #: 7 total cpu time spent up to now is 62.2 secs Computing kpt #: 8 total cpu time spent up to now is 70.2 secs Computing kpt #: 9 total cpu time spent up to now is 78.5 secs Computing kpt #: 10 total cpu time spent up to now is 86.5 secs Computing kpt #: 11 total cpu time spent up to now is 94.5 secs Computing kpt #: 12 total cpu time spent up to now is 102.0 secs Computing kpt #: 13 total cpu time spent up to now is 109.1 secs Computing kpt #: 14 total cpu time spent up to now is 116.5 secs Computing kpt #: 15 total cpu time spent up to now is 124.2 secs Computing kpt #: 16 total cpu time spent up to now is 131.9 secs Computing kpt #: 17 total cpu time spent up to now is 140.2 secs Computing kpt #: 18 total cpu time spent up to now is 148.7 secs Computing kpt #: 19 total cpu time spent up to now is 156.9 secs Computing kpt #: 20 total cpu time spent up to now is 165.4 secs Computing kpt #: 21 total cpu time spent up to now is 173.7 secs Computing kpt #: 22 total cpu time spent up to now is 181.9 secs Computing kpt #: 23 total cpu time spent up to now is 190.5 secs Computing kpt #: 24 total cpu time spent up to now is 199.5 secs Computing kpt #: 25 total cpu time spent up to now is 207.8 secs Computing kpt #: 26 total cpu time spent up to now is 215.8 secs Computing kpt #: 27 total cpu time spent up to now is 224.0 secs Computing kpt #: 28 total cpu time spent up to now is 231.9 secs Computing kpt #: 29 total cpu time spent up to now is 240.2 secs Computing kpt #: 30 total cpu time spent up to now is 247.9 secs Computing kpt #: 31 total cpu time spent up to now is 256.2 secs Computing kpt #: 32 total cpu time spent up to now is 263.9 secs Computing kpt #: 33 total cpu time spent up to now is 271.2 secs Computing kpt #: 34 total cpu time spent up to now is 278.9 secs Computing kpt #: 35 total cpu time spent up to now is 286.1 secs Computing kpt #: 36 total cpu time spent up to now is 294.0 secs Computing kpt #: 37 total cpu time spent up to now is 302.4 secs Computing kpt #: 38 total cpu time spent up to now is 310.5 secs Computing kpt #: 39 total cpu time spent up to now is 318.8 secs Computing kpt #: 40 total cpu time spent up to now is 326.6 secs Computing kpt #: 41 total cpu time spent up to now is 333.9 secs Computing kpt #: 42 total cpu time spent up to now is 340.9 secs Computing kpt #: 43 total cpu time spent up to now is 347.6 secs Computing kpt #: 44 total cpu time spent up to now is 354.4 secs Computing kpt #: 45 total cpu time spent up to now is 360.9 secs Computing kpt #: 46 total cpu time spent up to now is 367.7 secs Computing kpt #: 47 total cpu time spent up to now is 374.6 secs Computing kpt #: 48 total cpu time spent up to now is 381.3 secs Computing kpt #: 49 total cpu time spent up to now is 387.4 secs Computing kpt #: 50 total cpu time spent up to now is 393.3 secs Computing kpt #: 51 total cpu time spent up to now is 399.3 secs Computing kpt #: 52 total cpu time spent up to now is 405.3 secs Computing kpt #: 53 total cpu time spent up to now is 411.4 secs Computing kpt #: 54 total cpu time spent up to now is 417.7 secs Computing kpt #: 55 total cpu time spent up to now is 423.9 secs Computing kpt #: 56 total cpu time spent up to now is 430.2 secs Computing kpt #: 57 total cpu time spent up to now is 436.4 secs Computing kpt #: 58 total cpu time spent up to now is 443.1 secs Computing kpt #: 59 total cpu time spent up to now is 450.1 secs Computing kpt #: 60 total cpu time spent up to now is 456.6 secs Computing kpt #: 61 total cpu time spent up to now is 463.4 secs Computing kpt #: 62 total cpu time spent up to now is 471.2 secs Computing kpt #: 63 total cpu time spent up to now is 479.4 secs Computing kpt #: 64 total cpu time spent up to now is 487.7 secs Computing kpt #: 65 total cpu time spent up to now is 495.3 secs Computing kpt #: 66 total cpu time spent up to now is 502.7 secs Computing kpt #: 67 total cpu time spent up to now is 510.0 secs Computing kpt #: 68 total cpu time spent up to now is 516.5 secs Computing kpt #: 69 total cpu time spent up to now is 523.3 secs Computing kpt #: 70 total cpu time spent up to now is 530.0 secs Computing kpt #: 71 total cpu time spent up to now is 537.1 secs Computing kpt #: 72 total cpu time spent up to now is 543.9 secs Computing kpt #: 73 total cpu time spent up to now is 550.6 secs Computing kpt #: 74 total cpu time spent up to now is 557.4 secs Computing kpt #: 75 total cpu time spent up to now is 564.0 secs Computing kpt #: 76 total cpu time spent up to now is 570.7 secs Computing kpt #: 77 total cpu time spent up to now is 577.5 secs Computing kpt #: 78 total cpu time spent up to now is 584.5 secs Computing kpt #: 79 total cpu time spent up to now is 591.6 secs Computing kpt #: 80 total cpu time spent up to now is 598.7 secs Computing kpt #: 81 total cpu time spent up to now is 606.0 secs Computing kpt #: 82 total cpu time spent up to now is 613.9 secs Computing kpt #: 83 total cpu time spent up to now is 622.3 secs Computing kpt #: 84 total cpu time spent up to now is 629.7 secs Computing kpt #: 85 total cpu time spent up to now is 637.6 secs Computing kpt #: 86 total cpu time spent up to now is 645.5 secs Computing kpt #: 87 total cpu time spent up to now is 653.7 secs Computing kpt #: 88 total cpu time spent up to now is 661.7 secs Computing kpt #: 89 total cpu time spent up to now is 669.9 secs Computing kpt #: 90 total cpu time spent up to now is 678.0 secs Computing kpt #: 91 total cpu time spent up to now is 685.8 secs Computing kpt #: 92 total cpu time spent up to now is 693.5 secs Computing kpt #: 93 total cpu time spent up to now is 701.5 secs Computing kpt #: 94 total cpu time spent up to now is 709.7 secs Computing kpt #: 95 total cpu time spent up to now is 717.8 secs Computing kpt #: 96 total cpu time spent up to now is 726.0 secs Computing kpt #: 97 total cpu time spent up to now is 734.2 secs Computing kpt #: 98 total cpu time spent up to now is 741.6 secs Computing kpt #: 99 total cpu time spent up to now is 749.2 secs Computing kpt #: 100 total cpu time spent up to now is 757.1 secs Computing kpt #: 101 total cpu time spent up to now is 765.1 secs Computing kpt #: 102 total cpu time spent up to now is 772.9 secs Computing kpt #: 103 total cpu time spent up to now is 781.1 secs Computing kpt #: 104 total cpu time spent up to now is 788.9 secs Computing kpt #: 105 total cpu time spent up to now is 796.7 secs Computing kpt #: 106 total cpu time spent up to now is 804.5 secs Computing kpt #: 107 total cpu time spent up to now is 812.3 secs Computing kpt #: 108 total cpu time spent up to now is 820.2 secs Computing kpt #: 109 total cpu time spent up to now is 828.4 secs Computing kpt #: 110 total cpu time spent up to now is 836.6 secs Computing kpt #: 111 total cpu time spent up to now is 844.0 secs Computing kpt #: 112 total cpu time spent up to now is 850.8 secs Computing kpt #: 113 total cpu time spent up to now is 859.2 secs Computing kpt #: 114 total cpu time spent up to now is 866.6 secs Computing kpt #: 115 total cpu time spent up to now is 874.1 secs Computing kpt #: 116 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 885.5 secs Computing kpt #: 117 total cpu time spent up to now is 895.1 secs Computing kpt #: 118 total cpu time spent up to now is 905.8 secs Computing kpt #: 119 total cpu time spent up to now is 916.7 secs Computing kpt #: 120 total cpu time spent up to now is 926.7 secs Computing kpt #: 121 total cpu time spent up to now is 935.6 secs Computing kpt #: 122 total cpu time spent up to now is 945.4 secs Computing kpt #: 123 total cpu time spent up to now is 954.1 secs Computing kpt #: 124 total cpu time spent up to now is 963.4 secs Computing kpt #: 125 total cpu time spent up to now is 971.8 secs Computing kpt #: 126 total cpu time spent up to now is 979.5 secs Computing kpt #: 127 total cpu time spent up to now is 987.9 secs Computing kpt #: 128 total cpu time spent up to now is 996.8 secs Computing kpt #: 129 total cpu time spent up to now is 1006.0 secs Computing kpt #: 130 total cpu time spent up to now is 1015.0 secs Computing kpt #: 131 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 1026.6 secs Computing kpt #: 132 c_bands: 4 eigenvalues not converged total cpu time spent up to now is 1038.0 secs Computing kpt #: 133 c_bands: 4 eigenvalues not converged total cpu time spent up to now is 1050.0 secs Computing kpt #: 134 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 1061.6 secs Computing kpt #: 135 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 1073.7 secs Computing kpt #: 136 c_bands: 4 eigenvalues not converged total cpu time spent up to now is 1085.4 secs Computing kpt #: 137 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 1096.9 secs Computing kpt #: 138 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 1108.2 secs Computing kpt #: 139 total cpu time spent up to now is 1118.5 secs Computing kpt #: 140 total cpu time spent up to now is 1127.1 secs Computing kpt #: 141 total cpu time spent up to now is 1136.4 secs Computing kpt #: 142 total cpu time spent up to now is 1145.1 secs Computing kpt #: 143 total cpu time spent up to now is 1153.2 secs Computing kpt #: 144 total cpu time spent up to now is 1161.7 secs Computing kpt #: 145 total cpu time spent up to now is 1169.3 secs Computing kpt #: 146 total cpu time spent up to now is 1177.2 secs Computing kpt #: 147 total cpu time spent up to now is 1184.6 secs Computing kpt #: 148 total cpu time spent up to now is 1192.0 secs Computing kpt #: 149 total cpu time spent up to now is 1199.1 secs Computing kpt #: 150 total cpu time spent up to now is 1206.1 secs Computing kpt #: 151 total cpu time spent up to now is 1213.3 secs Computing kpt #: 152 total cpu time spent up to now is 1220.2 secs Computing kpt #: 153 total cpu time spent up to now is 1227.1 secs Computing kpt #: 154 total cpu time spent up to now is 1234.0 secs Computing kpt #: 155 total cpu time spent up to now is 1241.0 secs Computing kpt #: 156 total cpu time spent up to now is 1248.1 secs Computing kpt #: 157 total cpu time spent up to now is 1255.3 secs Computing kpt #: 158 total cpu time spent up to now is 1262.5 secs Computing kpt #: 159 total cpu time spent up to now is 1269.5 secs Computing kpt #: 160 total cpu time spent up to now is 1276.8 secs Computing kpt #: 161 total cpu time spent up to now is 1283.8 secs Computing kpt #: 162 total cpu time spent up to now is 1291.1 secs Computing kpt #: 163 total cpu time spent up to now is 1298.2 secs Computing kpt #: 164 total cpu time spent up to now is 1305.4 secs Computing kpt #: 165 total cpu time spent up to now is 1312.8 secs Computing kpt #: 166 total cpu time spent up to now is 1320.6 secs Computing kpt #: 167 total cpu time spent up to now is 1328.2 secs Computing kpt #: 168 total cpu time spent up to now is 1336.3 secs Computing kpt #: 169 total cpu time spent up to now is 1344.6 secs Computing kpt #: 170 total cpu time spent up to now is 1352.9 secs Computing kpt #: 171 total cpu time spent up to now is 1361.0 secs Computing kpt #: 172 total cpu time spent up to now is 1366.8 secs Computing kpt #: 173 total cpu time spent up to now is 1373.0 secs Computing kpt #: 174 total cpu time spent up to now is 1379.0 secs Computing kpt #: 175 total cpu time spent up to now is 1385.3 secs Computing kpt #: 176 total cpu time spent up to now is 1391.5 secs Computing kpt #: 177 total cpu time spent up to now is 1398.0 secs Computing kpt #: 178 total cpu time spent up to now is 1404.2 secs Computing kpt #: 179 total cpu time spent up to now is 1410.1 secs Computing kpt #: 180 total cpu time spent up to now is 1417.3 secs Computing kpt #: 181 total cpu time spent up to now is 1423.5 secs Computing kpt #: 182 total cpu time spent up to now is 1429.8 secs Computing kpt #: 183 total cpu time spent up to now is 1435.8 secs Computing kpt #: 184 total cpu time spent up to now is 1442.3 secs Computing kpt #: 185 total cpu time spent up to now is 1449.0 secs Computing kpt #: 186 total cpu time spent up to now is 1455.6 secs Computing kpt #: 187 total cpu time spent up to now is 1462.5 secs Computing kpt #: 188 total cpu time spent up to now is 1469.0 secs Computing kpt #: 189 total cpu time spent up to now is 1476.0 secs Computing kpt #: 190 total cpu time spent up to now is 1483.2 secs Computing kpt #: 191 total cpu time spent up to now is 1491.5 secs Computing kpt #: 192 total cpu time spent up to now is 1500.8 secs Computing kpt #: 193 total cpu time spent up to now is 1510.7 secs Computing kpt #: 194 total cpu time spent up to now is 1520.5 secs Computing kpt #: 195 c_bands: 3 eigenvalues not converged total cpu time spent up to now is 1531.6 secs Computing kpt #: 196 c_bands: 4 eigenvalues not converged total cpu time spent up to now is 1543.3 secs Computing kpt #: 197 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 1554.3 secs ethr = 1.04E-08, avg # of iterations = 65.1 total cpu time spent up to now is 1554.3 secs End of band structure calculation k = 0.0000 0.0000 0.0000 ( 9045 PWs) bands (ev): -31.1817 -31.1817 -31.1705 -31.1705 -31.1705 -31.1705 -31.1705 -31.1705 -12.4636 -12.4636 -12.4621 -12.4621 -12.4621 -12.4621 -12.4160 -12.4160 -12.1075 -12.1075 -12.1075 -12.1075 -12.0943 -12.0943 -12.0723 -12.0723 -12.0723 -12.0723 -12.0564 -12.0564 -12.0355 -12.0355 -12.0355 -12.0355 -0.2230 -0.2230 1.4961 1.4961 1.5183 1.5183 1.5183 1.5183 4.0417 4.0417 4.0417 4.0417 4.3457 4.3457 4.4093 4.4093 4.4093 4.4093 5.0223 5.0223 5.3985 5.3985 5.3985 5.3985 5.5787 5.5787 5.6074 5.6074 5.7352 5.7352 5.7352 5.7352 6.2106 6.2106 6.2106 6.2106 6.4784 6.4784 6.6069 6.6069 6.6069 6.6069 6.7696 6.7696 6.7696 6.7696 7.0013 7.0013 7.6722 7.6722 7.6722 7.6722 7.8662 7.8662 8.4366 8.4366 8.5785 8.5785 8.5785 8.5785 8.9691 8.9691 9.4080 9.4080 9.4080 9.4080 10.4984 10.4984 10.5716 10.5716 10.5716 10.5716 11.5999 11.5999 11.6554 11.6554 11.6554 11.6554 12.9964 12.9964 13.0246 13.0246 13.0246 13.0246 k = 0.0000 0.0200-0.0000 ( 8997 PWs) bands (ev): -31.1816 -31.1816 -31.1706 -31.1706 -31.1704 -31.1704 -31.1703 -31.1703 -12.4642 -12.4631 -12.4627 -12.4623 -12.4618 -12.4614 -12.4160 -12.4160 -12.1084 -12.1075 -12.1073 -12.1064 -12.0951 -12.0934 -12.0732 -12.0731 -12.0713 -12.0713 -12.0568 -12.0560 -12.0357 -12.0355 -12.0355 -12.0353 -0.2218 -0.2218 1.4673 1.4845 1.5072 1.5143 1.5392 1.5503 4.0311 4.0390 4.0450 4.0528 4.3334 4.3590 4.4054 4.4062 4.4124 4.4136 5.0134 5.0311 5.3826 5.3920 5.4035 5.4126 5.5699 5.5874 5.6035 5.6115 5.7149 5.7319 5.7362 5.7569 6.1930 6.2042 6.2171 6.2300 6.4689 6.4865 6.5954 6.6069 6.6091 6.6176 6.7571 6.7662 6.7744 6.7814 6.9955 7.0074 7.6194 7.6659 7.6681 7.7269 7.8455 7.8944 8.4051 8.4614 8.5314 8.5656 8.5958 8.6259 8.9676 8.9766 9.3835 9.4086 9.4090 9.4242 10.4893 10.5101 10.5542 10.5707 10.5741 10.5931 11.5900 11.6095 11.6479 11.6522 11.6579 11.6661 12.9757 13.0017 13.0120 13.0201 13.0233 13.0265 k = 0.0000 0.0400-0.0000 ( 8989 PWs) bands (ev): -31.1816 -31.1816 -31.1708 -31.1708 -31.1704 -31.1704 -31.1701 -31.1701 -12.4648 -12.4633 -12.4627 -12.4624 -12.4613 -12.4607 -12.4161 -12.4161 -12.1094 -12.1076 -12.1071 -12.1054 -12.0959 -12.0924 -12.0740 -12.0740 -12.0705 -12.0703 -12.0571 -12.0557 -12.0361 -12.0356 -12.0354 -12.0353 -0.2183 -0.2182 1.4333 1.4492 1.5098 1.5150 1.5676 1.5806 4.0212 4.0370 4.0489 4.0643 4.3225 4.3717 4.4028 4.4029 4.4158 4.4182 5.0043 5.0395 5.3650 5.3841 5.4068 5.4247 5.5612 5.5938 5.6018 5.6158 5.6957 5.7258 5.7351 5.7797 6.1777 6.1978 6.2234 6.2501 6.4586 6.4929 6.5837 6.6098 6.6131 6.6275 6.7437 6.7641 6.7802 6.7926 6.9902 7.0139 7.5686 7.6501 7.6547 7.7825 7.8316 7.9289 8.3689 8.4733 8.4901 8.5556 8.6180 8.6729 8.9729 8.9883 9.3513 9.4073 9.4134 9.4339 10.4837 10.5223 10.5413 10.5721 10.5778 10.6186 11.5810 11.6144 11.6453 11.6478 11.6617 11.6791 12.9396 12.9784 13.0016 13.0168 13.0219 13.0291 k = 0.0000 0.0600-0.0000 ( 8969 PWs) bands (ev): -31.1815 -31.1815 -31.1710 -31.1710 -31.1704 -31.1704 -31.1700 -31.1700 -12.4653 -12.4638 -12.4626 -12.4625 -12.4607 -12.4599 -12.4162 -12.4162 -12.1104 -12.1076 -12.1068 -12.1044 -12.0966 -12.0914 -12.0749 -12.0747 -12.0696 -12.0693 -12.0575 -12.0555 -12.0364 -12.0357 -12.0354 -12.0352 -0.2125 -0.2122 1.3973 1.4125 1.5121 1.5171 1.5955 1.6091 4.0120 4.0358 4.0534 4.0760 4.3131 4.3803 4.3994 4.4041 4.4209 4.4228 4.9954 5.0473 5.3461 5.3751 5.4085 5.4345 5.5524 5.5921 5.6075 5.6204 5.6778 5.7171 5.7326 5.8039 6.1652 6.1915 6.2296 6.2699 6.4477 6.4972 6.5725 6.6156 6.6181 6.6363 6.7296 6.7635 6.7870 6.8033 6.9852 7.0207 7.5201 7.6277 7.6344 7.8172 7.8432 7.9680 8.3300 8.4344 8.4940 8.5475 8.6438 8.7192 8.9847 9.0015 9.3135 9.3985 9.4223 9.4422 10.4811 10.5322 10.5339 10.5772 10.5825 10.6479 11.5726 11.6115 11.6423 11.6447 11.6727 11.6945 12.8983 12.9383 12.9985 13.0156 13.0202 13.0325 k = 0.0000 0.0800-0.0000 ( 8961 PWs) bands (ev): -31.1815 -31.1815 -31.1712 -31.1712 -31.1704 -31.1704 -31.1698 -31.1698 -12.4659 -12.4643 -12.4627 -12.4625 -12.4599 -12.4592 -12.4165 -12.4165 -12.1113 -12.1076 -12.1066 -12.1036 -12.0972 -12.0903 -12.0757 -12.0753 -12.0689 -12.0683 -12.0578 -12.0553 -12.0369 -12.0357 -12.0354 -12.0354 -0.2043 -0.2040 1.3597 1.3744 1.5148 1.5202 1.6219 1.6355 4.0038 4.0354 4.0584 4.0879 4.3056 4.3815 4.3956 4.4091 4.4274 4.4306 4.9867 5.0545 5.3260 5.3654 5.4086 5.4419 5.5433 5.5873 5.6147 5.6254 5.6615 5.7057 5.7290 5.8294 6.1559 6.1853 6.2357 6.2883 6.4366 6.4996 6.5630 6.6235 6.6235 6.6447 6.7147 6.7646 6.7946 6.8137 6.9805 7.0278 7.4740 7.6020 7.6093 7.8082 7.8998 8.0102 8.2899 8.3884 8.5017 8.5409 8.6708 8.7643 9.0020 9.0123 9.2737 9.3795 9.4369 9.4527 10.4791 10.5347 10.5380 10.5871 10.5879 10.6806 11.5638 11.6041 11.6363 11.6409 11.6921 11.7126 12.8574 12.8975 12.9938 13.0151 13.0185 13.0367 k = 0.0000 0.1000-0.0000 ( 8953 PWs) bands (ev): -31.1814 -31.1814 -31.1714 -31.1714 -31.1704 -31.1704 -31.1697 -31.1697 -12.4664 -12.4647 -12.4629 -12.4625 -12.4591 -12.4583 -12.4168 -12.4168 -12.1122 -12.1077 -12.1062 -12.1029 -12.0976 -12.0892 -12.0764 -12.0759 -12.0684 -12.0672 -12.0580 -12.0552 -12.0375 -12.0358 -12.0356 -12.0354 -0.1937 -0.1934 1.3209 1.3350 1.5183 1.5243 1.6463 1.6600 3.9965 4.0359 4.0638 4.0997 4.2999 4.3789 4.3915 4.4131 4.4320 4.4462 4.9786 5.0609 5.3048 5.3552 5.4072 5.4469 5.5335 5.5815 5.6192 5.6307 5.6482 5.6922 5.7251 5.8562 6.1501 6.1792 6.2415 6.3036 6.4253 6.5004 6.5562 6.6290 6.6317 6.6538 6.6992 6.7674 6.8027 6.8243 6.9761 7.0352 7.4305 7.5752 7.5810 7.7968 7.9577 8.0543 8.2499 8.3429 8.5078 8.5357 8.6965 8.8078 9.0155 9.0226 9.2369 9.3517 9.4583 9.4660 10.4758 10.5400 10.5449 10.5938 10.6010 10.7157 11.5531 11.5937 11.6306 11.6346 11.7171 11.7338 12.8197 12.8590 12.9880 13.0134 13.0179 13.0416 k = 0.0000 0.1200-0.0000 ( 8970 PWs) bands (ev): -31.1813 -31.1813 -31.1717 -31.1717 -31.1704 -31.1704 -31.1696 -31.1696 -12.4669 -12.4652 -12.4631 -12.4626 -12.4582 -12.4575 -12.4172 -12.4172 -12.1131 -12.1078 -12.1058 -12.1025 -12.0978 -12.0881 -12.0770 -12.0763 -12.0681 -12.0662 -12.0580 -12.0551 -12.0382 -12.0360 -12.0359 -12.0355 -0.1809 -0.1805 1.2808 1.2944 1.5225 1.5291 1.6687 1.6823 3.9903 4.0373 4.0695 4.1114 4.2961 4.3752 4.3870 4.4156 4.4365 4.4653 4.9711 5.0665 5.2826 5.3449 5.4046 5.4496 5.5227 5.5749 5.6156 5.6363 5.6422 5.6774 5.7212 5.8840 6.1475 6.1733 6.2470 6.3144 6.4138 6.5002 6.5535 6.6342 6.6375 6.6655 6.6830 6.7720 6.8114 6.8354 6.9721 7.0425 7.3895 7.5486 7.5512 7.7836 8.0142 8.0992 8.2120 8.2986 8.5132 8.5319 8.7184 8.8490 9.0059 9.0432 9.2092 9.3189 9.4818 9.4870 10.4718 10.5397 10.5633 10.6000 10.6172 10.7524 11.5387 11.5798 11.6263 11.6271 11.7464 11.7584 12.7870 12.8245 12.9812 13.0102 13.0190 13.0470 k = 0.0000 0.1400-0.0000 ( 8958 PWs) bands (ev): -31.1812 -31.1812 -31.1719 -31.1719 -31.1703 -31.1703 -31.1695 -31.1695 -12.4673 -12.4655 -12.4634 -12.4627 -12.4572 -12.4566 -12.4177 -12.4177 -12.1139 -12.1078 -12.1054 -12.1023 -12.0978 -12.0870 -12.0776 -12.0765 -12.0680 -12.0651 -12.0578 -12.0551 -12.0389 -12.0363 -12.0361 -12.0356 -0.1658 -0.1654 1.2398 1.2528 1.5275 1.5348 1.6890 1.7024 3.9852 4.0399 4.0754 4.1227 4.2941 4.3713 4.3822 4.4174 4.4410 4.4864 4.9645 5.0714 5.2595 5.3346 5.4008 5.4501 5.5106 5.5671 5.6039 5.6416 5.6421 5.6633 5.7180 5.9128 6.1483 6.1676 6.2524 6.3197 6.4024 6.4993 6.5555 6.6389 6.6398 6.6664 6.6803 6.7784 6.8206 6.8472 6.9686 7.0500 7.3510 7.5210 7.5229 7.7687 8.0640 8.1431 8.1816 8.2570 8.5186 8.5296 8.7329 8.8873 8.9831 9.0574 9.1938 9.2879 9.5001 9.5231 10.4684 10.5379 10.5873 10.6065 10.6348 10.7901 11.5193 11.5612 11.6198 11.6241 11.7793 11.7867 12.7605 12.7954 12.9738 13.0063 13.0209 13.0530 k = 0.0000 0.1600-0.0000 ( 8962 PWs) bands (ev): -31.1811 -31.1811 -31.1721 -31.1721 -31.1703 -31.1703 -31.1694 -31.1694 -12.4677 -12.4659 -12.4636 -12.4629 -12.4563 -12.4557 -12.4183 -12.4183 -12.1146 -12.1079 -12.1049 -12.1024 -12.0976 -12.0859 -12.0780 -12.0765 -12.0683 -12.0640 -12.0575 -12.0552 -12.0397 -12.0368 -12.0363 -12.0357 -0.1485 -0.1481 1.1978 1.2102 1.5332 1.5412 1.7072 1.7203 3.9813 4.0437 4.0815 4.1336 4.2939 4.3675 4.3771 4.4188 4.4456 4.5087 4.9589 5.0754 5.2356 5.3244 5.3961 5.4486 5.4972 5.5578 5.5898 5.6356 5.6481 5.6559 5.7155 5.9421 6.1521 6.1622 6.2577 6.3191 6.3914 6.4979 6.5616 6.6389 6.6412 6.6517 6.6970 6.7866 6.8303 6.8600 6.9655 7.0574 7.3149 7.4917 7.4986 7.7524 8.0851 8.1753 8.1810 8.2280 8.5244 8.5288 8.7342 8.9223 8.9558 9.0552 9.1877 9.2687 9.5211 9.5662 10.4666 10.5352 10.6080 10.6202 10.6530 10.8283 11.4944 11.5371 11.6136 11.6238 11.8158 11.8190 12.7410 12.7723 12.9660 13.0020 13.0236 13.0595 k = 0.0000 0.1800-0.0000 ( 8954 PWs) bands (ev): -31.1809 -31.1809 -31.1724 -31.1724 -31.1702 -31.1702 -31.1693 -31.1693 -12.4681 -12.4661 -12.4639 -12.4630 -12.4553 -12.4547 -12.4189 -12.4189 -12.1152 -12.1081 -12.1043 -12.1026 -12.0974 -12.0847 -12.0783 -12.0764 -12.0687 -12.0629 -12.0569 -12.0553 -12.0406 -12.0374 -12.0365 -12.0358 -0.1291 -0.1286 1.1549 1.1667 1.5397 1.5483 1.7230 1.7360 3.9786 4.0487 4.0875 4.1441 4.2953 4.3639 4.3717 4.4198 4.4502 4.5320 4.9543 5.0788 5.2109 5.3144 5.3907 5.4450 5.4830 5.5464 5.5753 5.6228 5.6539 5.6555 5.7141 5.9716 6.1571 6.1586 6.2629 6.3134 6.3813 6.4963 6.5697 6.6286 6.6353 6.6522 6.7147 6.7964 6.8406 6.8738 6.9632 7.0649 7.2809 7.4643 7.4757 7.7354 8.0662 8.1575 8.2214 8.2500 8.5292 8.5305 8.7156 8.9364 8.9534 9.0294 9.1861 9.2688 9.5454 9.6153 10.4670 10.5319 10.6140 10.6509 10.6715 10.8666 11.4641 11.5074 11.6084 11.6250 11.8553 11.8557 12.7284 12.7558 12.9582 12.9978 13.0269 13.0664 k = 0.0000 0.2000-0.0000 ( 8946 PWs) bands (ev): -31.1808 -31.1808 -31.1727 -31.1727 -31.1702 -31.1702 -31.1693 -31.1693 -12.4684 -12.4664 -12.4641 -12.4631 -12.4542 -12.4537 -12.4197 -12.4196 -12.1158 -12.1083 -12.1037 -12.1028 -12.0973 -12.0835 -12.0784 -12.0760 -12.0693 -12.0619 -12.0562 -12.0555 -12.0415 -12.0380 -12.0367 -12.0360 -0.1075 -0.1069 1.1113 1.1224 1.5469 1.5562 1.7366 1.7493 3.9772 4.0550 4.0932 4.1540 4.2980 4.3609 4.3659 4.4207 4.4549 4.5561 4.9510 5.0817 5.1854 5.3043 5.3848 5.4386 5.4693 5.5320 5.5613 5.6095 5.6559 5.6593 5.7139 6.0003 6.1523 6.1674 6.2681 6.3043 6.3722 6.4944 6.5772 6.6111 6.6293 6.6596 6.7325 6.8077 6.8518 6.8885 6.9618 7.0729 7.2489 7.4395 7.4541 7.7181 8.0361 8.1203 8.2743 8.2916 8.5306 8.5368 8.6763 8.9303 8.9745 8.9899 9.1859 9.2835 9.5736 9.6693 10.4699 10.5283 10.6172 10.6855 10.6900 10.9048 11.4291 11.4729 11.6041 11.6270 11.8957 11.8987 12.7226 12.7455 12.9507 12.9939 13.0309 13.0738 k = 0.0000 0.2200-0.0000 ( 8946 PWs) bands (ev): -31.1806 -31.1806 -31.1729 -31.1729 -31.1701 -31.1701 -31.1692 -31.1692 -12.4687 -12.4666 -12.4644 -12.4633 -12.4532 -12.4527 -12.4204 -12.4204 -12.1163 -12.1086 -12.1033 -12.1027 -12.0972 -12.0824 -12.0784 -12.0755 -12.0701 -12.0609 -12.0557 -12.0553 -12.0425 -12.0388 -12.0370 -12.0362 -0.0838 -0.0832 1.0669 1.0773 1.5548 1.5647 1.7479 1.7604 3.9770 4.0627 4.0985 4.1633 4.3017 4.3584 4.3598 4.4214 4.4600 4.5807 4.9487 5.0842 5.1595 5.2939 5.3784 5.4276 5.4584 5.5144 5.5484 5.5979 5.6555 5.6638 5.7151 6.0272 6.1480 6.1782 6.2737 6.2942 6.3638 6.4923 6.5801 6.5948 6.6210 6.6703 6.7498 6.8201 6.8639 6.9036 6.9614 7.0817 7.2188 7.4181 7.4336 7.7009 8.0052 8.0819 8.3291 8.3344 8.5325 8.5411 8.6243 8.9251 8.9340 9.0060 9.1855 9.3039 9.6064 9.7272 10.4756 10.5247 10.6186 10.7080 10.7221 10.9428 11.3899 11.4345 11.6002 11.6291 11.9401 11.9449 12.7225 12.7410 12.9440 12.9909 13.0355 13.0816 k = 0.0000 0.2400-0.0000 ( 8946 PWs) bands (ev): -31.1804 -31.1804 -31.1732 -31.1732 -31.1701 -31.1701 -31.1692 -31.1692 -12.4689 -12.4668 -12.4647 -12.4635 -12.4521 -12.4516 -12.4213 -12.4212 -12.1167 -12.1089 -12.1034 -12.1021 -12.0973 -12.0812 -12.0783 -12.0747 -12.0711 -12.0599 -12.0560 -12.0544 -12.0434 -12.0396 -12.0373 -12.0364 -0.0581 -0.0576 1.0220 1.0317 1.5634 1.5738 1.7570 1.7692 3.9779 4.0718 4.1031 4.1721 4.3061 4.3535 4.3567 4.4219 4.4655 4.6059 4.9472 5.0866 5.1335 5.2828 5.3718 5.4119 5.4515 5.4943 5.5361 5.5882 5.6538 5.6667 5.7182 6.0505 6.1444 6.1905 6.2796 6.2856 6.3558 6.4899 6.5694 6.5889 6.6109 6.6836 6.7662 6.8333 6.8772 6.9185 6.9623 7.0923 7.1909 7.4003 7.4141 7.6842 7.9762 8.0442 8.3758 8.3832 8.5282 8.5340 8.5822 8.8640 8.9424 9.0252 9.1843 9.3240 9.6441 9.7877 10.4840 10.5213 10.6179 10.7252 10.7603 10.9805 11.3476 11.3931 11.5962 11.6307 11.9883 11.9940 12.7273 12.7416 12.9385 12.9891 13.0408 13.0899 k = 0.0000 0.2600-0.0000 ( 8938 PWs) bands (ev): -31.1802 -31.1802 -31.1735 -31.1735 -31.1700 -31.1700 -31.1691 -31.1691 -12.4691 -12.4669 -12.4650 -12.4637 -12.4510 -12.4505 -12.4222 -12.4221 -12.1171 -12.1093 -12.1036 -12.1013 -12.0974 -12.0800 -12.0780 -12.0738 -12.0721 -12.0590 -12.0564 -12.0535 -12.0444 -12.0405 -12.0376 -12.0367 -0.0304 -0.0299 0.9765 0.9855 1.5726 1.5836 1.7638 1.7759 3.9801 4.0821 4.1068 4.1805 4.3106 4.3471 4.3559 4.4223 4.4718 4.6315 4.9461 5.0890 5.1079 5.2705 5.3649 5.3932 5.4477 5.4731 5.5242 5.5803 5.6509 5.6676 5.7234 6.0677 6.1416 6.2039 6.2814 6.2861 6.3479 6.4872 6.5517 6.5875 6.5990 6.6985 6.7813 6.8464 6.8914 6.9326 6.9644 7.1053 7.1655 7.3863 7.3952 7.6681 7.9501 8.0077 8.4127 8.4354 8.4764 8.5335 8.5781 8.8028 8.9523 9.0411 9.1819 9.3407 9.6868 9.8501 10.4950 10.5184 10.6150 10.7412 10.7994 11.0179 11.3029 11.3499 11.5918 11.6313 12.0399 12.0458 12.7355 12.7463 12.9347 12.9892 13.0469 13.0987 k = 0.0000 0.2800-0.0000 ( 8946 PWs) bands (ev): -31.1800 -31.1800 -31.1738 -31.1738 -31.1700 -31.1700 -31.1691 -31.1691 -12.4692 -12.4670 -12.4654 -12.4639 -12.4498 -12.4494 -12.4231 -12.4231 -12.1174 -12.1097 -12.1038 -12.1004 -12.0976 -12.0789 -12.0776 -12.0733 -12.0727 -12.0582 -12.0568 -12.0525 -12.0454 -12.0415 -12.0380 -12.0370 -0.0009 -0.0005 0.9306 0.9389 1.5824 1.5938 1.7684 1.7804 3.9833 4.0937 4.1095 4.1885 4.3144 4.3409 4.3560 4.4225 4.4791 4.6576 4.9442 5.0841 5.0916 5.2565 5.3575 5.3734 5.4461 5.4517 5.5125 5.5741 5.6469 5.6662 5.7308 6.0763 6.1401 6.2180 6.2839 6.2933 6.3399 6.4841 6.5336 6.5855 6.5857 6.7134 6.7950 6.8589 6.9061 6.9455 6.9677 7.1218 7.1435 7.3760 7.3768 7.6528 7.9274 7.9724 8.3970 8.4617 8.4839 8.5282 8.5862 8.7472 8.9624 9.0537 9.1783 9.3527 9.7339 9.9135 10.5083 10.5163 10.6099 10.7557 10.8390 11.0549 11.2567 11.3060 11.5865 11.6302 12.0947 12.0999 12.7459 12.7539 12.9330 12.9915 13.0540 13.1081 k = 0.0000 0.3000-0.0000 ( 8946 PWs) bands (ev): -31.1798 -31.1798 -31.1741 -31.1741 -31.1699 -31.1699 -31.1691 -31.1691 -12.4693 -12.4671 -12.4657 -12.4642 -12.4487 -12.4483 -12.4241 -12.4241 -12.1176 -12.1102 -12.1039 -12.0994 -12.0979 -12.0777 -12.0770 -12.0745 -12.0715 -12.0576 -12.0573 -12.0516 -12.0463 -12.0426 -12.0384 -12.0373 0.0305 0.0308 0.8843 0.8919 1.5927 1.6046 1.7709 1.7828 3.9875 4.1064 4.1109 4.1964 4.3164 4.3355 4.3573 4.4225 4.4877 4.6840 4.9396 5.0639 5.0946 5.2403 5.3490 5.3534 5.4315 5.4465 5.5007 5.5692 5.6419 5.6626 5.7400 6.0755 6.1401 6.2324 6.2936 6.3014 6.3318 6.4805 6.5162 6.5713 6.5834 6.7274 6.8074 6.8697 6.9199 6.9575 6.9714 7.1265 7.1422 7.3587 7.3691 7.6382 7.9085 7.9387 8.3295 8.4936 8.5038 8.5356 8.5972 8.7049 8.9721 9.0638 9.1734 9.3596 9.7846 9.9771 10.5152 10.5231 10.6031 10.7684 10.8783 11.0909 11.2104 11.2628 11.5796 11.6271 12.1522 12.1562 12.7572 12.7634 12.9337 12.9964 13.0621 13.1182 k = 0.0000 0.3200-0.0000 ( 8954 PWs) bands (ev): -31.1796 -31.1796 -31.1744 -31.1744 -31.1699 -31.1699 -31.1691 -31.1690 -12.4694 -12.4671 -12.4660 -12.4644 -12.4475 -12.4471 -12.4252 -12.4251 -12.1177 -12.1107 -12.1040 -12.0985 -12.0982 -12.0767 -12.0763 -12.0757 -12.0702 -12.0578 -12.0571 -12.0506 -12.0470 -12.0438 -12.0388 -12.0377 0.0635 0.0638 0.8377 0.8447 1.6035 1.6157 1.7714 1.7833 3.9926 4.1110 4.1199 4.2042 4.3149 4.3324 4.3595 4.4222 4.4980 4.7107 4.9297 5.0502 5.0981 5.2219 5.3337 5.3385 5.4137 5.4489 5.4890 5.5655 5.6362 5.6569 5.7507 6.0668 6.1413 6.2469 6.3068 6.3103 6.3254 6.4763 6.5000 6.5559 6.5822 6.7396 6.8186 6.8784 6.9309 6.9704 6.9739 7.1167 7.1663 7.3408 7.3652 7.6242 7.8937 7.9067 8.2596 8.4701 8.5251 8.5740 8.6094 8.6830 8.9811 9.0721 9.1673 9.3616 9.8378 10.0404 10.5150 10.5367 10.5966 10.7789 10.9160 11.1216 11.1691 11.2221 11.5707 11.6215 12.2118 12.2141 12.7681 12.7736 12.9371 13.0041 13.0714 13.1290 k = 0.0000 0.3400-0.0000 ( 8954 PWs) bands (ev): -31.1794 -31.1794 -31.1747 -31.1747 -31.1698 -31.1698 -31.1691 -31.1690 -12.4694 -12.4671 -12.4664 -12.4646 -12.4463 -12.4459 -12.4263 -12.4262 -12.1177 -12.1113 -12.1040 -12.0988 -12.0974 -12.0770 -12.0758 -12.0754 -12.0688 -12.0584 -12.0569 -12.0496 -12.0475 -12.0450 -12.0392 -12.0381 0.0982 0.0983 0.7909 0.7973 1.6148 1.6273 1.7701 1.7820 3.9985 4.1098 4.1340 4.2120 4.3099 4.3313 4.3628 4.4217 4.5102 4.7379 4.9128 5.0448 5.1021 5.2014 5.3148 5.3249 5.3999 5.4533 5.4774 5.5631 5.6300 5.6494 5.7628 6.0529 6.1435 6.2612 6.3074 6.3201 6.3337 6.4716 6.4853 6.5399 6.5827 6.7494 6.8289 6.8847 6.9372 6.9732 6.9857 7.1162 7.1932 7.3235 7.3636 7.6106 7.8766 7.8834 8.1907 8.4194 8.5537 8.6069 8.6223 8.6809 8.9896 9.0797 9.1600 9.3589 9.8926 10.1026 10.5159 10.5424 10.5971 10.7871 10.9494 11.1066 11.1740 11.1870 11.5593 11.6132 12.2730 12.2733 12.7777 12.7833 12.9435 13.0146 13.0822 13.1408 k = 0.0000 0.3600-0.0000 ( 8970 PWs) bands (ev): -31.1791 -31.1791 -31.1750 -31.1750 -31.1697 -31.1697 -31.1691 -31.1691 -12.4695 -12.4671 -12.4667 -12.4649 -12.4450 -12.4447 -12.4275 -12.4273 -12.1177 -12.1119 -12.1040 -12.0993 -12.0963 -12.0783 -12.0750 -12.0744 -12.0673 -12.0590 -12.0570 -12.0487 -12.0477 -12.0463 -12.0397 -12.0386 0.1344 0.1345 0.7441 0.7498 1.6264 1.6391 1.7670 1.7790 4.0052 4.1072 4.1485 4.2200 4.3029 4.3304 4.3669 4.4208 4.5245 4.7653 4.8897 5.0469 5.1060 5.1795 5.2967 5.3079 5.3907 5.4597 5.4661 5.5617 5.6233 5.6402 5.7761 6.0358 6.1468 6.2753 6.2976 6.3306 6.3517 6.4661 6.4724 6.5237 6.5861 6.7562 6.8387 6.8892 6.9391 6.9684 7.0036 7.1255 7.2205 7.3084 7.3635 7.5971 7.8490 7.8776 8.1243 8.3606 8.5787 8.6314 8.6353 8.6924 8.9978 9.0878 9.1515 9.3519 9.9481 10.1631 10.5175 10.5338 10.6102 10.7931 10.9728 11.0639 11.1633 11.2074 11.5451 11.6019 12.3330 12.3350 12.7850 12.7913 12.9528 13.0278 13.0947 13.1535 k = 0.0000 0.3800-0.0000 ( 8970 PWs) bands (ev): -31.1788 -31.1788 -31.1753 -31.1753 -31.1697 -31.1697 -31.1691 -31.1691 -12.4694 -12.4671 -12.4670 -12.4652 -12.4438 -12.4435 -12.4286 -12.4285 -12.1177 -12.1125 -12.1039 -12.0997 -12.0952 -12.0797 -12.0740 -12.0734 -12.0658 -12.0595 -12.0574 -12.0478 -12.0476 -12.0475 -12.0403 -12.0391 0.1720 0.1722 0.6973 0.7023 1.6382 1.6511 1.7624 1.7744 4.0124 4.1033 4.1630 4.2282 4.2952 4.3285 4.3716 4.4196 4.5409 4.7932 4.8624 5.0546 5.1078 5.1588 5.2793 5.2881 5.3855 5.4551 5.4679 5.5613 5.6164 5.6294 5.7904 6.0167 6.1512 6.2858 6.2892 6.3415 6.3692 6.4599 6.4613 6.5075 6.5931 6.7593 6.8480 6.8923 6.9378 6.9608 7.0229 7.1431 7.2409 7.3022 7.3639 7.5833 7.8244 7.8765 8.0613 8.2990 8.6004 8.6479 8.6495 8.7097 9.0062 9.0975 9.1420 9.3410 10.0038 10.2213 10.5153 10.5196 10.6315 10.7971 10.9780 11.0206 11.1593 11.2429 11.5277 11.5876 12.3926 12.3971 12.7891 12.7966 12.9653 13.0435 13.1091 13.1672 k = 0.0000 0.4000-0.0000 ( 8994 PWs) bands (ev): -31.1786 -31.1786 -31.1756 -31.1756 -31.1696 -31.1696 -31.1691 -31.1691 -12.4694 -12.4674 -12.4671 -12.4654 -12.4425 -12.4422 -12.4298 -12.4297 -12.1176 -12.1132 -12.1038 -12.1003 -12.0940 -12.0810 -12.0731 -12.0724 -12.0642 -12.0601 -12.0581 -12.0489 -12.0473 -12.0469 -12.0409 -12.0396 0.2109 0.2113 0.6505 0.6550 1.6503 1.6633 1.7563 1.7684 4.0202 4.0984 4.1771 4.2366 4.2873 4.3253 4.3768 4.4180 4.5595 4.8214 4.8329 5.0662 5.1011 5.1461 5.2625 5.2666 5.3834 5.4444 5.4778 5.5619 5.6094 5.6173 5.8056 5.9965 6.1570 6.2728 6.3029 6.3523 6.3841 6.4521 6.4528 6.4919 6.6041 6.7583 6.8570 6.8950 6.9342 6.9520 7.0432 7.1663 7.2408 7.3172 7.3635 7.5689 7.8038 7.8804 8.0025 8.2378 8.6189 8.6591 8.6649 8.7259 9.0149 9.1101 9.1314 9.3265 10.0589 10.2765 10.4908 10.5214 10.6566 10.7995 10.9634 10.9792 11.1765 11.2784 11.5070 11.5702 12.4513 12.4584 12.7890 12.7980 12.9808 13.0615 13.1256 13.1816 k = 0.0000 0.4200-0.0000 ( 8962 PWs) bands (ev): -31.1783 -31.1783 -31.1759 -31.1759 -31.1696 -31.1695 -31.1691 -31.1691 -12.4693 -12.4676 -12.4670 -12.4656 -12.4412 -12.4409 -12.4310 -12.4309 -12.1173 -12.1137 -12.1036 -12.1007 -12.0928 -12.0823 -12.0722 -12.0715 -12.0626 -12.0607 -12.0588 -12.0503 -12.0468 -12.0460 -12.0414 -12.0402 0.2510 0.2517 0.6040 0.6079 1.6625 1.6755 1.7489 1.7612 4.0283 4.0924 4.1907 4.2448 4.2798 4.3207 4.3822 4.4160 4.5801 4.8022 4.8500 5.0806 5.0813 5.1465 5.2442 5.2463 5.3836 5.4342 5.4892 5.5634 5.6024 5.6041 5.8218 5.9759 6.1642 6.2592 6.3166 6.3625 6.3958 6.4443 6.4451 6.4772 6.6188 6.7530 6.8659 6.8978 6.9291 6.9433 7.0639 7.1931 7.2268 7.3463 7.3607 7.5532 7.7883 7.8896 7.9488 8.1786 8.6347 8.6681 8.6795 8.7373 9.0243 9.1200 9.1261 9.3089 10.1129 10.3280 10.4620 10.5218 10.6838 10.8013 10.9368 10.9406 11.2068 11.3136 11.4829 11.5501 12.5083 12.5178 12.7838 12.7945 12.9996 13.0818 13.1445 13.1955 k = 0.0000 0.4400-0.0000 ( 8974 PWs) bands (ev): -31.1780 -31.1780 -31.1762 -31.1762 -31.1695 -31.1695 -31.1692 -31.1692 -12.4692 -12.4679 -12.4669 -12.4658 -12.4399 -12.4397 -12.4323 -12.4321 -12.1171 -12.1143 -12.1034 -12.1012 -12.0916 -12.0837 -12.0713 -12.0708 -12.0612 -12.0610 -12.0597 -12.0518 -12.0462 -12.0451 -12.0421 -12.0408 0.2922 0.2932 0.5577 0.5611 1.6746 1.6876 1.7404 1.7528 4.0366 4.0857 4.2034 4.2513 4.2742 4.3148 4.3877 4.4134 4.6028 4.7712 4.8790 5.0551 5.0971 5.1536 5.2216 5.2307 5.3857 5.4247 5.5019 5.5658 5.5900 5.5957 5.8388 5.9551 6.1726 6.2453 6.3302 6.3710 6.4047 6.4374 6.4378 6.4640 6.6364 6.7435 6.8746 6.9012 6.9229 6.9353 7.0848 7.2085 7.2218 7.3542 7.3787 7.5360 7.7793 7.9012 7.9044 8.1229 8.6480 8.6743 8.6937 8.7429 9.0345 9.1079 9.1454 9.2886 10.1655 10.3749 10.4292 10.5194 10.7126 10.8037 10.9052 10.9057 11.2429 11.3480 11.4556 11.5272 12.5625 12.5742 12.7727 12.7849 13.0216 13.1043 13.1658 13.2017 k = 0.0000 0.4600-0.0000 ( 8974 PWs) bands (ev): -31.1777 -31.1777 -31.1765 -31.1765 -31.1694 -31.1694 -31.1692 -31.1692 -12.4690 -12.4682 -12.4667 -12.4660 -12.4386 -12.4384 -12.4335 -12.4333 -12.1167 -12.1149 -12.1031 -12.1016 -12.0903 -12.0850 -12.0705 -12.0702 -12.0615 -12.0605 -12.0595 -12.0533 -12.0455 -12.0443 -12.0427 -12.0414 0.3345 0.3358 0.5118 0.5147 1.6866 1.6996 1.7310 1.7435 4.0452 4.0783 4.2152 4.2513 4.2750 4.3076 4.3930 4.4103 4.6273 4.7404 4.9083 5.0267 5.1153 5.1635 5.1991 5.2157 5.3894 5.4158 5.5156 5.5691 5.5753 5.5893 5.8566 5.9345 6.1823 6.2315 6.3435 6.3759 6.4116 6.4315 6.4321 6.4523 6.6559 6.7303 6.8833 6.9053 6.9158 6.9280 7.1058 7.1888 7.2509 7.3429 7.4109 7.5165 7.7781 7.8603 7.9252 8.0717 8.6590 8.6773 8.7072 8.7431 9.0456 9.0954 9.1676 9.2660 10.2161 10.3928 10.4163 10.5125 10.7426 10.8084 10.8720 10.8753 11.2811 11.3816 11.4252 11.5019 12.6128 12.6263 12.7548 12.7684 13.0471 13.1292 13.1811 13.1892 k = 0.0000 0.4800-0.0000 ( 8978 PWs) bands (ev): -31.1774 -31.1774 -31.1768 -31.1768 -31.1694 -31.1694 -31.1693 -31.1693 -12.4689 -12.4685 -12.4666 -12.4663 -12.4374 -12.4371 -12.4348 -12.4346 -12.1163 -12.1154 -12.1028 -12.1020 -12.0890 -12.0864 -12.0700 -12.0698 -12.0617 -12.0612 -12.0579 -12.0548 -12.0448 -12.0436 -12.0434 -12.0421 0.3777 0.3793 0.4665 0.4689 1.6984 1.7113 1.7207 1.7334 4.0537 4.0704 4.2260 4.2449 4.2820 4.2995 4.3980 4.4067 4.6535 4.7104 4.9379 4.9973 5.1348 5.1750 5.1770 5.2013 5.3944 5.4077 5.5301 5.5602 5.5731 5.5833 5.8751 5.9142 6.1932 6.2180 6.3563 6.3748 6.4172 6.4270 6.4303 6.4424 6.6760 6.7140 6.8918 6.9082 6.9101 6.9215 7.1268 7.1684 7.2790 7.3262 7.4414 7.4944 7.7856 7.8270 7.9523 8.0258 8.6677 8.6771 8.7197 8.7385 9.0574 9.0826 9.1918 9.2419 10.2645 10.3531 10.4514 10.4995 10.7737 10.8169 10.8386 10.8500 11.3193 11.3920 11.4140 11.4744 12.6581 12.6728 12.7297 12.7444 13.0764 13.1454 13.1565 13.2095 k = 0.0000 0.5000-0.0000 ( 8930 PWs) bands (ev): -31.1771 -31.1771 -31.1771 -31.1771 -31.1693 -31.1693 -31.1693 -31.1693 -12.4686 -12.4686 -12.4664 -12.4664 -12.4360 -12.4360 -12.4358 -12.4358 -12.1158 -12.1158 -12.1024 -12.1024 -12.0877 -12.0877 -12.0697 -12.0697 -12.0615 -12.0615 -12.0563 -12.0563 -12.0441 -12.0441 -12.0428 -12.0428 0.4218 0.4218 0.4238 0.4238 1.7098 1.7098 1.7227 1.7227 4.0622 4.0622 4.2360 4.2360 4.2908 4.2908 4.4026 4.4026 4.6813 4.6813 4.9676 4.9676 5.1555 5.1555 5.1877 5.1877 5.4005 5.4005 5.5450 5.5450 5.5779 5.5779 5.8944 5.8944 6.2052 6.2052 6.3674 6.3674 6.4222 6.4222 6.4346 6.4346 6.6957 6.6957 6.9001 6.9001 6.9155 6.9155 7.1477 7.1477 7.3045 7.3045 7.4694 7.4694 7.8019 7.8019 7.9859 7.9859 8.6738 8.6738 8.7304 8.7304 9.0699 9.0699 9.2168 9.2168 10.3102 10.3102 10.4793 10.4793 10.8058 10.8058 10.8306 10.8306 11.3566 11.3566 11.4450 11.4450 12.6974 12.6974 12.7124 12.7124 13.1094 13.1094 13.1860 13.1860 k = 0.0000 0.5000-0.0000 ( 8930 PWs) bands (ev): -31.1771 -31.1771 -31.1771 -31.1771 -31.1693 -31.1693 -31.1693 -31.1693 -12.4686 -12.4686 -12.4664 -12.4664 -12.4360 -12.4360 -12.4358 -12.4358 -12.1158 -12.1158 -12.1024 -12.1024 -12.0877 -12.0877 -12.0697 -12.0697 -12.0615 -12.0615 -12.0563 -12.0563 -12.0441 -12.0441 -12.0428 -12.0428 0.4218 0.4218 0.4238 0.4238 1.7098 1.7098 1.7227 1.7227 4.0622 4.0622 4.2360 4.2360 4.2908 4.2908 4.4026 4.4026 4.6813 4.6813 4.9676 4.9676 5.1555 5.1555 5.1877 5.1877 5.4005 5.4005 5.5450 5.5450 5.5779 5.5779 5.8944 5.8944 6.2052 6.2052 6.3674 6.3674 6.4222 6.4222 6.4346 6.4346 6.6957 6.6957 6.9001 6.9001 6.9155 6.9155 7.1477 7.1477 7.3045 7.3045 7.4694 7.4694 7.8019 7.8019 7.9859 7.9859 8.6738 8.6738 8.7304 8.7304 9.0699 9.0699 9.2168 9.2168 10.3102 10.3102 10.4793 10.4793 10.8058 10.8058 10.8306 10.8306 11.3566 11.3566 11.4450 11.4450 12.6974 12.6974 12.7124 12.7124 13.1094 13.1094 13.1860 13.1860 k = 0.0200 0.5000-0.0000 ( 8974 PWs) bands (ev): -31.1771 -31.1771 -31.1771 -31.1771 -31.1693 -31.1693 -31.1693 -31.1693 -12.4687 -12.4687 -12.4664 -12.4664 -12.4361 -12.4361 -12.4359 -12.4359 -12.1159 -12.1159 -12.1024 -12.1024 -12.0877 -12.0877 -12.0698 -12.0698 -12.0617 -12.0617 -12.0562 -12.0562 -12.0445 -12.0445 -12.0424 -12.0424 0.4224 0.4224 0.4245 0.4245 1.7089 1.7089 1.7217 1.7217 4.0629 4.0629 4.2366 4.2366 4.2904 4.2904 4.4036 4.4036 4.6812 4.6812 4.9675 4.9675 5.1529 5.1529 5.1893 5.1893 5.4006 5.4006 5.5449 5.5449 5.5779 5.5779 5.8937 5.8937 6.2046 6.2046 6.3675 6.3675 6.4185 6.4185 6.4379 6.4379 6.6948 6.6948 6.8977 6.8977 6.9170 6.9170 7.1435 7.1435 7.3060 7.3060 7.4704 7.4704 7.8050 7.8050 7.9877 7.9877 8.6726 8.6726 8.7294 8.7294 9.0695 9.0695 9.2156 9.2156 10.3092 10.3092 10.4776 10.4776 10.8092 10.8092 10.8345 10.8345 11.3599 11.3599 11.4482 11.4482 12.6961 12.6961 12.7116 12.7116 13.1099 13.1099 13.1864 13.1864 k = 0.0400 0.5000-0.0000 ( 8970 PWs) bands (ev): -31.1771 -31.1771 -31.1771 -31.1771 -31.1693 -31.1693 -31.1693 -31.1693 -12.4686 -12.4686 -12.4663 -12.4663 -12.4362 -12.4362 -12.4359 -12.4359 -12.1158 -12.1158 -12.1023 -12.1023 -12.0877 -12.0877 -12.0699 -12.0699 -12.0622 -12.0622 -12.0559 -12.0559 -12.0451 -12.0451 -12.0417 -12.0417 0.4244 0.4244 0.4269 0.4269 1.7060 1.7060 1.7189 1.7189 4.0648 4.0648 4.2382 4.2382 4.2894 4.2894 4.4066 4.4066 4.6811 4.6811 4.9673 4.9673 5.1466 5.1466 5.1931 5.1931 5.4009 5.4009 5.5445 5.5445 5.5780 5.5780 5.8917 5.8917 6.2030 6.2030 6.3677 6.3677 6.4117 6.4117 6.4439 6.4439 6.6922 6.6922 6.8918 6.8918 6.9198 6.9198 7.1318 7.1318 7.3096 7.3096 7.4735 7.4735 7.8139 7.8139 7.9929 7.9929 8.6691 8.6691 8.7263 8.7263 9.0681 9.0681 9.2120 9.2120 10.3062 10.3062 10.4729 10.4729 10.8194 10.8194 10.8461 10.8461 11.3698 11.3698 11.4575 11.4575 12.6925 12.6925 12.7092 12.7092 13.1113 13.1113 13.1874 13.1874 k = 0.0600 0.5000-0.0000 ( 8970 PWs) bands (ev): -31.1771 -31.1771 -31.1771 -31.1771 -31.1694 -31.1694 -31.1693 -31.1693 -12.4685 -12.4685 -12.4663 -12.4663 -12.4364 -12.4364 -12.4359 -12.4359 -12.1157 -12.1157 -12.1022 -12.1022 -12.0878 -12.0878 -12.0701 -12.0701 -12.0628 -12.0628 -12.0555 -12.0555 -12.0457 -12.0457 -12.0409 -12.0409 0.4278 0.4278 0.4307 0.4307 1.7013 1.7013 1.7143 1.7143 4.0681 4.0681 4.2408 4.2408 4.2879 4.2879 4.4115 4.4115 4.6809 4.6809 4.9669 4.9669 5.1383 5.1383 5.1974 5.1974 5.4010 5.4010 5.5440 5.5440 5.5781 5.5781 5.8885 5.8885 6.2006 6.2006 6.3675 6.3675 6.4042 6.4042 6.4501 6.4501 6.6880 6.6880 6.8841 6.8841 6.9226 6.9226 7.1146 7.1146 7.3139 7.3139 7.4786 7.4786 7.8282 7.8282 8.0015 8.0015 8.6633 8.6633 8.7214 8.7214 9.0656 9.0656 9.2065 9.2065 10.3019 10.3019 10.4656 10.4656 10.8364 10.8364 10.8645 10.8645 11.3859 11.3859 11.4728 11.4728 12.6869 12.6869 12.7051 12.7051 13.1136 13.1136 13.1887 13.1887 k = 0.0800 0.5000-0.0000 ( 8970 PWs) bands (ev): -31.1771 -31.1771 -31.1771 -31.1771 -31.1694 -31.1694 -31.1694 -31.1694 -12.4684 -12.4684 -12.4661 -12.4661 -12.4366 -12.4366 -12.4360 -12.4360 -12.1155 -12.1155 -12.1020 -12.1020 -12.0878 -12.0878 -12.0703 -12.0703 -12.0635 -12.0635 -12.0552 -12.0552 -12.0461 -12.0461 -12.0401 -12.0401 0.4325 0.4325 0.4360 0.4360 1.6948 1.6948 1.7079 1.7079 4.0725 4.0725 4.2442 4.2442 4.2861 4.2861 4.4182 4.4182 4.6806 4.6806 4.9664 4.9664 5.1291 5.1291 5.2013 5.2013 5.4008 5.4008 5.5434 5.5434 5.5784 5.5784 5.8840 5.8840 6.1975 6.1975 6.3661 6.3661 6.3970 6.3970 6.4561 6.4561 6.6825 6.6825 6.8751 6.8751 6.9247 6.9247 7.0942 7.0942 7.3178 7.3178 7.4857 7.4857 7.8470 7.8470 8.0128 8.0128 8.6551 8.6551 8.7149 8.7149 9.0615 9.0615 9.1995 9.1995 10.2970 10.2970 10.4565 10.4565 10.8598 10.8598 10.8892 10.8892 11.4078 11.4078 11.4936 11.4936 12.6795 12.6795 12.6993 12.6993 13.1164 13.1164 13.1899 13.1899 k = 0.1000 0.5000-0.0000 ( 8964 PWs) bands (ev): -31.1770 -31.1770 -31.1770 -31.1770 -31.1694 -31.1694 -31.1694 -31.1694 -12.4682 -12.4682 -12.4660 -12.4660 -12.4369 -12.4369 -12.4362 -12.4362 -12.1153 -12.1153 -12.1017 -12.1017 -12.0879 -12.0879 -12.0707 -12.0707 -12.0642 -12.0642 -12.0551 -12.0551 -12.0463 -12.0463 -12.0393 -12.0393 0.4386 0.4386 0.4426 0.4426 1.6866 1.6866 1.6997 1.6997 4.0779 4.0779 4.2479 4.2479 4.2847 4.2847 4.4266 4.4266 4.6801 4.6801 4.9658 4.9658 5.1195 5.1195 5.2046 5.2046 5.3996 5.3996 5.5431 5.5431 5.5790 5.5790 5.8786 5.8786 6.1938 6.1938 6.3624 6.3624 6.3910 6.3910 6.4618 6.4618 6.6760 6.6760 6.8649 6.8649 6.9256 6.9256 7.0724 7.0724 7.3209 7.3209 7.4946 7.4946 7.8694 7.8694 8.0265 8.0265 8.6446 8.6446 8.7071 8.7071 9.0553 9.0553 9.1916 9.1916 10.2925 10.2925 10.4465 10.4465 10.8892 10.8892 10.9193 10.9193 11.4349 11.4349 11.5194 11.5194 12.6708 12.6708 12.6919 12.6919 13.1195 13.1195 13.1907 13.1907 k = 0.1200 0.5000-0.0000 ( 8970 PWs) bands (ev): -31.1770 -31.1770 -31.1770 -31.1770 -31.1695 -31.1695 -31.1694 -31.1694 -12.4681 -12.4681 -12.4658 -12.4658 -12.4372 -12.4372 -12.4364 -12.4364 -12.1151 -12.1151 -12.1014 -12.1014 -12.0879 -12.0879 -12.0711 -12.0711 -12.0649 -12.0649 -12.0552 -12.0552 -12.0462 -12.0462 -12.0386 -12.0386 0.4460 0.4460 0.4505 0.4505 1.6767 1.6767 1.6900 1.6900 4.0841 4.0841 4.2514 4.2514 4.2842 4.2842 4.4366 4.4366 4.6794 4.6794 4.9650 4.9650 5.1099 5.1099 5.2072 5.2072 5.3971 5.3971 5.5429 5.5429 5.5800 5.5800 5.8723 5.8723 6.1898 6.1898 6.3559 6.3559 6.3866 6.3866 6.4666 6.4666 6.6689 6.6689 6.8539 6.8539 6.9251 6.9251 7.0505 7.0505 7.3233 7.3233 7.5047 7.5047 7.8945 7.8945 8.0421 8.0421 8.6320 8.6320 8.6984 8.6984 9.0466 9.0466 9.1833 9.1833 10.2892 10.2892 10.4364 10.4364 10.9240 10.9240 10.9544 10.9544 11.4664 11.4664 11.5494 11.5494 12.6612 12.6612 12.6832 12.6832 13.1221 13.1221 13.1906 13.1906 k = 0.1400 0.5000-0.0000 ( 8968 PWs) bands (ev): -31.1769 -31.1769 -31.1769 -31.1769 -31.1695 -31.1695 -31.1695 -31.1695 -12.4678 -12.4678 -12.4656 -12.4656 -12.4376 -12.4376 -12.4366 -12.4366 -12.1148 -12.1148 -12.1011 -12.1011 -12.0881 -12.0881 -12.0716 -12.0716 -12.0655 -12.0655 -12.0556 -12.0556 -12.0459 -12.0459 -12.0379 -12.0379 0.4546 0.4546 0.4597 0.4597 1.6652 1.6652 1.6787 1.6787 4.0910 4.0910 4.2534 4.2534 4.2859 4.2859 4.4481 4.4481 4.6785 4.6785 4.9641 4.9641 5.1009 5.1009 5.2090 5.2090 5.3929 5.3929 5.5428 5.5428 5.5817 5.5817 5.8655 5.8655 6.1852 6.1852 6.3471 6.3471 6.3833 6.3833 6.4704 6.4704 6.6619 6.6619 6.8422 6.8422 6.9226 6.9226 7.0300 7.0300 7.3253 7.3253 7.5158 7.5158 7.9213 7.9213 8.0591 8.0591 8.6176 8.6176 8.6889 8.6889 9.0352 9.0352 9.1748 9.1748 10.2879 10.2879 10.4270 10.4270 10.9635 10.9635 10.9938 10.9938 11.5017 11.5017 11.5831 11.5831 12.6508 12.6508 12.6732 12.6732 13.1234 13.1234 13.1888 13.1888 k = 0.1600 0.5000-0.0000 ( 8970 PWs) bands (ev): -31.1769 -31.1769 -31.1769 -31.1769 -31.1696 -31.1696 -31.1695 -31.1695 -12.4676 -12.4676 -12.4654 -12.4654 -12.4379 -12.4379 -12.4369 -12.4369 -12.1144 -12.1144 -12.1007 -12.1007 -12.0883 -12.0883 -12.0722 -12.0722 -12.0661 -12.0661 -12.0562 -12.0562 -12.0454 -12.0454 -12.0373 -12.0373 0.4644 0.4644 0.4700 0.4700 1.6524 1.6524 1.6659 1.6659 4.0983 4.0983 4.2533 4.2533 4.2904 4.2904 4.4611 4.4611 4.6773 4.6773 4.9632 4.9632 5.0924 5.0924 5.2104 5.2104 5.3868 5.3868 5.5423 5.5423 5.5847 5.5847 5.8586 5.8586 6.1801 6.1801 6.3369 6.3369 6.3803 6.3803 6.4725 6.4725 6.6556 6.6556 6.8300 6.8300 6.9175 6.9175 7.0117 7.0117 7.3274 7.3274 7.5272 7.5272 7.9491 7.9491 8.0770 8.0770 8.6016 8.6016 8.6789 8.6789 9.0213 9.0213 9.1661 9.1661 10.2892 10.2892 10.4192 10.4192 11.0071 11.0071 11.0373 11.0373 11.5402 11.5402 11.6198 11.6198 12.6400 12.6400 12.6622 12.6622 13.1220 13.1220 13.1842 13.1842 k = 0.1800 0.5000-0.0000 ( 8972 PWs) bands (ev): -31.1768 -31.1768 -31.1768 -31.1768 -31.1696 -31.1696 -31.1696 -31.1696 -12.4673 -12.4673 -12.4651 -12.4651 -12.4384 -12.4384 -12.4372 -12.4372 -12.1140 -12.1140 -12.1002 -12.1002 -12.0885 -12.0885 -12.0729 -12.0729 -12.0666 -12.0666 -12.0569 -12.0569 -12.0447 -12.0447 -12.0367 -12.0367 0.4753 0.4753 0.4814 0.4814 1.6383 1.6383 1.6519 1.6519 4.1058 4.1058 4.2514 4.2514 4.2975 4.2975 4.4753 4.4753 4.6759 4.6759 4.9622 4.9622 5.0849 5.0849 5.2113 5.2113 5.3787 5.3787 5.5409 5.5409 5.5891 5.5891 5.8518 5.8518 6.1739 6.1739 6.3261 6.3261 6.3772 6.3772 6.4725 6.4725 6.6507 6.6507 6.8174 6.8174 6.9095 6.9095 6.9964 6.9964 7.3302 7.3302 7.5385 7.5385 7.9771 7.9771 8.0956 8.0956 8.5845 8.5845 8.6684 8.6684 9.0052 9.0052 9.1568 9.1568 10.2935 10.2935 10.4137 10.4137 11.0542 11.0542 11.0841 11.0841 11.5810 11.5810 11.6588 11.6588 12.6289 12.6289 12.6504 12.6504 13.1166 13.1166 13.1751 13.1751 k = 0.2000 0.5000-0.0000 ( 8974 PWs) bands (ev): -31.1768 -31.1768 -31.1768 -31.1768 -31.1697 -31.1697 -31.1697 -31.1697 -12.4670 -12.4670 -12.4648 -12.4648 -12.4388 -12.4388 -12.4376 -12.4376 -12.1136 -12.1136 -12.0997 -12.0997 -12.0888 -12.0888 -12.0735 -12.0735 -12.0670 -12.0670 -12.0577 -12.0577 -12.0440 -12.0440 -12.0361 -12.0361 0.4872 0.4872 0.4937 0.4937 1.6231 1.6231 1.6367 1.6367 4.1133 4.1133 4.2482 4.2482 4.3065 4.3065 4.4907 4.4907 4.6740 4.6740 4.9611 4.9611 5.0785 5.0785 5.2120 5.2120 5.3688 5.3688 5.5382 5.5382 5.5952 5.5952 5.8457 5.8457 6.1665 6.1665 6.3151 6.3151 6.3737 6.3737 6.4703 6.4703 6.6477 6.6477 6.8047 6.8047 6.8987 6.8987 6.9841 6.9841 7.3338 7.3338 7.5494 7.5494 8.0050 8.0050 8.1146 8.1146 8.5669 8.5669 8.6574 8.6574 8.9876 8.9876 9.1463 9.1463 10.3011 10.3011 10.4109 10.4109 11.1043 11.1043 11.1340 11.1340 11.6238 11.6238 11.6996 11.6996 12.6175 12.6175 12.6381 12.6381 13.1058 13.1058 13.1598 13.1598 k = 0.2200 0.5000-0.0000 ( 8966 PWs) bands (ev): -31.1767 -31.1767 -31.1767 -31.1767 -31.1697 -31.1697 -31.1697 -31.1697 -12.4667 -12.4667 -12.4645 -12.4645 -12.4392 -12.4392 -12.4379 -12.4379 -12.1131 -12.1131 -12.0992 -12.0992 -12.0892 -12.0892 -12.0742 -12.0742 -12.0674 -12.0674 -12.0585 -12.0585 -12.0432 -12.0432 -12.0356 -12.0356 0.5000 0.5000 0.5069 0.5069 1.6070 1.6070 1.6206 1.6206 4.1206 4.1206 4.2443 4.2443 4.3169 4.3169 4.5071 4.5071 4.6720 4.6720 4.9601 4.9601 5.0732 5.0732 5.2128 5.2128 5.3571 5.3571 5.5339 5.5339 5.6029 5.6029 5.8407 5.8407 6.1575 6.1575 6.3040 6.3040 6.3699 6.3699 6.4657 6.4657 6.6469 6.6469 6.7921 6.7921 6.8858 6.8858 6.9741 6.9741 7.3385 7.3385 7.5593 7.5593 8.0323 8.0323 8.1338 8.1338 8.5493 8.5493 8.6459 8.6459 8.9689 8.9689 9.1342 9.1342 10.3120 10.3120 10.4115 10.4115 11.1569 11.1569 11.1862 11.1862 11.6680 11.6680 11.7417 11.7417 12.6059 12.6059 12.6255 12.6255 13.0891 13.0891 13.1377 13.1377 k = 0.2400 0.5000-0.0000 ( 8974 PWs) bands (ev): -31.1766 -31.1766 -31.1766 -31.1766 -31.1698 -31.1698 -31.1698 -31.1698 -12.4663 -12.4663 -12.4642 -12.4642 -12.4397 -12.4397 -12.4384 -12.4384 -12.1126 -12.1126 -12.0986 -12.0986 -12.0896 -12.0896 -12.0749 -12.0749 -12.0678 -12.0678 -12.0594 -12.0594 -12.0424 -12.0424 -12.0351 -12.0351 0.5135 0.5135 0.5207 0.5207 1.5902 1.5902 1.6037 1.6037 4.1276 4.1276 4.2400 4.2400 4.3282 4.3282 4.5239 4.5239 4.6699 4.6699 4.9592 4.9592 5.0691 5.0691 5.2137 5.2137 5.3440 5.3440 5.5279 5.5279 5.6120 5.6120 5.8370 5.8370 6.1466 6.1466 6.2928 6.2928 6.3661 6.3661 6.4592 6.4592 6.6481 6.6481 6.7798 6.7798 6.8719 6.8719 6.9654 6.9654 7.3445 7.3445 7.5680 7.5680 8.0589 8.0589 8.1531 8.1531 8.5322 8.5322 8.6341 8.6341 8.9496 8.9496 9.1200 9.1200 10.3258 10.3258 10.4157 10.4157 11.2111 11.2111 11.2404 11.2404 11.7131 11.7131 11.7844 11.7844 12.5938 12.5938 12.6129 12.6129 13.0667 13.0667 13.1092 13.1092 k = 0.2600 0.5000-0.0000 ( 8982 PWs) bands (ev): -31.1766 -31.1766 -31.1766 -31.1766 -31.1699 -31.1699 -31.1699 -31.1699 -12.4660 -12.4660 -12.4639 -12.4639 -12.4402 -12.4402 -12.4388 -12.4388 -12.1120 -12.1120 -12.0980 -12.0980 -12.0902 -12.0902 -12.0756 -12.0756 -12.0681 -12.0681 -12.0603 -12.0603 -12.0416 -12.0416 -12.0348 -12.0348 0.5275 0.5275 0.5350 0.5350 1.5729 1.5729 1.5862 1.5862 4.1342 4.1342 4.2354 4.2354 4.3403 4.3403 4.5407 4.5407 4.6683 4.6683 4.9582 4.9582 5.0662 5.0662 5.2149 5.2149 5.3299 5.3299 5.5203 5.5203 5.6221 5.6221 5.8349 5.8349 6.1340 6.1340 6.2813 6.2813 6.3624 6.3624 6.4514 6.4514 6.6511 6.6511 6.7681 6.7681 6.8578 6.8578 6.9571 6.9571 7.3518 7.3518 7.5751 7.5751 8.0844 8.0844 8.1724 8.1724 8.5162 8.5162 8.6221 8.6221 8.9300 8.9300 9.1034 9.1034 10.3424 10.3424 10.4238 10.4238 11.2663 11.2663 11.2958 11.2958 11.7589 11.7589 11.8275 11.8275 12.5810 12.5810 12.6004 12.6004 13.0397 13.0397 13.0756 13.0756 k = 0.2800 0.5000-0.0000 ( 8990 PWs) bands (ev): -31.1765 -31.1765 -31.1765 -31.1765 -31.1700 -31.1700 -31.1700 -31.1700 -12.4656 -12.4656 -12.4636 -12.4636 -12.4407 -12.4407 -12.4393 -12.4393 -12.1114 -12.1114 -12.0973 -12.0973 -12.0908 -12.0908 -12.0763 -12.0763 -12.0684 -12.0684 -12.0611 -12.0611 -12.0408 -12.0408 -12.0344 -12.0344 0.5420 0.5420 0.5496 0.5496 1.5554 1.5554 1.5684 1.5684 4.1403 4.1403 4.2308 4.2308 4.3529 4.3529 4.5561 4.5561 4.6682 4.6682 4.9572 4.9572 5.0644 5.0644 5.2165 5.2165 5.3152 5.3152 5.5112 5.5112 5.6331 5.6331 5.8345 5.8345 6.1196 6.1196 6.2688 6.2688 6.3592 6.3592 6.4430 6.4430 6.6552 6.6552 6.7573 6.7573 6.8442 6.8442 6.9488 6.9488 7.3605 7.3605 7.5804 7.5804 8.1088 8.1088 8.1916 8.1916 8.5016 8.5016 8.6102 8.6102 8.9103 8.9103 9.0844 9.0844 10.3611 10.3611 10.4355 10.4355 11.3217 11.3217 11.3520 11.3520 11.8048 11.8048 11.8707 11.8707 12.5672 12.5672 12.5881 12.5881 13.0093 13.0093 13.0387 13.0387 k = 0.3000 0.5000-0.0000 ( 9000 PWs) bands (ev): -31.1764 -31.1764 -31.1764 -31.1764 -31.1701 -31.1701 -31.1700 -31.1700 -12.4652 -12.4652 -12.4632 -12.4632 -12.4412 -12.4412 -12.4397 -12.4397 -12.1107 -12.1107 -12.0967 -12.0967 -12.0914 -12.0914 -12.0770 -12.0770 -12.0687 -12.0687 -12.0619 -12.0619 -12.0400 -12.0400 -12.0341 -12.0341 0.5567 0.5567 0.5642 0.5642 1.5379 1.5379 1.5505 1.5505 4.1460 4.1460 4.2260 4.2260 4.3658 4.3658 4.5686 4.5686 4.6712 4.6712 4.9559 4.9559 5.0636 5.0636 5.2181 5.2181 5.3006 5.3006 5.5007 5.5007 5.6448 5.6448 5.8358 5.8358 6.1040 6.1040 6.2550 6.2550 6.3568 6.3568 6.4346 6.4346 6.6599 6.6599 6.7477 6.7477 6.8314 6.8314 6.9400 6.9400 7.3704 7.3704 7.5836 7.5836 8.1319 8.1319 8.2104 8.2104 8.4890 8.4890 8.5988 8.5988 8.8906 8.8906 9.0630 9.0630 10.3815 10.3815 10.4506 10.4506 11.3761 11.3761 11.4083 11.4083 11.8507 11.8507 11.9139 11.9139 12.5524 12.5524 12.5757 12.5757 12.9771 12.9771 13.0003 13.0003 k = 0.3200 0.5000-0.0000 ( 9002 PWs) bands (ev): -31.1763 -31.1763 -31.1763 -31.1763 -31.1701 -31.1701 -31.1701 -31.1701 -12.4648 -12.4648 -12.4629 -12.4629 -12.4416 -12.4416 -12.4402 -12.4402 -12.1100 -12.1100 -12.0961 -12.0961 -12.0920 -12.0920 -12.0778 -12.0778 -12.0688 -12.0688 -12.0626 -12.0626 -12.0393 -12.0393 -12.0339 -12.0339 0.5713 0.5713 0.5788 0.5788 1.5207 1.5207 1.5328 1.5328 4.1511 4.1511 4.2213 4.2213 4.3791 4.3791 4.5761 4.5761 4.6791 4.6791 4.9542 4.9542 5.0638 5.0638 5.2189 5.2189 5.2875 5.2875 5.4889 5.4889 5.6571 5.6571 5.8385 5.8385 6.0877 6.0877 6.2396 6.2396 6.3555 6.3555 6.4265 6.4265 6.6646 6.6646 6.7396 6.7396 6.8199 6.8199 6.9307 6.9307 7.3815 7.3815 7.5847 7.5847 8.1537 8.1537 8.2286 8.2286 8.4788 8.4788 8.5884 8.5884 8.8712 8.8712 9.0395 9.0395 10.4031 10.4031 10.4682 10.4682 11.4286 11.4286 11.4638 11.4638 11.8962 11.8962 11.9573 11.9573 12.5364 12.5364 12.5628 12.5628 12.9442 12.9442 12.9621 12.9621 k = 0.3400 0.5000-0.0000 ( 8990 PWs) bands (ev): -31.1763 -31.1763 -31.1763 -31.1763 -31.1702 -31.1702 -31.1702 -31.1702 -12.4644 -12.4644 -12.4626 -12.4626 -12.4420 -12.4420 -12.4407 -12.4407 -12.1093 -12.1093 -12.0957 -12.0957 -12.0924 -12.0924 -12.0786 -12.0786 -12.0689 -12.0689 -12.0633 -12.0633 -12.0385 -12.0385 -12.0337 -12.0337 0.5856 0.5856 0.5929 0.5929 1.5041 1.5041 1.5155 1.5155 4.1558 4.1558 4.2167 4.2167 4.3925 4.3925 4.5779 4.5779 4.6926 4.6926 4.9516 4.9516 5.0649 5.0649 5.2171 5.2171 5.2781 5.2781 5.4761 5.4761 5.6700 5.6700 5.8421 5.8421 6.0715 6.0715 6.2225 6.2225 6.3551 6.3551 6.4191 6.4191 6.6687 6.6687 6.7331 6.7331 6.8100 6.8100 6.9207 6.9207 7.3936 7.3936 7.5835 7.5835 8.1739 8.1739 8.2456 8.2456 8.4715 8.4715 8.5795 8.5795 8.8523 8.8523 9.0140 9.0140 10.4256 10.4256 10.4874 10.4874 11.4784 11.4784 11.5174 11.5174 11.9410 11.9410 12.0010 12.0010 12.5191 12.5191 12.5489 12.5489 12.9119 12.9119 12.9261 12.9261 k = 0.3600 0.5000-0.0000 ( 9002 PWs) bands (ev): -31.1762 -31.1762 -31.1762 -31.1762 -31.1703 -31.1703 -31.1702 -31.1702 -12.4640 -12.4640 -12.4624 -12.4624 -12.4424 -12.4424 -12.4411 -12.4411 -12.1085 -12.1085 -12.0958 -12.0958 -12.0925 -12.0925 -12.0794 -12.0794 -12.0690 -12.0690 -12.0639 -12.0639 -12.0379 -12.0379 -12.0336 -12.0336 0.5994 0.5994 0.6063 0.6063 1.4885 1.4885 1.4990 1.4990 4.1601 4.1601 4.2121 4.2121 4.4060 4.4060 4.5747 4.5747 4.7108 4.7108 4.9480 4.9480 5.0668 5.0668 5.2102 5.2102 5.2751 5.2751 5.4624 5.4624 5.6836 5.6836 5.8458 5.8458 6.0563 6.0563 6.2039 6.2039 6.3557 6.3557 6.4123 6.4123 6.6718 6.6718 6.7280 6.7280 6.8025 6.8025 6.9103 6.9103 7.4067 7.4067 7.5801 7.5801 8.1925 8.1925 8.2607 8.2607 8.4675 8.4675 8.5722 8.5722 8.8343 8.8343 8.9870 8.9870 10.4485 10.4485 10.5070 10.5070 11.5247 11.5247 11.5677 11.5677 11.9850 11.9850 12.0455 12.0455 12.5003 12.5003 12.5335 12.5335 12.8809 12.8809 12.8935 12.8935 k = 0.3800 0.5000-0.0000 ( 8998 PWs) bands (ev): -31.1761 -31.1761 -31.1761 -31.1761 -31.1703 -31.1703 -31.1703 -31.1703 -12.4636 -12.4636 -12.4621 -12.4621 -12.4428 -12.4428 -12.4416 -12.4416 -12.1076 -12.1076 -12.0963 -12.0963 -12.0920 -12.0920 -12.0803 -12.0803 -12.0689 -12.0689 -12.0645 -12.0645 -12.0372 -12.0372 -12.0335 -12.0335 0.6124 0.6124 0.6187 0.6187 1.4741 1.4741 1.4835 1.4835 4.1641 4.1641 4.2077 4.2077 4.4195 4.4195 4.5681 4.5681 4.7320 4.7320 4.9428 4.9428 5.0697 5.0697 5.1984 5.1984 5.2785 5.2785 5.4480 5.4480 5.6978 5.6978 5.8485 5.8485 6.0433 6.0433 6.1841 6.1841 6.3572 6.3572 6.4061 6.4061 6.6740 6.6740 6.7237 6.7237 6.7978 6.7978 6.8993 6.8993 7.4205 7.4205 7.5746 7.5746 8.2093 8.2093 8.2731 8.2731 8.4674 8.4674 8.5668 8.5668 8.8177 8.8177 8.9589 8.9589 10.4714 10.4714 10.5258 10.5258 11.5670 11.5670 11.6130 11.6130 12.0281 12.0281 12.0906 12.0906 12.4798 12.4798 12.5161 12.5161 12.8526 12.8526 12.8651 12.8651 k = 0.4000 0.5000-0.0000 ( 8994 PWs) bands (ev): -31.1761 -31.1761 -31.1761 -31.1761 -31.1704 -31.1704 -31.1704 -31.1704 -12.4632 -12.4632 -12.4619 -12.4619 -12.4430 -12.4430 -12.4420 -12.4420 -12.1068 -12.1068 -12.0971 -12.0971 -12.0913 -12.0913 -12.0813 -12.0813 -12.0688 -12.0688 -12.0651 -12.0651 -12.0366 -12.0366 -12.0335 -12.0335 0.6242 0.6242 0.6298 0.6298 1.4613 1.4613 1.4696 1.4696 4.1677 4.1677 4.2035 4.2035 4.4330 4.4330 4.5592 4.5592 4.7549 4.7549 4.9359 4.9359 5.0736 5.0736 5.1838 5.1838 5.2866 5.2866 5.4331 5.4331 5.7129 5.7129 5.8489 5.8489 6.0341 6.0341 6.1635 6.1635 6.3593 6.3593 6.4005 6.4005 6.6758 6.6758 6.7193 6.7193 6.7966 6.7966 6.8880 6.8880 7.4348 7.4348 7.5672 7.5672 8.2244 8.2244 8.2819 8.2819 8.4715 8.4715 8.5628 8.5628 8.8034 8.8034 8.9303 8.9303 10.4935 10.4935 10.5426 10.5426 11.6049 11.6049 11.6517 11.6517 12.0706 12.0706 12.1359 12.1359 12.4573 12.4573 12.4968 12.4968 12.8280 12.8280 12.8408 12.8408 k = 0.4200 0.5000-0.0000 ( 8992 PWs) bands (ev): -31.1760 -31.1760 -31.1760 -31.1760 -31.1704 -31.1704 -31.1704 -31.1704 -12.4628 -12.4628 -12.4618 -12.4618 -12.4433 -12.4433 -12.4424 -12.4424 -12.1059 -12.1059 -12.0980 -12.0980 -12.0904 -12.0904 -12.0823 -12.0823 -12.0686 -12.0686 -12.0656 -12.0656 -12.0360 -12.0360 -12.0336 -12.0336 0.6345 0.6345 0.6392 0.6392 1.4505 1.4505 1.4574 1.4574 4.1712 4.1712 4.1994 4.1994 4.4466 4.4466 4.5488 4.5488 4.7786 4.7786 4.9268 4.9268 5.0787 5.0787 5.1682 5.1682 5.2975 5.2975 5.4178 5.4178 5.7286 5.7286 5.8457 5.8457 6.0299 6.0299 6.1426 6.1426 6.3620 6.3620 6.3952 6.3952 6.6775 6.6775 6.7142 6.7142 6.7988 6.7988 6.8764 6.8764 7.4496 7.4496 7.5581 7.5581 8.2378 8.2378 8.2870 8.2870 8.4795 8.4795 8.5595 8.5595 8.7927 8.7927 8.9019 8.9019 10.5144 10.5144 10.5565 10.5565 11.6380 11.6380 11.6825 11.6825 12.1130 12.1130 12.1805 12.1805 12.4328 12.4328 12.4755 12.4755 12.8080 12.8080 12.8204 12.8204 k = 0.4400 0.5000-0.0000 ( 8988 PWs) bands (ev): -31.1760 -31.1760 -31.1760 -31.1760 -31.1704 -31.1704 -31.1704 -31.1704 -12.4625 -12.4625 -12.4617 -12.4617 -12.4434 -12.4434 -12.4427 -12.4427 -12.1049 -12.1049 -12.0990 -12.0990 -12.0894 -12.0894 -12.0833 -12.0833 -12.0684 -12.0684 -12.0661 -12.0661 -12.0355 -12.0355 -12.0337 -12.0337 0.6431 0.6431 0.6468 0.6468 1.4419 1.4419 1.4472 1.4472 4.1746 4.1746 4.1954 4.1954 4.4600 4.4600 4.5374 4.5374 4.8022 4.8022 4.9155 4.9155 5.0850 5.0850 5.1528 5.1528 5.3103 5.3103 5.4021 5.4021 5.7451 5.7451 5.8383 5.8383 6.0314 6.0314 6.1217 6.1217 6.3652 6.3652 6.3902 6.3902 6.6796 6.6796 6.7085 6.7085 6.8040 6.8040 6.8647 6.8647 7.4645 7.4645 7.5474 7.5474 8.2496 8.2496 8.2884 8.2884 8.4907 8.4907 8.5557 8.5557 8.7868 8.7868 8.8743 8.8743 10.5331 10.5331 10.5665 10.5665 11.6661 11.6661 11.7043 11.7043 12.1551 12.1551 12.2225 12.2225 12.4068 12.4068 12.4522 12.4522 12.7930 12.7930 12.8038 12.8038 k = 0.4600 0.5000-0.0000 ( 8992 PWs) bands (ev): -31.1760 -31.1760 -31.1760 -31.1760 -31.1705 -31.1705 -31.1705 -31.1705 -12.4622 -12.4622 -12.4617 -12.4617 -12.4435 -12.4435 -12.4430 -12.4430 -12.1040 -12.1040 -12.1000 -12.1000 -12.0885 -12.0885 -12.0843 -12.0843 -12.0681 -12.0681 -12.0666 -12.0666 -12.0351 -12.0351 -12.0339 -12.0339 0.6496 0.6496 0.6522 0.6522 1.4359 1.4359 1.4395 1.4395 4.1779 4.1779 4.1917 4.1917 4.4734 4.4734 4.5253 4.5253 4.8252 4.8252 4.9017 4.9017 5.0927 5.0927 5.1381 5.1381 5.3244 5.3244 5.3863 5.3863 5.7622 5.7622 5.8269 5.8269 6.0383 6.0383 6.1014 6.1014 6.3687 6.3687 6.3855 6.3855 6.6826 6.6826 6.7024 6.7024 6.8115 6.8115 6.8531 6.8531 7.4795 7.4795 7.5355 7.5355 8.2599 8.2599 8.2866 8.2866 8.5039 8.5039 8.5500 8.5500 8.7870 8.7870 8.8486 8.8486 10.5490 10.5490 10.5723 10.5723 11.6890 11.6890 11.7171 11.7171 12.1963 12.1963 12.2583 12.2583 12.3818 12.3818 12.4272 12.4272 12.7830 12.7830 12.7911 12.7911 k = 0.4800 0.5000-0.0000 ( 8986 PWs) bands (ev): -31.1759 -31.1759 -31.1759 -31.1759 -31.1705 -31.1705 -31.1705 -31.1705 -12.4620 -12.4620 -12.4617 -12.4617 -12.4435 -12.4435 -12.4432 -12.4432 -12.1030 -12.1030 -12.1010 -12.1010 -12.0874 -12.0874 -12.0854 -12.0854 -12.0678 -12.0678 -12.0670 -12.0670 -12.0347 -12.0347 -12.0341 -12.0341 0.6539 0.6539 0.6552 0.6552 1.4325 1.4325 1.4344 1.4344 4.1812 4.1812 4.1881 4.1881 4.4867 4.4867 4.5128 4.5128 4.8470 4.8470 4.8856 4.8856 5.1018 5.1018 5.1246 5.1246 5.3393 5.3393 5.3705 5.3705 5.7795 5.7795 5.8127 5.8127 6.0498 6.0498 6.0822 6.0822 6.3726 6.3726 6.3810 6.3810 6.6864 6.6864 6.6965 6.6965 6.8206 6.8206 6.8417 6.8417 7.4943 7.4943 7.5225 7.5225 8.2689 8.2689 8.2825 8.2825 8.5176 8.5176 8.5416 8.5416 8.7939 8.7939 8.8258 8.8258 10.5614 10.5614 10.5733 10.5733 11.7063 11.7063 11.7212 11.7212 12.2348 12.2348 12.2778 12.2778 12.3672 12.3672 12.4012 12.4012 12.7780 12.7780 12.7824 12.7824 k = 0.5000 0.5000-0.0000 ( 8956 PWs) bands (ev): -31.1759 -31.1759 -31.1759 -31.1759 -31.1705 -31.1705 -31.1705 -31.1705 -12.4618 -12.4618 -12.4618 -12.4618 -12.4434 -12.4434 -12.4434 -12.4434 -12.1020 -12.1020 -12.1020 -12.1020 -12.0864 -12.0864 -12.0864 -12.0864 -12.0674 -12.0674 -12.0674 -12.0674 -12.0343 -12.0343 -12.0343 -12.0343 0.6558 0.6558 0.6558 0.6558 1.4320 1.4320 1.4320 1.4320 4.1846 4.1846 4.1846 4.1846 4.4999 4.4999 4.4999 4.4999 4.8673 4.8673 4.8673 4.8673 5.1124 5.1124 5.1124 5.1124 5.3547 5.3547 5.3547 5.3547 5.7965 5.7965 5.7965 5.7965 6.0648 6.0648 6.0648 6.0648 6.3767 6.3767 6.3767 6.3767 6.6911 6.6911 6.6911 6.6911 6.8308 6.8308 6.8308 6.8308 7.5087 7.5087 7.5087 7.5087 8.2764 8.2764 8.2764 8.2764 8.5306 8.5306 8.5306 8.5306 8.8071 8.8071 8.8071 8.8071 10.5696 10.5696 10.5696 10.5696 11.7173 11.7173 11.7173 11.7173 12.2663 12.2663 12.2663 12.2663 12.3772 12.3772 12.3772 12.3772 12.7779 12.7779 12.7779 12.7779 k = 0.5000 0.5000-0.0000 ( 8956 PWs) bands (ev): -31.1759 -31.1759 -31.1759 -31.1759 -31.1705 -31.1705 -31.1705 -31.1705 -12.4618 -12.4618 -12.4618 -12.4618 -12.4434 -12.4434 -12.4434 -12.4434 -12.1020 -12.1020 -12.1020 -12.1020 -12.0864 -12.0864 -12.0864 -12.0864 -12.0674 -12.0674 -12.0674 -12.0674 -12.0343 -12.0343 -12.0343 -12.0343 0.6558 0.6558 0.6558 0.6558 1.4320 1.4320 1.4320 1.4320 4.1846 4.1846 4.1846 4.1846 4.4999 4.4999 4.4999 4.4999 4.8673 4.8673 4.8673 4.8673 5.1124 5.1124 5.1124 5.1124 5.3547 5.3547 5.3547 5.3547 5.7965 5.7965 5.7965 5.7965 6.0648 6.0648 6.0648 6.0648 6.3767 6.3767 6.3767 6.3767 6.6911 6.6911 6.6911 6.6911 6.8308 6.8308 6.8308 6.8308 7.5087 7.5087 7.5087 7.5087 8.2764 8.2764 8.2764 8.2764 8.5306 8.5306 8.5306 8.5306 8.8071 8.8071 8.8071 8.8071 10.5696 10.5696 10.5696 10.5696 11.7173 11.7173 11.7173 11.7173 12.2663 12.2663 12.2663 12.2663 12.3772 12.3772 12.3772 12.3772 12.7779 12.7779 12.7779 12.7779 k = 0.4861 0.4861-0.0000 ( 8982 PWs) bands (ev): -31.1760 -31.1760 -31.1759 -31.1759 -31.1705 -31.1705 -31.1705 -31.1705 -12.4621 -12.4619 -12.4618 -12.4617 -12.4435 -12.4435 -12.4433 -12.4432 -12.1031 -12.1028 -12.1011 -12.1008 -12.0878 -12.0865 -12.0863 -12.0850 -12.0679 -12.0675 -12.0674 -12.0668 -12.0348 -12.0345 -12.0343 -12.0340 0.6522 0.6528 0.6563 0.6571 1.4319 1.4321 1.4343 1.4353 4.1796 4.1841 4.1851 4.1896 4.4842 4.4928 4.5060 4.5158 4.8461 4.8492 4.8846 4.8861 5.0992 5.1024 5.1246 5.1264 5.3342 5.3441 5.3661 5.3752 5.7727 5.7947 5.7976 5.8200 6.0473 6.0554 6.0755 6.0853 6.3667 6.3691 6.3843 6.3871 6.6837 6.6880 6.6941 6.6990 6.8201 6.8270 6.8357 6.8424 7.4942 7.4987 7.5184 7.5216 8.2635 8.2730 8.2805 8.2836 8.5124 8.5302 8.5309 8.5459 8.7900 8.8035 8.8142 8.8335 10.5602 10.5658 10.5684 10.5749 11.7070 11.7114 11.7168 11.7251 12.2208 12.2583 12.2620 12.2817 12.3646 12.3735 12.3788 12.4120 12.7781 12.7803 12.7816 12.7876 k = 0.4722 0.4722-0.0000 ( 8988 PWs) bands (ev): -31.1760 -31.1760 -31.1759 -31.1759 -31.1705 -31.1705 -31.1705 -31.1705 -12.4624 -12.4620 -12.4618 -12.4615 -12.4436 -12.4436 -12.4430 -12.4428 -12.1042 -12.1037 -12.1003 -12.0996 -12.0892 -12.0866 -12.0863 -12.0835 -12.0683 -12.0675 -12.0673 -12.0662 -12.0354 -12.0346 -12.0342 -12.0337 0.6424 0.6436 0.6585 0.6600 1.4323 1.4325 1.4414 1.4434 4.1744 4.1835 4.1853 4.1947 4.4689 4.4851 4.5111 4.5321 4.8228 4.8308 4.9006 4.9024 5.0872 5.0950 5.1385 5.1407 5.3137 5.3345 5.3779 5.3953 5.7494 5.7921 5.7979 5.8416 6.0338 6.0478 6.0874 6.1081 6.3573 6.3617 6.3917 6.3980 6.6769 6.6849 6.6967 6.7073 6.8104 6.8243 6.8417 6.8551 7.4780 7.4890 7.5271 7.5335 8.2446 8.2695 8.2829 8.2878 8.4941 8.5289 8.5314 8.5568 8.7851 8.8036 8.8246 8.8657 10.5467 10.5568 10.5625 10.5759 11.6908 11.7019 11.7102 11.7300 12.1670 12.2216 12.2508 12.2763 12.3526 12.3629 12.4086 12.4500 12.7822 12.7876 12.7952 12.8080 k = 0.4583 0.4583-0.0000 ( 8984 PWs) bands (ev): -31.1761 -31.1761 -31.1759 -31.1759 -31.1705 -31.1705 -31.1704 -31.1704 -12.4628 -12.4622 -12.4618 -12.4615 -12.4437 -12.4436 -12.4426 -12.4423 -12.1053 -12.1045 -12.0995 -12.0985 -12.0904 -12.0866 -12.0862 -12.0821 -12.0686 -12.0676 -12.0673 -12.0655 -12.0360 -12.0347 -12.0341 -12.0335 0.6269 0.6286 0.6623 0.6645 1.4330 1.4334 1.4531 1.4561 4.1691 4.1829 4.1854 4.2000 4.4539 4.4768 4.5149 4.5486 4.7979 4.8124 4.9133 4.9169 5.0772 5.0904 5.1537 5.1549 5.2935 5.3263 5.3898 5.4151 5.7273 5.7888 5.7977 5.8594 6.0253 6.0426 6.1003 6.1327 6.3484 6.3547 6.3988 6.4094 6.6705 6.6823 6.6987 6.7160 6.8015 6.8228 6.8490 6.8689 7.4600 7.4796 7.5342 7.5450 8.2199 8.2632 8.2810 8.2938 8.4779 8.5261 8.5328 8.5643 8.7926 8.8074 8.8377 8.9009 10.5297 10.5426 10.5525 10.5730 11.6667 11.6869 11.7013 11.7293 12.1133 12.1663 12.2351 12.2665 12.3333 12.3501 12.4473 12.4855 12.7888 12.7958 12.8195 12.8365 k = 0.4444 0.4444-0.0000 ( 8990 PWs) bands (ev): -31.1762 -31.1762 -31.1758 -31.1758 -31.1705 -31.1705 -31.1703 -31.1703 -12.4632 -12.4625 -12.4619 -12.4614 -12.4439 -12.4438 -12.4420 -12.4417 -12.1063 -12.1054 -12.0988 -12.0973 -12.0916 -12.0867 -12.0862 -12.0808 -12.0688 -12.0676 -12.0672 -12.0648 -12.0368 -12.0349 -12.0341 -12.0334 0.6061 0.6082 0.6678 0.6707 1.4340 1.4345 1.4688 1.4725 4.1635 4.1825 4.1851 4.2054 4.4392 4.4682 4.5172 4.5651 4.7715 4.7945 4.9215 4.9299 5.0702 5.0890 5.1685 5.1699 5.2744 5.3197 5.4018 5.4344 5.7068 5.7848 5.7969 5.8713 6.0215 6.0421 6.1139 6.1587 6.3401 6.3481 6.4053 6.4213 6.6646 6.6802 6.7000 6.7252 6.7933 6.8223 6.8576 6.8837 7.4403 7.4707 7.5393 7.5564 8.1900 8.2487 8.2800 8.3012 8.4652 8.5224 8.5353 8.5709 8.8086 8.8160 8.8529 8.9372 10.5096 10.5237 10.5390 10.5664 11.6353 11.6642 11.6896 11.7210 12.0645 12.1053 12.2126 12.2508 12.3096 12.3426 12.4837 12.5178 12.7964 12.8041 12.8509 12.8708 k = 0.4306 0.4306-0.0000 ( 8986 PWs) bands (ev): -31.1764 -31.1763 -31.1758 -31.1758 -31.1705 -31.1705 -31.1703 -31.1702 -12.4637 -12.4629 -12.4619 -12.4613 -12.4441 -12.4440 -12.4413 -12.4409 -12.1072 -12.1062 -12.0981 -12.0964 -12.0926 -12.0868 -12.0861 -12.0796 -12.0689 -12.0676 -12.0672 -12.0640 -12.0376 -12.0350 -12.0342 -12.0333 0.5810 0.5834 0.6750 0.6786 1.4353 1.4359 1.4877 1.4921 4.1576 4.1820 4.1845 4.2110 4.4247 4.4594 4.5179 4.5810 4.7443 4.7777 4.9246 4.9406 5.0672 5.0906 5.1801 5.1865 5.2579 5.3152 5.4134 5.4530 5.6883 5.7801 5.7957 5.8767 6.0193 6.0498 6.1281 6.1856 6.3326 6.3422 6.4113 6.4336 6.6592 6.6790 6.7006 6.7346 6.7858 6.8227 6.8678 6.8994 7.4190 7.4623 7.5423 7.5676 8.1560 8.2246 8.2819 8.3098 8.4563 8.5194 8.5392 8.5782 8.8224 8.8361 8.8696 8.9734 10.4866 10.5014 10.5225 10.5565 11.5968 11.6335 11.6687 11.7076 12.0229 12.0435 12.1829 12.2285 12.2884 12.3397 12.5160 12.5471 12.8038 12.8123 12.8869 12.9089 k = 0.4167 0.4167-0.0000 ( 8988 PWs) bands (ev): -31.1765 -31.1765 -31.1757 -31.1757 -31.1705 -31.1705 -31.1702 -31.1702 -12.4643 -12.4633 -12.4620 -12.4613 -12.4444 -12.4442 -12.4405 -12.4401 -12.1081 -12.1070 -12.0974 -12.0959 -12.0931 -12.0868 -12.0861 -12.0785 -12.0689 -12.0676 -12.0670 -12.0632 -12.0386 -12.0351 -12.0344 -12.0332 0.5523 0.5549 0.6838 0.6882 1.4369 1.4376 1.5091 1.5140 4.1513 4.1814 4.1837 4.2168 4.4102 4.4505 4.5169 4.5956 4.7165 4.7629 4.9226 4.9489 5.0690 5.0951 5.1862 5.2031 5.2477 5.3128 5.4246 5.4709 5.6717 5.7747 5.7942 5.8770 6.0167 6.0658 6.1427 6.2127 6.3261 6.3369 6.4168 6.4463 6.6544 6.6784 6.7003 6.7442 6.7791 6.8240 6.8795 6.9160 7.3964 7.4546 7.5433 7.5784 8.1191 8.1931 8.2861 8.3193 8.4506 8.5185 8.5448 8.5869 8.8354 8.8631 8.8871 9.0083 10.4601 10.4768 10.5045 10.5438 11.5511 11.5921 11.6373 11.6922 11.9784 11.9935 12.1487 12.1979 12.2745 12.3386 12.5448 12.5738 12.8110 12.8202 12.9252 12.9493 k = 0.4028 0.4028-0.0000 ( 8980 PWs) bands (ev): -31.1767 -31.1767 -31.1756 -31.1756 -31.1705 -31.1705 -31.1701 -31.1701 -12.4648 -12.4637 -12.4621 -12.4613 -12.4446 -12.4444 -12.4396 -12.4391 -12.1088 -12.1078 -12.0968 -12.0961 -12.0929 -12.0868 -12.0860 -12.0775 -12.0688 -12.0675 -12.0667 -12.0624 -12.0395 -12.0352 -12.0346 -12.0332 0.5207 0.5234 0.6942 0.6993 1.4388 1.4395 1.5321 1.5375 4.1445 4.1804 4.1830 4.2229 4.3958 4.4416 4.5141 4.6075 4.6889 4.7515 4.9158 4.9549 5.0753 5.1018 5.1826 5.2194 5.2486 5.3129 5.4351 5.4879 5.6573 5.7688 5.7921 5.8749 6.0141 6.0871 6.1575 6.2389 6.3214 6.3327 6.4216 6.4593 6.6500 6.6787 6.6995 6.7538 6.7734 6.8259 6.8929 6.9333 7.3727 7.4475 7.5423 7.5887 8.0808 8.1563 8.2922 8.3295 8.4471 8.5202 8.5521 8.5970 8.8501 8.8912 8.9054 9.0416 10.4300 10.4501 10.4868 10.5289 11.4973 11.5378 11.6029 11.6731 11.9234 11.9626 12.1120 12.1613 12.2665 12.3367 12.5718 12.5984 12.8185 12.8283 12.9639 12.9907 k = 0.3889 0.3889-0.0000 ( 8994 PWs) bands (ev): -31.1769 -31.1769 -31.1755 -31.1755 -31.1705 -31.1705 -31.1700 -31.1700 -12.4654 -12.4641 -12.4622 -12.4613 -12.4450 -12.4447 -12.4386 -12.4381 -12.1096 -12.1086 -12.0971 -12.0961 -12.0924 -12.0867 -12.0860 -12.0768 -12.0688 -12.0674 -12.0660 -12.0615 -12.0406 -12.0354 -12.0349 -12.0332 0.4868 0.4896 0.7063 0.7121 1.4409 1.4417 1.5562 1.5620 4.1374 4.1786 4.1825 4.2292 4.3814 4.4327 4.5093 4.6140 4.6625 4.7454 4.9054 4.9591 5.0852 5.1097 5.1718 5.2352 5.2587 5.3154 5.4447 5.5039 5.6451 5.7624 5.7896 5.8727 6.0118 6.1108 6.1725 6.2612 6.3202 6.3303 6.4261 6.4727 6.6460 6.6793 6.6981 6.7618 6.7704 6.8283 6.9077 6.9513 7.3480 7.4409 7.5394 7.5983 8.0422 8.1166 8.3002 8.3405 8.4451 8.5242 8.5612 8.6084 8.8662 8.9151 8.9279 9.0726 10.3970 10.4202 10.4717 10.5124 11.4339 11.4743 11.5692 11.6480 11.8738 11.9340 12.0738 12.1217 12.2602 12.3316 12.5985 12.6221 12.8275 12.8368 13.0018 13.0315 k = 0.3750 0.3750-0.0000 ( 8996 PWs) bands (ev): -31.1771 -31.1771 -31.1754 -31.1754 -31.1705 -31.1705 -31.1699 -31.1699 -12.4659 -12.4646 -12.4622 -12.4613 -12.4453 -12.4450 -12.4375 -12.4371 -12.1102 -12.1093 -12.0978 -12.0956 -12.0920 -12.0864 -12.0858 -12.0763 -12.0689 -12.0672 -12.0651 -12.0607 -12.0417 -12.0355 -12.0353 -12.0332 0.4512 0.4540 0.7200 0.7264 1.4432 1.4441 1.5808 1.5868 4.1297 4.1762 4.1820 4.2356 4.3670 4.4241 4.5025 4.6113 4.6401 4.7463 4.8923 4.9618 5.0973 5.1171 5.1604 5.2505 5.2729 5.3203 5.4532 5.5187 5.6351 5.7554 5.7866 5.8717 6.0101 6.1348 6.1877 6.2741 6.3220 6.3356 6.4304 6.4862 6.6426 6.6798 6.6968 6.7618 6.7767 6.8310 6.9237 6.9700 7.3226 7.4350 7.5344 7.6069 8.0046 8.0756 8.3098 8.3519 8.4437 8.5304 8.5718 8.6209 8.8832 8.9320 8.9558 9.1014 10.3616 10.3864 10.4606 10.4954 11.3611 11.4063 11.5361 11.6169 11.8315 11.9053 12.0342 12.0811 12.2526 12.3218 12.6255 12.6465 12.8387 12.8461 13.0379 13.0700 k = 0.3611 0.3611-0.0000 ( 8982 PWs) bands (ev): -31.1773 -31.1773 -31.1753 -31.1753 -31.1705 -31.1705 -31.1697 -31.1697 -12.4664 -12.4650 -12.4623 -12.4612 -12.4457 -12.4454 -12.4364 -12.4360 -12.1108 -12.1100 -12.0985 -12.0952 -12.0918 -12.0862 -12.0853 -12.0758 -12.0691 -12.0669 -12.0638 -12.0598 -12.0429 -12.0358 -12.0355 -12.0333 0.4144 0.4172 0.7352 0.7423 1.4457 1.4468 1.6053 1.6115 4.1215 4.1732 4.1813 4.2421 4.3525 4.4156 4.4939 4.5958 4.6256 4.7542 4.8777 4.9638 5.1081 5.1225 5.1550 5.2656 5.2887 5.3274 5.4604 5.5324 5.6272 5.7479 5.7831 5.8728 6.0089 6.1573 6.2034 6.2764 6.3220 6.3545 6.4347 6.4997 6.6395 6.6793 6.6964 6.7596 6.7867 6.8340 6.9402 6.9897 7.2966 7.4298 7.5270 7.6145 7.9693 8.0351 8.3210 8.3637 8.4426 8.5382 8.5837 8.6345 8.9005 8.9462 8.9841 9.1278 10.3242 10.3486 10.4540 10.4788 11.2819 11.3351 11.5035 11.5814 11.7958 11.8760 11.9928 12.0403 12.2415 12.3065 12.6522 12.6731 12.8520 12.8562 13.0720 13.1036 k = 0.3472 0.3472-0.0000 ( 8974 PWs) bands (ev): -31.1776 -31.1776 -31.1752 -31.1752 -31.1705 -31.1705 -31.1696 -31.1696 -12.4669 -12.4654 -12.4624 -12.4612 -12.4461 -12.4458 -12.4353 -12.4349 -12.1113 -12.1107 -12.0993 -12.0949 -12.0918 -12.0861 -12.0846 -12.0754 -12.0695 -12.0666 -12.0624 -12.0589 -12.0441 -12.0364 -12.0355 -12.0333 0.3768 0.3795 0.7519 0.7598 1.4485 1.4496 1.6293 1.6357 4.1129 4.1696 4.1800 4.2488 4.3381 4.4075 4.4834 4.5744 4.6144 4.7668 4.8626 4.9651 5.1067 5.1334 5.1590 5.2806 5.3050 5.3365 5.4662 5.5447 5.6216 5.7400 5.7795 5.8761 6.0085 6.1770 6.2199 6.2732 6.3225 6.3790 6.4391 6.5131 6.6369 6.6770 6.6978 6.7581 6.7975 6.8373 6.9566 7.0104 7.2704 7.4251 7.5169 7.6209 7.9376 7.9962 8.3334 8.3756 8.4412 8.5473 8.5965 8.6493 8.9172 8.9591 9.0109 9.1522 10.2849 10.3071 10.4516 10.4640 11.1997 11.2610 11.4714 11.5436 11.7651 11.8464 11.9495 11.9998 12.2259 12.2860 12.6781 12.7011 12.8668 12.8670 13.1041 13.1279 k = 0.3333 0.3333-0.0000 ( 8966 PWs) bands (ev): -31.1778 -31.1778 -31.1751 -31.1751 -31.1705 -31.1705 -31.1695 -31.1695 -12.4673 -12.4658 -12.4624 -12.4612 -12.4465 -12.4462 -12.4341 -12.4337 -12.1117 -12.1113 -12.0999 -12.0947 -12.0920 -12.0860 -12.0837 -12.0750 -12.0698 -12.0661 -12.0610 -12.0580 -12.0454 -12.0370 -12.0356 -12.0333 0.3389 0.3414 0.7702 0.7787 1.4514 1.4526 1.6524 1.6589 4.1038 4.1656 4.1780 4.2553 4.3239 4.3996 4.4712 4.5528 4.6029 4.7804 4.8490 4.9661 5.0976 5.1493 5.1686 5.2956 5.3213 5.3471 5.4704 5.5555 5.6184 5.7318 5.7759 5.8811 6.0090 6.1930 6.2371 6.2680 6.3246 6.4045 6.4441 6.5259 6.6347 6.6734 6.7009 6.7576 6.8086 6.8406 6.9719 7.0324 7.2444 7.4210 7.5037 7.6262 7.9105 7.9603 8.3465 8.3876 8.4395 8.5571 8.6099 8.6651 8.9328 8.9714 9.0353 9.1746 10.2434 10.2623 10.4474 10.4578 11.1170 11.1849 11.4402 11.5053 11.7377 11.8168 11.9046 11.9600 12.2058 12.2613 12.7026 12.7280 12.8780 12.8829 13.1329 13.1371 k = 0.3194 0.3194-0.0000 ( 8980 PWs) bands (ev): -31.1781 -31.1781 -31.1749 -31.1749 -31.1705 -31.1705 -31.1695 -31.1694 -12.4678 -12.4662 -12.4625 -12.4612 -12.4470 -12.4467 -12.4330 -12.4326 -12.1122 -12.1118 -12.1005 -12.0945 -12.0924 -12.0859 -12.0829 -12.0746 -12.0703 -12.0657 -12.0594 -12.0571 -12.0467 -12.0378 -12.0356 -12.0334 0.3008 0.3032 0.7900 0.7991 1.4545 1.4558 1.6742 1.6808 4.0943 4.1610 4.1749 4.2616 4.3102 4.3922 4.4579 4.5327 4.5910 4.7885 4.8422 4.9671 5.0880 5.1660 5.1806 5.3108 5.3372 5.3590 5.4733 5.5647 5.6176 5.7234 5.7726 5.8872 6.0106 6.2052 6.2528 6.2636 6.3288 6.4280 6.4504 6.5375 6.6332 6.6694 6.7054 6.7581 6.8199 6.8440 6.9855 7.0552 7.2194 7.4173 7.4873 7.6305 7.8890 7.9282 8.3595 8.3993 8.4377 8.5669 8.6237 8.6819 8.9466 8.9838 9.0569 9.1955 10.1989 10.2149 10.4380 10.4637 11.0356 11.1083 11.4102 11.4675 11.7120 11.7873 11.8586 11.9213 12.1818 12.2333 12.7244 12.7507 12.8896 12.8990 13.1277 13.1560 k = 0.3056 0.3056-0.0000 ( 8978 PWs) bands (ev): -31.1783 -31.1783 -31.1748 -31.1748 -31.1705 -31.1705 -31.1694 -31.1694 -12.4681 -12.4665 -12.4626 -12.4613 -12.4475 -12.4472 -12.4317 -12.4314 -12.1127 -12.1121 -12.1010 -12.0945 -12.0928 -12.0858 -12.0821 -12.0743 -12.0708 -12.0651 -12.0578 -12.0563 -12.0480 -12.0385 -12.0356 -12.0335 0.2629 0.2652 0.8112 0.8209 1.4577 1.4590 1.6945 1.7011 4.0844 4.1559 4.1704 4.2674 4.2975 4.3853 4.4440 4.5144 4.5792 4.7830 4.8492 4.9683 5.0796 5.1819 5.1948 5.3262 5.3525 5.3719 5.4749 5.5721 5.6194 5.7151 5.7697 5.8938 6.0136 6.2146 6.2522 6.2742 6.3350 6.4447 6.4620 6.5471 6.6327 6.6657 6.7110 6.7597 6.8308 6.8478 6.9968 7.0769 7.1974 7.4133 7.4686 7.6341 7.8735 7.9011 8.3711 8.4097 8.4369 8.5759 8.6378 8.6994 8.9586 8.9968 9.0754 9.2148 10.1504 10.1663 10.4307 10.4741 10.9568 11.0327 11.3817 11.4310 11.6866 11.7574 11.8128 11.8843 12.1551 12.2030 12.7419 12.7665 12.9020 12.9146 13.1111 13.1518 k = 0.2917 0.2917-0.0000 ( 8978 PWs) bands (ev): -31.1785 -31.1785 -31.1746 -31.1746 -31.1705 -31.1705 -31.1693 -31.1693 -12.4685 -12.4668 -12.4626 -12.4613 -12.4480 -12.4478 -12.4306 -12.4303 -12.1132 -12.1124 -12.1014 -12.0946 -12.0932 -12.0857 -12.0813 -12.0739 -12.0714 -12.0644 -12.0562 -12.0554 -12.0493 -12.0393 -12.0356 -12.0337 0.2254 0.2275 0.8337 0.8441 1.4609 1.4624 1.7130 1.7196 4.0743 4.1500 4.1645 4.2712 4.2872 4.3788 4.4303 4.4980 4.5677 4.7682 4.8650 4.9705 5.0732 5.1956 5.2115 5.3418 5.3670 5.3856 5.4757 5.5779 5.6232 5.7070 5.7674 5.9000 6.0183 6.2218 6.2450 6.2898 6.3432 6.4526 6.4798 6.5539 6.6337 6.6630 6.7176 6.7626 6.8397 6.8533 7.0056 7.0922 7.1834 7.4065 7.4504 7.6373 7.8631 7.8808 8.3798 8.4153 8.4413 8.5834 8.6524 8.7175 8.9692 9.0104 9.0912 9.2326 10.0970 10.1173 10.4262 10.4872 10.8818 10.9600 11.3549 11.3963 11.6600 11.7260 11.7694 11.8500 12.1265 12.1713 12.7537 12.7742 12.9151 12.9293 13.0921 13.1332 k = 0.2778 0.2778-0.0000 ( 8974 PWs) bands (ev): -31.1788 -31.1788 -31.1744 -31.1744 -31.1705 -31.1705 -31.1692 -31.1692 -12.4687 -12.4670 -12.4627 -12.4613 -12.4486 -12.4483 -12.4294 -12.4291 -12.1137 -12.1125 -12.1018 -12.0947 -12.0937 -12.0856 -12.0806 -12.0734 -12.0720 -12.0637 -12.0547 -12.0545 -12.0506 -12.0400 -12.0355 -12.0338 0.1885 0.1905 0.8577 0.8686 1.4643 1.4658 1.7293 1.7360 4.0640 4.1432 4.1573 4.2682 4.2842 4.3730 4.4176 4.4833 4.5567 4.7497 4.8824 4.9748 5.0688 5.2078 5.2298 5.3574 5.3804 5.4001 5.4762 5.5826 5.6285 5.6991 5.7657 5.9053 6.0246 6.2276 6.2372 6.3046 6.3526 6.4573 6.4973 6.5575 6.6361 6.6615 6.7244 6.7677 6.8443 6.8623 7.0118 7.0927 7.1856 7.3919 7.4392 7.6403 7.8544 7.8712 8.3834 8.4152 8.4526 8.5887 8.6672 8.7359 8.9791 9.0244 9.1048 9.2486 10.0394 10.0676 10.4244 10.5018 10.8113 10.8919 11.3298 11.3637 11.6303 11.6906 11.7329 11.8191 12.0967 12.1389 12.7589 12.7741 12.9289 12.9429 13.0737 13.1136 k = 0.2639 0.2639-0.0000 ( 8964 PWs) bands (ev): -31.1790 -31.1790 -31.1742 -31.1742 -31.1705 -31.1705 -31.1692 -31.1692 -12.4690 -12.4672 -12.4627 -12.4613 -12.4491 -12.4489 -12.4282 -12.4280 -12.1140 -12.1126 -12.1020 -12.0950 -12.0942 -12.0855 -12.0799 -12.0730 -12.0726 -12.0630 -12.0540 -12.0531 -12.0517 -12.0408 -12.0355 -12.0339 0.1524 0.1543 0.8829 0.8944 1.4677 1.4692 1.7434 1.7502 4.0537 4.1350 4.1496 4.2597 4.2869 4.3678 4.4066 4.4700 4.5463 4.7296 4.8978 4.9827 5.0663 5.2191 5.2488 5.3726 5.3930 5.4150 5.4769 5.5866 5.6345 5.6916 5.7645 5.9092 6.0325 6.2290 6.2331 6.3182 6.3625 6.4600 6.5122 6.5591 6.6392 6.6613 6.7299 6.7766 6.8457 6.8732 7.0152 7.0795 7.2026 7.3686 7.4373 7.6433 7.8467 7.8730 8.3805 8.4135 8.4668 8.5917 8.6823 8.7546 8.9886 9.0388 9.1169 9.2625 9.9786 10.0165 10.4249 10.5162 10.7462 10.8302 11.3055 11.3338 11.5966 11.6512 11.7059 11.7919 12.0664 12.1062 12.7573 12.7682 12.9426 12.9551 13.0574 13.0957 k = 0.2500 0.2500-0.0000 ( 8968 PWs) bands (ev): -31.1793 -31.1793 -31.1740 -31.1740 -31.1705 -31.1705 -31.1691 -31.1691 -12.4691 -12.4674 -12.4628 -12.4614 -12.4497 -12.4495 -12.4271 -12.4269 -12.1144 -12.1126 -12.1023 -12.0954 -12.0946 -12.0854 -12.0793 -12.0734 -12.0724 -12.0623 -12.0535 -12.0532 -12.0512 -12.0415 -12.0355 -12.0341 0.1173 0.1191 0.9093 0.9215 1.4711 1.4727 1.7550 1.7619 4.0436 4.1249 4.1421 4.2505 4.2898 4.3633 4.3979 4.4581 4.5363 4.7087 4.9093 4.9956 5.0656 5.2297 5.2677 5.3867 5.4052 5.4299 5.4789 5.5905 5.6404 5.6844 5.7640 5.9116 6.0416 6.2213 6.2379 6.3310 6.3722 6.4604 6.5243 6.5605 6.6419 6.6623 6.7330 6.7899 6.8453 6.8842 7.0147 7.0624 7.2249 7.3421 7.4414 7.6467 7.8438 7.8822 8.3712 8.4114 8.4812 8.5924 8.6973 8.7736 8.9974 9.0536 9.1284 9.2741 9.9152 9.9640 10.4269 10.5286 10.6870 10.7766 11.2797 11.3076 11.5594 11.6122 11.6859 11.7683 12.0358 12.0735 12.7490 12.7593 12.9553 12.9660 13.0439 13.0802 k = 0.2361 0.2361-0.0000 ( 8964 PWs) bands (ev): -31.1795 -31.1795 -31.1738 -31.1738 -31.1705 -31.1705 -31.1691 -31.1691 -12.4692 -12.4674 -12.4628 -12.4614 -12.4504 -12.4502 -12.4260 -12.4258 -12.1146 -12.1126 -12.1024 -12.0959 -12.0950 -12.0852 -12.0787 -12.0742 -12.0720 -12.0615 -12.0544 -12.0529 -12.0497 -12.0420 -12.0354 -12.0342 0.0834 0.0850 0.9370 0.9496 1.4746 1.4762 1.7640 1.7710 4.0338 4.1134 4.1351 4.2413 4.2917 4.3597 4.3919 4.4474 4.5269 4.6874 4.9167 5.0136 5.0661 5.2398 5.2863 5.3986 5.4178 5.4444 5.4832 5.5942 5.6458 5.6777 5.7640 5.9126 6.0512 6.2138 6.2431 6.3431 6.3810 6.4577 6.5342 6.5629 6.6438 6.6644 6.7335 6.8063 6.8432 6.8943 7.0078 7.0492 7.2472 7.3161 7.4500 7.6507 7.8470 7.8972 8.3570 8.4073 8.4941 8.5911 8.7119 8.7936 9.0051 9.0687 9.1401 9.2832 9.8500 9.9102 10.4298 10.5365 10.6347 10.7328 11.2497 11.2853 11.5212 11.5778 11.6705 11.7478 12.0054 12.0412 12.7356 12.7493 12.9655 12.9760 13.0340 13.0675 k = 0.2222 0.2222-0.0000 ( 8974 PWs) bands (ev): -31.1797 -31.1797 -31.1737 -31.1737 -31.1705 -31.1705 -31.1691 -31.1691 -12.4693 -12.4675 -12.4628 -12.4615 -12.4510 -12.4509 -12.4250 -12.4248 -12.1148 -12.1125 -12.1026 -12.0965 -12.0955 -12.0851 -12.0782 -12.0750 -12.0715 -12.0608 -12.0555 -12.0528 -12.0483 -12.0424 -12.0354 -12.0344 0.0507 0.0522 0.9658 0.9789 1.4779 1.4796 1.7702 1.7774 4.0246 4.1012 4.1284 4.2319 4.2923 4.3573 4.3882 4.4380 4.5178 4.6656 4.9213 5.0352 5.0677 5.2494 5.3042 5.4078 5.4310 5.4580 5.4908 5.5978 5.6504 5.6714 5.7644 5.9122 6.0608 6.2068 6.2488 6.3545 6.3883 6.4522 6.5429 6.5664 6.6447 6.6670 6.7321 6.8235 6.8396 6.9032 6.9931 7.0437 7.2656 7.2943 7.4626 7.6555 7.8564 7.9175 8.3388 8.4001 8.5045 8.5882 8.7259 8.8149 9.0107 9.0840 9.1524 9.2901 9.7837 9.8556 10.4330 10.5371 10.5909 10.7001 11.2144 11.2637 11.4861 11.5506 11.6583 11.7300 11.9753 12.0095 12.7202 12.7386 12.9718 12.9858 13.0281 13.0576 k = 0.2083 0.2083-0.0000 ( 8974 PWs) bands (ev): -31.1799 -31.1799 -31.1735 -31.1735 -31.1705 -31.1705 -31.1691 -31.1691 -12.4693 -12.4675 -12.4628 -12.4615 -12.4517 -12.4516 -12.4239 -12.4238 -12.1149 -12.1123 -12.1026 -12.0971 -12.0959 -12.0850 -12.0777 -12.0759 -12.0711 -12.0602 -12.0565 -12.0528 -12.0468 -12.0425 -12.0353 -12.0345 0.0195 0.0209 0.9956 1.0092 1.4813 1.4829 1.7735 1.7810 4.0162 4.0890 4.1220 4.2222 4.2915 4.3563 4.3866 4.4298 4.5092 4.6437 4.9246 5.0588 5.0702 5.2586 5.3212 5.4147 5.4441 5.4708 5.5020 5.6012 5.6537 5.6658 5.7653 5.9107 6.0697 6.2006 6.2550 6.3652 6.3933 6.4452 6.5513 6.5706 6.6449 6.6699 6.7291 6.8323 6.8412 6.9109 6.9745 7.0434 7.2668 7.2915 7.4789 7.6615 7.8719 7.9424 8.3170 8.3889 8.5118 8.5843 8.7387 8.8383 9.0135 9.0990 9.1652 9.2952 9.7173 9.8008 10.4358 10.5266 10.5592 10.6787 11.1733 11.2384 11.4589 11.5322 11.6485 11.7143 11.9456 11.9784 12.7051 12.7282 12.9744 12.9951 13.0256 13.0504 k = 0.1944 0.1944-0.0000 ( 8964 PWs) bands (ev): -31.1801 -31.1801 -31.1732 -31.1732 -31.1705 -31.1705 -31.1691 -31.1691 -12.4692 -12.4674 -12.4629 -12.4616 -12.4524 -12.4523 -12.4229 -12.4228 -12.1149 -12.1122 -12.1027 -12.0976 -12.0964 -12.0848 -12.0773 -12.0767 -12.0707 -12.0597 -12.0573 -12.0531 -12.0455 -12.0423 -12.0352 -12.0346 -0.0102 -0.0090 1.0264 1.0404 1.4845 1.4862 1.7739 1.7817 4.0087 4.0774 4.1157 4.2119 4.2898 4.3568 4.3864 4.4229 4.5009 4.6216 4.9274 5.0714 5.0851 5.2675 5.3367 5.4204 5.4564 5.4836 5.5161 5.6044 5.6548 5.6618 5.7665 5.9080 6.0777 6.1952 6.2617 6.3750 6.3946 6.4394 6.5582 6.5760 6.6447 6.6728 6.7248 6.8256 6.8527 6.9180 6.9553 7.0456 7.2560 7.3042 7.4979 7.6690 7.8932 7.9714 8.2917 8.3735 8.5159 8.5796 8.7500 8.8640 9.0129 9.1133 9.1776 9.2995 9.6519 9.7468 10.4371 10.5073 10.5401 10.6659 11.1266 11.2055 11.4434 11.5228 11.6408 11.7006 11.9164 11.9481 12.6918 12.7194 12.9752 13.0032 13.0252 13.0458 k = 0.1806 0.1806-0.0000 ( 8966 PWs) bands (ev): -31.1803 -31.1803 -31.1730 -31.1730 -31.1705 -31.1705 -31.1691 -31.1691 -12.4691 -12.4673 -12.4629 -12.4616 -12.4531 -12.4530 -12.4220 -12.4219 -12.1149 -12.1120 -12.1027 -12.0981 -12.0970 -12.0847 -12.0777 -12.0768 -12.0704 -12.0594 -12.0580 -12.0535 -12.0441 -12.0420 -12.0352 -12.0348 -0.0383 -0.0372 1.0581 1.0725 1.4877 1.4893 1.7714 1.7794 4.0023 4.0667 4.1094 4.2010 4.2878 4.3585 4.3871 4.4173 4.4929 4.5996 4.9305 5.0739 5.1105 5.2763 5.3506 5.4258 5.4674 5.4970 5.5318 5.6073 5.6521 5.6609 5.7679 5.9042 6.0845 6.1909 6.2685 6.3832 6.3911 6.4374 6.5616 6.5844 6.6443 6.6753 6.7194 6.8167 6.8592 6.9244 6.9379 7.0485 7.2510 7.3175 7.5185 7.6780 7.9199 8.0042 8.2630 8.3536 8.5172 8.5745 8.7590 8.8921 9.0086 9.1261 9.1884 9.3040 9.5887 9.6948 10.4357 10.4908 10.5265 10.6581 11.0749 11.1640 11.4402 11.5216 11.6348 11.6886 11.8879 11.9187 12.6817 12.7136 12.9753 13.0097 13.0257 13.0432 k = 0.1667 0.1667-0.0000 ( 8958 PWs) bands (ev): -31.1805 -31.1805 -31.1728 -31.1728 -31.1705 -31.1704 -31.1691 -31.1691 -12.4689 -12.4672 -12.4628 -12.4617 -12.4539 -12.4537 -12.4211 -12.4211 -12.1147 -12.1117 -12.1027 -12.0986 -12.0975 -12.0846 -12.0785 -12.0764 -12.0701 -12.0593 -12.0585 -12.0540 -12.0429 -12.0414 -12.0351 -12.0349 -0.0647 -0.0637 1.0906 1.1054 1.4907 1.4924 1.7658 1.7742 3.9972 4.0572 4.1033 4.1896 4.2858 4.3610 4.3882 4.4131 4.4852 4.5776 4.9341 5.0757 5.1365 5.2852 5.3625 5.4314 5.4773 5.5110 5.5483 5.6100 5.6479 5.6607 5.7692 5.8992 6.0902 6.1876 6.2746 6.3810 6.3924 6.4399 6.5617 6.5952 6.6437 6.6773 6.7131 6.8064 6.8600 6.9167 6.9365 7.0511 7.2545 7.3309 7.5399 7.6886 7.9513 8.0399 8.2309 8.3293 8.5164 8.5691 8.7651 8.9219 9.0006 9.1363 9.1957 9.3100 9.5296 9.6462 10.4314 10.4824 10.5159 10.6522 11.0195 11.1156 11.4468 11.5267 11.6306 11.6780 11.8600 11.8903 12.6761 12.7117 12.9759 13.0144 13.0264 13.0421 k = 0.1528 0.1528-0.0000 ( 8960 PWs) bands (ev): -31.1807 -31.1807 -31.1726 -31.1726 -31.1705 -31.1704 -31.1692 -31.1692 -12.4687 -12.4670 -12.4628 -12.4617 -12.4547 -12.4544 -12.4203 -12.4203 -12.1145 -12.1115 -12.1028 -12.0990 -12.0982 -12.0846 -12.0792 -12.0760 -12.0700 -12.0595 -12.0589 -12.0544 -12.0418 -12.0408 -12.0351 -12.0350 -0.0893 -0.0883 1.1238 1.1390 1.4935 1.4952 1.7573 1.7662 3.9934 4.0492 4.0972 4.1776 4.2843 4.3642 4.3892 4.4103 4.4777 4.5558 4.9384 5.0767 5.1623 5.2942 5.3725 5.4373 5.4865 5.5252 5.5651 5.6127 5.6438 5.6597 5.7704 5.8930 6.0952 6.1853 6.2790 6.3713 6.3981 6.4452 6.5597 6.6070 6.6430 6.6786 6.7060 6.7953 6.8563 6.9008 6.9444 7.0523 7.2664 7.3456 7.5613 7.7008 7.9869 8.0778 8.1962 8.3006 8.5144 8.5634 8.7677 8.9506 8.9907 9.1423 9.1987 9.3181 9.4767 9.6025 10.4267 10.4802 10.5089 10.6464 10.9617 11.0627 11.4600 11.5361 11.6280 11.6689 11.8330 11.8629 12.6758 12.7148 12.9770 13.0176 13.0273 13.0416 k = 0.1389 0.1389-0.0000 ( 8954 PWs) bands (ev): -31.1808 -31.1808 -31.1724 -31.1724 -31.1704 -31.1704 -31.1692 -31.1692 -12.4685 -12.4667 -12.4628 -12.4618 -12.4554 -12.4551 -12.4196 -12.4195 -12.1142 -12.1112 -12.1029 -12.0992 -12.0988 -12.0849 -12.0796 -12.0756 -12.0699 -12.0600 -12.0591 -12.0547 -12.0407 -12.0401 -12.0351 -12.0350 -0.1119 -0.1111 1.1577 1.1731 1.4962 1.4979 1.7459 1.7552 3.9910 4.0426 4.0913 4.1653 4.2837 4.3677 4.3900 4.4089 4.4704 4.5343 4.9433 5.0768 5.1879 5.3037 5.3806 5.4433 5.4953 5.5391 5.5815 5.6159 5.6401 5.6578 5.7712 5.8853 6.1000 6.1840 6.2805 6.3617 6.4028 6.4522 6.5570 6.6186 6.6419 6.6787 6.6990 6.7842 6.8498 6.8857 6.9519 7.0520 7.2859 7.3627 7.5823 7.7143 8.0256 8.1140 8.1621 8.2680 8.5119 8.5578 8.7662 8.9589 8.9961 9.1414 9.1986 9.3280 9.4331 9.5649 10.4245 10.4811 10.5057 10.6402 10.9030 11.0073 11.4768 11.5481 11.6271 11.6611 11.8069 11.8367 12.6818 12.7235 12.9789 13.0196 13.0281 13.0410 k = 0.1250 0.1250-0.0000 ( 8966 PWs) bands (ev): -31.1810 -31.1810 -31.1722 -31.1722 -31.1704 -31.1704 -31.1693 -31.1693 -12.4681 -12.4664 -12.4628 -12.4619 -12.4562 -12.4559 -12.4189 -12.4188 -12.1138 -12.1109 -12.1032 -12.0996 -12.0992 -12.0855 -12.0796 -12.0753 -12.0699 -12.0609 -12.0592 -12.0548 -12.0398 -12.0395 -12.0352 -12.0350 -0.1327 -0.1319 1.1920 1.2077 1.4987 1.5004 1.7317 1.7416 3.9901 4.0375 4.0855 4.1526 4.2840 4.3715 4.3904 4.4087 4.4632 4.5132 4.9491 5.0758 5.2130 5.3136 5.3873 5.4486 5.5038 5.5521 5.5966 5.6207 5.6367 5.6550 5.7716 5.8762 6.1050 6.1834 6.2786 6.3528 6.4070 6.4603 6.5545 6.6291 6.6402 6.6760 6.6944 6.7738 6.8419 6.8715 6.9584 7.0503 7.3114 7.3831 7.6027 7.7288 8.0665 8.1078 8.1695 8.2321 8.5096 8.5524 8.7605 8.9401 9.0208 9.1312 9.1981 9.3377 9.4031 9.5338 10.4259 10.4832 10.5064 10.6335 10.8445 10.9508 11.4947 11.5609 11.6278 11.6547 11.7818 11.8117 12.6945 12.7384 12.9813 13.0208 13.0285 13.0401 k = 0.1111 0.1111-0.0000 ( 8951 PWs) bands (ev): -31.1811 -31.1811 -31.1720 -31.1720 -31.1704 -31.1704 -31.1694 -31.1694 -12.4678 -12.4661 -12.4627 -12.4619 -12.4570 -12.4566 -12.4182 -12.4182 -12.1133 -12.1105 -12.1035 -12.1003 -12.0990 -12.0863 -12.0794 -12.0749 -12.0700 -12.0619 -12.0591 -12.0549 -12.0389 -12.0388 -12.0352 -12.0349 -0.1514 -0.1507 1.2268 1.2426 1.5010 1.5027 1.7149 1.7252 3.9907 4.0338 4.0798 4.1397 4.2855 4.3754 4.3908 4.4091 4.4563 4.4926 4.9555 5.0736 5.2374 5.3240 5.3928 5.4524 5.5122 5.5636 5.6093 5.6280 5.6339 5.6521 5.7714 5.8654 6.1107 6.1837 6.2733 6.3437 6.4114 6.4688 6.5532 6.6348 6.6398 6.6692 6.6947 6.7648 6.8334 6.8583 6.9639 7.0473 7.3416 7.4072 7.6223 7.7439 8.0654 8.1100 8.1907 8.2131 8.5076 8.5476 8.7503 8.9129 9.0412 9.1123 9.2012 9.3444 9.3904 9.5092 10.4306 10.4864 10.5103 10.6263 10.7875 10.8945 11.5122 11.5736 11.6298 11.6498 11.7579 11.7879 12.7143 12.7595 12.9841 13.0217 13.0283 13.0388 k = 0.0972 0.0972-0.0000 ( 8959 PWs) bands (ev): -31.1812 -31.1812 -31.1718 -31.1718 -31.1704 -31.1704 -31.1695 -31.1695 -12.4674 -12.4657 -12.4627 -12.4620 -12.4578 -12.4573 -12.4177 -12.4177 -12.1128 -12.1102 -12.1040 -12.1011 -12.0987 -12.0872 -12.0789 -12.0746 -12.0702 -12.0632 -12.0589 -12.0549 -12.0382 -12.0381 -12.0353 -12.0350 -0.1680 -0.1674 1.2618 1.2778 1.5030 1.5047 1.6955 1.7064 3.9927 4.0315 4.0743 4.1267 4.2882 4.3794 4.3912 4.4098 4.4494 4.4728 4.9626 5.0703 5.2612 5.3347 5.3973 5.4541 5.5205 5.5728 5.6199 5.6295 5.6371 5.6523 5.7705 5.8531 6.1176 6.1846 6.2659 6.3331 6.4168 6.4770 6.5537 6.6312 6.6440 6.6602 6.6992 6.7577 6.8247 6.8459 6.9686 7.0432 7.3753 7.4353 7.6409 7.7591 8.0200 8.1393 8.1645 8.2560 8.5059 8.5438 8.7357 8.8805 9.0482 9.0888 9.2129 9.3481 9.3929 9.4899 10.4380 10.4908 10.5162 10.6189 10.7333 10.8395 11.5278 11.5856 11.6322 11.6470 11.7353 11.7655 12.7409 12.7867 12.9872 13.0222 13.0275 13.0372 k = 0.0833 0.0833-0.0000 ( 8957 PWs) bands (ev): -31.1813 -31.1813 -31.1716 -31.1716 -31.1704 -31.1704 -31.1696 -31.1696 -12.4669 -12.4653 -12.4626 -12.4621 -12.4586 -12.4580 -12.4172 -12.4172 -12.1122 -12.1098 -12.1044 -12.1020 -12.0983 -12.0882 -12.0783 -12.0742 -12.0704 -12.0644 -12.0586 -12.0550 -12.0376 -12.0374 -12.0353 -12.0350 -0.1825 -0.1820 1.2969 1.3131 1.5048 1.5066 1.6738 1.6851 3.9961 4.0303 4.0689 4.1137 4.2923 4.3833 4.3917 4.4103 4.4425 4.4542 4.9702 5.0659 5.2841 5.3457 5.4009 5.4533 5.5288 5.5797 5.6252 5.6290 5.6397 5.6618 5.7687 5.8393 6.1260 6.1863 6.2573 6.3201 6.4235 6.4845 6.5565 6.6249 6.6451 6.6515 6.7066 6.7529 6.8162 6.8341 6.9729 7.0382 7.4117 7.4670 7.6580 7.7740 7.9723 8.1025 8.2017 8.3013 8.5043 8.5415 8.7170 8.8437 9.0391 9.0654 9.2354 9.3532 9.4019 9.4748 10.4468 10.4968 10.5233 10.6114 10.6831 10.7868 11.5412 11.5968 11.6338 11.6466 11.7144 11.7446 12.7736 12.8193 12.9904 13.0224 13.0262 13.0354 k = 0.0694 0.0694-0.0000 ( 8959 PWs) bands (ev): -31.1814 -31.1814 -31.1714 -31.1714 -31.1704 -31.1704 -31.1697 -31.1697 -12.4664 -12.4648 -12.4626 -12.4622 -12.4593 -12.4587 -12.4168 -12.4168 -12.1115 -12.1095 -12.1049 -12.1028 -12.0978 -12.0893 -12.0775 -12.0739 -12.0707 -12.0657 -12.0583 -12.0551 -12.0371 -12.0369 -12.0353 -12.0350 -0.1948 -0.1944 1.3321 1.3483 1.5062 1.5082 1.6500 1.6617 4.0009 4.0303 4.0638 4.1009 4.2977 4.3871 4.3920 4.4105 4.4337 4.4393 4.9784 5.0604 5.3060 5.3566 5.4036 5.4500 5.5371 5.5849 5.6210 5.6277 5.6499 5.6752 5.7660 5.8240 6.1360 6.1886 6.2485 6.3045 6.4313 6.4905 6.5614 6.6176 6.6402 6.6459 6.7160 6.7508 6.8078 6.8229 6.9770 7.0325 7.4504 7.5019 7.6732 7.7882 7.9231 8.0580 8.2453 8.3473 8.5018 8.5412 8.6948 8.8034 9.0200 9.0443 9.2653 9.3610 9.4116 9.4625 10.4561 10.5043 10.5310 10.6036 10.6385 10.7373 11.5525 11.6069 11.6344 11.6479 11.6956 11.7252 12.8116 12.8564 12.9936 13.0223 13.0246 13.0336 k = 0.0556 0.0556-0.0000 ( 8975 PWs) bands (ev): -31.1815 -31.1815 -31.1712 -31.1712 -31.1704 -31.1704 -31.1698 -31.1698 -12.4659 -12.4643 -12.4625 -12.4623 -12.4601 -12.4594 -12.4165 -12.4165 -12.1108 -12.1091 -12.1055 -12.1037 -12.0973 -12.0904 -12.0766 -12.0736 -12.0710 -12.0671 -12.0579 -12.0553 -12.0366 -12.0364 -12.0353 -12.0350 -0.2049 -0.2046 1.3670 1.3833 1.5074 1.5095 1.6242 1.6363 4.0069 4.0312 4.0588 4.0882 4.3046 4.3891 4.3925 4.4099 4.4214 4.4316 4.9869 5.0541 5.3269 5.3671 5.4052 5.4441 5.5453 5.5891 5.6148 5.6235 5.6648 5.6890 5.7622 5.8076 6.1477 6.1917 6.2399 6.2870 6.4401 6.4942 6.5684 6.6107 6.6326 6.6411 6.7263 6.7511 6.7997 6.8120 6.9812 7.0263 7.4911 7.5390 7.6853 7.8013 7.8734 8.0131 8.2885 8.3935 8.4976 8.5432 8.6700 8.7606 8.9997 9.0241 9.2982 9.3703 9.4191 9.4522 10.4650 10.5130 10.5387 10.5916 10.6049 10.6923 11.5623 11.6150 11.6353 11.6492 11.6797 11.7075 12.8534 12.8967 12.9967 13.0219 13.0230 13.0317 k = 0.0417 0.0417-0.0000 ( 8987 PWs) bands (ev): -31.1816 -31.1816 -31.1710 -31.1710 -31.1704 -31.1704 -31.1700 -31.1700 -12.4653 -12.4638 -12.4625 -12.4624 -12.4608 -12.4601 -12.4162 -12.4162 -12.1100 -12.1087 -12.1060 -12.1047 -12.0966 -12.0914 -12.0756 -12.0732 -12.0713 -12.0684 -12.0575 -12.0555 -12.0362 -12.0361 -12.0354 -12.0351 -0.2128 -0.2126 1.4016 1.4180 1.5081 1.5107 1.5968 1.6090 4.0141 4.0329 4.0541 4.0758 4.3129 4.3834 4.3959 4.4081 4.4144 4.4254 4.9957 5.0470 5.3467 5.3769 5.4057 5.4358 5.5534 5.5927 5.6075 5.6194 5.6813 5.7021 5.7573 5.7902 6.1611 6.1954 6.2317 6.2682 6.4495 6.4948 6.5768 6.6055 6.6250 6.6344 6.7371 6.7536 6.7918 6.8014 6.9857 7.0199 7.5338 7.5768 7.6932 7.8097 7.8277 7.9695 8.3302 8.4397 8.4905 8.5478 8.6439 8.7161 8.9832 9.0052 9.3309 9.3802 9.4225 9.4431 10.4732 10.5210 10.5459 10.5673 10.5930 10.6526 11.5715 11.6194 11.6374 11.6496 11.6684 11.6915 12.8970 12.9384 12.9995 13.0207 13.0225 13.0298 k = 0.0278 0.0278-0.0000 ( 9003 PWs) bands (ev): -31.1816 -31.1816 -31.1708 -31.1708 -31.1704 -31.1704 -31.1701 -31.1701 -12.4648 -12.4633 -12.4627 -12.4624 -12.4614 -12.4608 -12.4161 -12.4161 -12.1092 -12.1083 -12.1065 -12.1056 -12.0959 -12.0924 -12.0746 -12.0729 -12.0716 -12.0697 -12.0572 -12.0558 -12.0359 -12.0358 -12.0354 -12.0352 -0.2185 -0.2183 1.4355 1.4522 1.5083 1.5118 1.5681 1.5802 4.0224 4.0353 4.0497 4.0639 4.3226 4.3720 4.4001 4.4073 4.4121 4.4197 5.0046 5.0392 5.3653 5.3856 5.4049 5.4253 5.5617 5.5936 5.6020 5.6154 5.6987 5.7143 5.7512 5.7722 6.1762 6.1998 6.2241 6.2488 6.4593 6.4921 6.5864 6.6031 6.6180 6.6262 6.7480 6.7578 6.7840 6.7908 6.9905 7.0135 7.5783 7.6135 7.6950 7.7703 7.8303 7.9291 8.3696 8.4788 8.4861 8.5550 8.6187 8.6706 8.9722 8.9889 9.3611 9.3900 9.4211 9.4343 10.4810 10.5216 10.5490 10.5582 10.5857 10.6192 11.5806 11.6173 11.6414 11.6501 11.6621 11.6775 12.9397 12.9787 13.0016 13.0197 13.0227 13.0280 k = 0.0139 0.0139-0.0000 ( 9011 PWs) bands (ev): -31.1816 -31.1816 -31.1706 -31.1706 -31.1705 -31.1705 -31.1703 -31.1703 -12.4642 -12.4631 -12.4627 -12.4623 -12.4618 -12.4615 -12.4160 -12.4160 -12.1083 -12.1079 -12.1070 -12.1065 -12.0951 -12.0934 -12.0735 -12.0726 -12.0719 -12.0710 -12.0568 -12.0561 -12.0357 -12.0356 -12.0354 -12.0354 -0.2219 -0.2218 1.4681 1.4857 1.5068 1.5133 1.5393 1.5498 4.0316 4.0382 4.0455 4.0525 4.3336 4.3588 4.4045 4.4080 4.4106 4.4143 5.0135 5.0310 5.3826 5.3928 5.4025 5.4128 5.5701 5.5872 5.6036 5.6114 5.7168 5.7254 5.7439 5.7538 6.1928 6.2049 6.2170 6.2294 6.4691 6.4863 6.5966 6.6038 6.6118 6.6169 6.7589 6.7632 6.7766 6.7802 6.9957 7.0072 7.6246 7.6463 7.6886 7.7211 7.8456 7.8940 8.4056 8.4612 8.5323 8.5650 8.5964 8.6247 8.9675 8.9765 9.3871 9.3993 9.4156 9.4234 10.4890 10.5102 10.5567 10.5643 10.5788 10.5922 11.5900 11.6096 11.6474 11.6524 11.6585 11.6654 12.9761 13.0017 13.0118 13.0211 13.0235 13.0262 k = 0.0000 0.0000 0.0000 ( 9045 PWs) bands (ev): -31.1817 -31.1817 -31.1705 -31.1705 -31.1705 -31.1705 -31.1705 -31.1705 -12.4636 -12.4636 -12.4621 -12.4621 -12.4621 -12.4621 -12.4160 -12.4160 -12.1075 -12.1075 -12.1075 -12.1075 -12.0943 -12.0943 -12.0723 -12.0723 -12.0723 -12.0723 -12.0564 -12.0564 -12.0355 -12.0355 -12.0355 -12.0355 -0.2230 -0.2230 1.4961 1.4961 1.5183 1.5183 1.5183 1.5183 4.0417 4.0417 4.0417 4.0417 4.3457 4.3457 4.4093 4.4093 4.4093 4.4093 5.0223 5.0223 5.3985 5.3985 5.3985 5.3985 5.5787 5.5787 5.6074 5.6074 5.7352 5.7352 5.7352 5.7352 6.2106 6.2106 6.2106 6.2106 6.4784 6.4784 6.6069 6.6069 6.6069 6.6069 6.7696 6.7696 6.7696 6.7696 7.0013 7.0013 7.6722 7.6722 7.6722 7.6722 7.8662 7.8662 8.4366 8.4366 8.5785 8.5785 8.5785 8.5785 8.9691 8.9691 9.4080 9.4080 9.4080 9.4080 10.4984 10.4984 10.5716 10.5716 10.5716 10.5716 11.5999 11.5999 11.6554 11.6554 11.6554 11.6554 12.9964 12.9964 13.0246 13.0246 13.0246 13.0246 k = 0.0000 0.0000 0.0000 ( 9045 PWs) bands (ev): -31.1817 -31.1817 -31.1705 -31.1705 -31.1705 -31.1705 -31.1705 -31.1705 -12.4636 -12.4636 -12.4621 -12.4621 -12.4621 -12.4621 -12.4160 -12.4160 -12.1075 -12.1075 -12.1075 -12.1075 -12.0943 -12.0943 -12.0723 -12.0723 -12.0723 -12.0723 -12.0564 -12.0564 -12.0355 -12.0355 -12.0355 -12.0355 -0.2230 -0.2230 1.4961 1.4961 1.5183 1.5183 1.5183 1.5183 4.0417 4.0417 4.0417 4.0417 4.3457 4.3457 4.4093 4.4093 4.4093 4.4093 5.0223 5.0223 5.3985 5.3985 5.3985 5.3985 5.5787 5.5787 5.6074 5.6074 5.7352 5.7352 5.7352 5.7352 6.2106 6.2106 6.2106 6.2106 6.4784 6.4784 6.6069 6.6069 6.6069 6.6069 6.7696 6.7696 6.7696 6.7696 7.0013 7.0013 7.6722 7.6722 7.6722 7.6722 7.8662 7.8662 8.4366 8.4366 8.5785 8.5785 8.5785 8.5785 8.9691 8.9691 9.4080 9.4080 9.4080 9.4080 10.4984 10.4984 10.5716 10.5716 10.5716 10.5716 11.5999 11.5999 11.6554 11.6554 11.6554 11.6554 12.9964 12.9964 13.0246 13.0246 13.0246 13.0246 k = 0.0114 0.0114 0.0114 ( 9015 PWs) bands (ev): -31.1816 -31.1816 -31.1706 -31.1706 -31.1705 -31.1705 -31.1703 -31.1703 -12.4642 -12.4631 -12.4627 -12.4623 -12.4618 -12.4615 -12.4160 -12.4160 -12.1083 -12.1080 -12.1069 -12.1066 -12.0952 -12.0934 -12.0735 -12.0723 -12.0723 -12.0710 -12.0568 -12.0561 -12.0357 -12.0357 -12.0354 -12.0354 -0.2219 -0.2218 1.4681 1.4858 1.5068 1.5130 1.5395 1.5499 4.0317 4.0380 4.0457 4.0525 4.3335 4.3588 4.4044 4.4087 4.4099 4.4145 5.0135 5.0310 5.3825 5.3931 5.4022 5.4129 5.5701 5.5872 5.6036 5.6114 5.7176 5.7236 5.7463 5.7522 6.1926 6.2051 6.2171 6.2294 6.4691 6.4863 6.5969 6.6030 6.6124 6.6167 6.7601 6.7616 6.7776 6.7796 6.9956 7.0072 7.6268 7.6418 7.6930 7.7189 7.8455 7.8942 8.4055 8.4613 8.5323 8.5646 8.5968 8.6246 8.9675 8.9765 9.3888 9.3967 9.4167 9.4232 10.4888 10.5103 10.5578 10.5623 10.5798 10.5921 11.5900 11.6097 11.6473 11.6522 11.6589 11.6653 12.9760 13.0013 13.0123 13.0211 13.0234 13.0262 k = 0.0227 0.0227 0.0227 ( 9003 PWs) bands (ev): -31.1816 -31.1816 -31.1708 -31.1708 -31.1705 -31.1705 -31.1701 -31.1701 -12.4648 -12.4633 -12.4627 -12.4624 -12.4614 -12.4608 -12.4161 -12.4161 -12.1091 -12.1085 -12.1063 -12.1057 -12.0959 -12.0924 -12.0747 -12.0723 -12.0723 -12.0696 -12.0572 -12.0558 -12.0359 -12.0358 -12.0354 -12.0352 -0.2185 -0.2183 1.4356 1.4526 1.5078 1.5108 1.5687 1.5805 4.0227 4.0347 4.0499 4.0640 4.3225 4.3723 4.3998 4.4082 4.4111 4.4200 5.0045 5.0392 5.3651 5.3863 5.4039 5.4257 5.5617 5.5935 5.6023 5.6153 5.6997 5.7117 5.7568 5.7682 6.1756 6.2003 6.2244 6.2486 6.4594 6.4919 6.5872 6.6017 6.6188 6.6260 6.7513 6.7538 6.7855 6.7901 6.9905 7.0135 7.5829 7.6045 7.7034 7.7665 7.8294 7.9298 8.3693 8.4793 8.4860 8.5539 8.6198 8.6706 8.9722 8.9893 9.3659 9.3833 9.4226 9.4344 10.4796 10.5225 10.5508 10.5548 10.5881 10.6190 11.5803 11.6185 11.6408 11.6489 11.6635 11.6769 12.9393 12.9765 13.0050 13.0189 13.0226 13.0279 k = 0.0341 0.0341 0.0341 ( 8985 PWs) bands (ev): -31.1816 -31.1816 -31.1710 -31.1710 -31.1705 -31.1705 -31.1700 -31.1700 -12.4653 -12.4638 -12.4625 -12.4624 -12.4608 -12.4601 -12.4162 -12.4162 -12.1098 -12.1090 -12.1058 -12.1047 -12.0966 -12.0914 -12.0758 -12.0723 -12.0723 -12.0682 -12.0575 -12.0555 -12.0363 -12.0360 -12.0355 -12.0350 -0.2128 -0.2126 1.4021 1.4190 1.5069 1.5086 1.5978 1.6097 4.0147 4.0319 4.0544 4.0761 4.3126 4.3848 4.3956 4.4076 4.4139 4.4257 4.9955 5.0470 5.3463 5.3782 5.4037 5.4369 5.5536 5.5924 5.6082 5.6190 5.6818 5.6994 5.7667 5.7827 6.1598 6.1961 6.2327 6.2680 6.4498 6.4942 6.5780 6.6039 6.6255 6.6344 6.7436 6.7462 6.7931 6.8011 6.9858 7.0198 7.5411 7.5635 7.7051 7.8144 7.8153 7.9712 8.3296 8.4397 8.4917 8.5448 8.6459 8.7161 8.9832 9.0067 9.3397 9.3685 9.4260 9.4418 10.4682 10.5185 10.5501 10.5660 10.5985 10.6522 11.5709 11.6245 11.6358 11.6453 11.6708 11.6905 12.8959 12.9356 13.0052 13.0187 13.0222 13.0296 k = 0.0455 0.0455 0.0455 ( 8985 PWs) bands (ev): -31.1815 -31.1815 -31.1712 -31.1712 -31.1705 -31.1705 -31.1698 -31.1698 -12.4659 -12.4644 -12.4625 -12.4623 -12.4601 -12.4595 -12.4165 -12.4165 -12.1105 -12.1096 -12.1053 -12.1038 -12.0973 -12.0904 -12.0768 -12.0723 -12.0723 -12.0668 -12.0580 -12.0553 -12.0368 -12.0361 -12.0357 -12.0349 -0.2049 -0.2046 1.3683 1.3853 1.5050 1.5060 1.6257 1.6373 4.0079 4.0296 4.0592 4.0887 4.3040 4.3917 4.3933 4.4069 4.4214 4.4317 4.9867 5.0541 5.3262 5.3694 5.4014 5.4462 5.5459 5.5888 5.6164 5.6222 5.6641 5.6871 5.7758 5.7954 6.1455 6.1924 6.2417 6.2872 6.4406 6.4930 6.5694 6.6095 6.6319 6.6410 6.7376 6.7393 6.8004 6.8128 6.9815 7.0259 7.5014 7.5216 7.7003 7.8014 7.8622 8.0160 8.2875 8.3935 8.5003 8.5365 8.6731 8.7610 9.0005 9.0279 9.3111 9.3532 9.4276 9.4460 10.4526 10.4990 10.5554 10.5957 10.6121 10.6913 11.5616 11.6263 11.6321 11.6412 11.6820 11.7059 12.8511 12.8928 13.0057 13.0193 13.0224 13.0314 k = 0.0568 0.0568 0.0568 ( 8970 PWs) bands (ev): -31.1814 -31.1814 -31.1714 -31.1714 -31.1705 -31.1705 -31.1697 -31.1697 -12.4664 -12.4649 -12.4625 -12.4621 -12.4594 -12.4588 -12.4168 -12.4168 -12.1112 -12.1100 -12.1048 -12.1028 -12.0979 -12.0893 -12.0778 -12.0724 -12.0723 -12.0654 -12.0584 -12.0551 -12.0374 -12.0363 -12.0359 -12.0347 -0.1947 -0.1943 1.3344 1.3515 1.5023 1.5028 1.6520 1.6631 4.0024 4.0282 4.0641 4.1016 4.2968 4.3884 4.3965 4.4063 4.4348 4.4379 4.9780 5.0605 5.3049 5.3603 5.3971 5.4536 5.5385 5.5848 5.6245 5.6248 5.6471 5.6750 5.7843 5.8058 6.1328 6.1892 6.2513 6.3057 6.4321 6.4888 6.5618 6.6177 6.6378 6.6451 6.7333 6.7340 6.8072 6.8252 6.9775 7.0314 7.4644 7.4805 7.6911 7.7867 7.9095 8.0620 8.2442 8.3475 8.5064 8.5283 8.6995 8.8045 9.0236 9.0522 9.2812 9.3381 9.4287 9.4479 10.4323 10.4734 10.5660 10.6295 10.6349 10.7358 11.5521 11.6236 11.6296 11.6368 11.6970 11.7233 12.8074 12.8509 13.0067 13.0201 13.0231 13.0332 k = 0.0682 0.0682 0.0682 ( 8958 PWs) bands (ev): -31.1813 -31.1813 -31.1715 -31.1715 -31.1705 -31.1705 -31.1696 -31.1696 -12.4669 -12.4653 -12.4625 -12.4619 -12.4586 -12.4581 -12.4172 -12.4172 -12.1118 -12.1104 -12.1043 -12.1017 -12.0985 -12.0882 -12.0787 -12.0724 -12.0722 -12.0639 -12.0588 -12.0550 -12.0381 -12.0364 -12.0362 -12.0346 -0.1823 -0.1819 1.3006 1.3179 1.4990 1.4991 1.6762 1.6869 3.9983 4.0276 4.0693 4.1149 4.2910 4.3854 4.3968 4.4058 4.4442 4.4515 4.9696 5.0658 5.2826 5.3511 5.3909 5.4589 5.5314 5.5807 5.6264 5.6310 5.6320 5.6636 5.7923 5.8135 6.1218 6.1862 6.2612 6.3233 6.4244 6.4828 6.5554 6.6268 6.6429 6.6461 6.7287 6.7334 6.8136 6.8387 6.9738 7.0357 7.4301 7.4417 7.6789 7.7706 7.9554 8.1077 8.2003 8.3020 8.5106 8.5199 8.7237 8.8457 9.0519 9.0790 9.2517 9.3241 9.4309 9.4483 10.4075 10.4437 10.5808 10.6500 10.6816 10.7855 11.5420 11.6168 11.6282 11.6322 11.7150 11.7427 12.7669 12.8118 13.0082 13.0208 13.0244 13.0350 k = 0.0795 0.0795 0.0795 ( 8958 PWs) bands (ev): -31.1812 -31.1812 -31.1717 -31.1717 -31.1705 -31.1705 -31.1695 -31.1695 -12.4674 -12.4658 -12.4625 -12.4618 -12.4579 -12.4575 -12.4177 -12.4177 -12.1123 -12.1108 -12.1039 -12.1007 -12.0990 -12.0871 -12.0795 -12.0725 -12.0722 -12.0624 -12.0592 -12.0550 -12.0389 -12.0366 -12.0365 -12.0345 -0.1678 -0.1672 1.2672 1.2846 1.4948 1.4950 1.6982 1.7084 3.9956 4.0280 4.0748 4.1284 4.2864 4.3830 4.3957 4.4054 4.4508 4.4699 4.9617 5.0700 5.2594 5.3423 5.3830 5.4620 5.5246 5.5763 5.6161 5.6261 5.6387 5.6536 5.7998 5.8182 6.1125 6.1834 6.2706 6.3395 6.4173 6.4761 6.5504 6.6354 6.6437 6.6472 6.7261 6.7358 6.8195 6.8535 6.9702 7.0380 7.3989 7.4066 7.6647 7.7530 7.9993 8.1517 8.1568 8.2575 8.5112 8.5132 8.7445 8.8825 9.0845 9.1077 9.2252 9.3119 9.4360 9.4483 10.3788 10.4111 10.5992 10.6730 10.7350 10.8400 11.5308 11.6064 11.6277 11.6278 11.7354 11.7639 12.7308 12.7767 13.0104 13.0213 13.0259 13.0371 k = 0.0909 0.0909 0.0909 ( 8961 PWs) bands (ev): -31.1811 -31.1811 -31.1719 -31.1719 -31.1705 -31.1705 -31.1694 -31.1694 -12.4678 -12.4662 -12.4625 -12.4616 -12.4572 -12.4568 -12.4183 -12.4182 -12.1129 -12.1111 -12.1036 -12.0996 -12.0995 -12.0861 -12.0803 -12.0727 -12.0722 -12.0610 -12.0596 -12.0550 -12.0399 -12.0369 -12.0367 -12.0344 -0.1511 -0.1504 1.2344 1.2518 1.4899 1.4904 1.7178 1.7275 3.9946 4.0297 4.0805 4.1419 4.2833 4.3811 4.3940 4.4052 4.4575 4.4892 4.9542 5.0728 5.2355 5.3343 5.3734 5.4626 5.5181 5.5717 5.6028 5.6222 5.6445 5.6469 5.8069 5.8199 6.1047 6.1806 6.2790 6.3540 6.4110 6.4695 6.5467 6.6388 6.6418 6.6504 6.7262 6.7404 6.8248 6.8697 6.9667 7.0375 7.3709 7.3764 7.6494 7.7338 8.0398 8.1146 8.1925 8.2149 8.5020 8.5143 8.7615 8.9116 9.1201 9.1381 9.2058 9.3026 9.4452 9.4489 10.3474 10.3764 10.6201 10.6977 10.7942 10.8989 11.5182 11.5927 11.6235 11.6282 11.7579 11.7869 12.7002 12.7466 13.0134 13.0215 13.0272 13.0398 k = 0.1023 0.1023 0.1023 ( 8955 PWs) bands (ev): -31.1810 -31.1810 -31.1721 -31.1721 -31.1705 -31.1705 -31.1693 -31.1693 -12.4682 -12.4665 -12.4625 -12.4614 -12.4564 -12.4562 -12.4189 -12.4189 -12.1133 -12.1113 -12.1032 -12.0999 -12.0985 -12.0851 -12.0810 -12.0728 -12.0721 -12.0599 -12.0595 -12.0551 -12.0409 -12.0372 -12.0369 -12.0343 -0.1324 -0.1316 1.2022 1.2197 1.4845 1.4853 1.7347 1.7438 3.9952 4.0326 4.0866 4.1555 4.2814 4.3797 4.3918 4.4053 4.4643 4.5092 4.9473 5.0741 5.2109 5.3273 5.3623 5.4605 5.5118 5.5667 5.5913 5.6145 5.6438 5.6492 5.8137 5.8185 6.0980 6.1776 6.2853 6.3666 6.4054 6.4640 6.5446 6.6324 6.6451 6.6525 6.7294 6.7462 6.8295 6.8873 6.9630 7.0332 7.3465 7.3524 7.6333 7.7130 8.0737 8.0748 8.1770 8.2287 8.4923 8.5134 8.7752 8.9288 9.1567 9.1701 9.1986 9.2977 9.4510 9.4595 10.3141 10.3408 10.6428 10.7236 10.8583 10.9620 11.5040 11.5760 11.6202 11.6294 11.7821 11.8116 12.6758 12.7222 13.0172 13.0214 13.0280 13.0435 k = 0.1136 0.1136 0.1136 ( 8961 PWs) bands (ev): -31.1808 -31.1808 -31.1723 -31.1723 -31.1705 -31.1705 -31.1692 -31.1692 -12.4685 -12.4668 -12.4625 -12.4613 -12.4557 -12.4556 -12.4196 -12.4195 -12.1138 -12.1115 -12.1030 -12.1003 -12.0974 -12.0842 -12.0816 -12.0730 -12.0720 -12.0603 -12.0581 -12.0552 -12.0420 -12.0375 -12.0370 -12.0342 -0.1116 -0.1107 1.1709 1.1884 1.4785 1.4796 1.7488 1.7574 3.9975 4.0370 4.0930 4.1689 4.2808 4.3790 4.3894 4.4058 4.4713 4.5297 4.9411 5.0739 5.1857 5.3216 5.3499 5.4559 5.5058 5.5612 5.5817 5.6045 5.6426 5.6529 5.8143 5.8203 6.0921 6.1744 6.2888 6.3774 6.4003 6.4602 6.5437 6.6251 6.6453 6.6533 6.7350 6.7524 6.8336 6.9060 6.9591 7.0245 7.3259 7.3351 7.6170 7.6906 8.0386 8.0884 8.1559 8.2587 8.4818 8.5101 8.7866 8.9316 9.1905 9.2038 9.2069 9.3007 9.4556 9.4789 10.2801 10.3054 10.6667 10.7500 10.9266 11.0288 11.4883 11.5570 11.6179 11.6312 11.8078 11.8379 12.6579 12.7038 13.0209 13.0217 13.0279 13.0482 k = 0.1250 0.1250 0.1250 ( 8955 PWs) bands (ev): -31.1807 -31.1807 -31.1725 -31.1725 -31.1706 -31.1706 -31.1692 -31.1692 -12.4687 -12.4670 -12.4624 -12.4611 -12.4550 -12.4550 -12.4203 -12.4203 -12.1141 -12.1116 -12.1027 -12.1007 -12.0962 -12.0834 -12.0821 -12.0732 -12.0719 -12.0606 -12.0567 -12.0554 -12.0433 -12.0379 -12.0371 -12.0341 -0.0889 -0.0878 1.1405 1.1580 1.4720 1.4734 1.7599 1.7680 4.0015 4.0430 4.0998 4.1822 4.2816 4.3788 4.3867 4.4066 4.4785 4.5504 4.9356 5.0720 5.1603 5.3172 5.3364 5.4487 5.5002 5.5551 5.5740 5.5940 5.6421 5.6557 5.8075 5.8268 6.0864 6.1708 6.2886 6.3865 6.3956 6.4582 6.5438 6.6177 6.6430 6.6528 6.7421 6.7584 6.8370 6.9253 6.9551 7.0114 7.3095 7.3241 7.6007 7.6664 8.0073 8.0689 8.1661 8.2803 8.4704 8.5042 8.7980 8.9228 9.2152 9.2288 9.2391 9.3171 9.4638 9.5028 10.2464 10.2717 10.6913 10.7768 10.9980 11.0989 11.4714 11.5363 11.6169 11.6336 11.8350 11.8655 12.6466 12.6917 13.0201 13.0270 13.0271 13.0540 k = 0.1364 0.1364 0.1364 ( 8964 PWs) bands (ev): -31.1805 -31.1805 -31.1727 -31.1727 -31.1706 -31.1706 -31.1691 -31.1691 -12.4689 -12.4672 -12.4624 -12.4609 -12.4545 -12.4544 -12.4212 -12.4211 -12.1144 -12.1116 -12.1025 -12.1010 -12.0951 -12.0827 -12.0826 -12.0734 -12.0718 -12.0609 -12.0557 -12.0554 -12.0446 -12.0382 -12.0372 -12.0341 -0.0643 -0.0631 1.1112 1.1287 1.4650 1.4667 1.7679 1.7756 4.0073 4.0506 4.1071 4.1952 4.2836 4.3794 4.3840 4.4079 4.4859 4.5714 4.9310 5.0686 5.1346 5.3140 5.3220 5.4395 5.4949 5.5482 5.5678 5.5834 5.6416 5.6576 5.7985 5.8332 6.0804 6.1666 6.2846 6.3912 6.3941 6.4576 6.5445 6.6107 6.6390 6.6510 6.7496 6.7638 6.8398 6.9442 6.9509 6.9949 7.2976 7.3184 7.5846 7.6407 7.9825 8.0376 8.1844 8.2918 8.4577 8.4955 8.8117 8.9088 9.2283 9.2593 9.2761 9.3491 9.4765 9.5299 10.2143 10.2409 10.7160 10.8035 11.0714 11.1721 11.4542 11.5147 11.6175 11.6365 11.8632 11.8944 12.6415 12.6855 13.0188 13.0255 13.0330 13.0604 k = 0.1477 0.1477 0.1477 ( 8976 PWs) bands (ev): -31.1803 -31.1803 -31.1729 -31.1729 -31.1706 -31.1706 -31.1691 -31.1691 -12.4691 -12.4674 -12.4623 -12.4607 -12.4539 -12.4537 -12.4221 -12.4220 -12.1146 -12.1115 -12.1024 -12.1013 -12.0939 -12.0830 -12.0821 -12.0736 -12.0718 -12.0612 -12.0559 -12.0541 -12.0460 -12.0384 -12.0373 -12.0341 -0.0379 -0.0365 1.0831 1.1006 1.4576 1.4596 1.7727 1.7800 4.0148 4.0598 4.1148 4.2078 4.2868 4.3806 4.3813 4.4097 4.4934 4.5925 4.9272 5.0639 5.1088 5.3069 5.3119 5.4288 5.4902 5.5405 5.5629 5.5730 5.6409 5.6588 5.7876 5.8394 6.0739 6.1619 6.2772 6.3870 6.4006 6.4575 6.5455 6.6042 6.6338 6.6477 6.7565 6.7684 6.8417 6.9467 6.9614 6.9764 7.2905 7.3158 7.5686 7.6136 7.9656 8.0069 8.1981 8.2915 8.4433 8.4840 8.8298 8.8956 9.2347 9.2934 9.3145 9.3910 9.4947 9.5590 10.1848 10.2147 10.7407 10.8300 11.1455 11.2479 11.4376 11.4932 11.6202 11.6399 11.8923 11.9242 12.6422 12.6849 13.0171 13.0232 13.0396 13.0675 k = 0.1591 0.1591 0.1591 ( 8970 PWs) bands (ev): -31.1801 -31.1801 -31.1731 -31.1731 -31.1706 -31.1706 -31.1691 -31.1691 -12.4692 -12.4675 -12.4622 -12.4606 -12.4534 -12.4531 -12.4230 -12.4229 -12.1148 -12.1113 -12.1023 -12.1016 -12.0927 -12.0834 -12.0816 -12.0739 -12.0719 -12.0614 -12.0560 -12.0529 -12.0475 -12.0386 -12.0373 -12.0340 -0.0097 -0.0082 1.0562 1.0736 1.4497 1.4520 1.7743 1.7813 4.0240 4.0707 4.1231 4.2200 4.2913 4.3787 4.3825 4.4121 4.5012 4.6137 4.9243 5.0579 5.0830 5.2911 5.3107 5.4170 5.4860 5.5319 5.5587 5.5631 5.6401 5.6595 5.7753 5.8453 6.0664 6.1563 6.2669 6.3827 6.4063 6.4565 6.5464 6.5986 6.6277 6.6429 6.7626 6.7720 6.8427 6.9426 6.9574 6.9757 7.2881 7.3139 7.5529 7.5859 7.9577 7.9803 8.2035 8.2788 8.4268 8.4699 8.8534 8.8876 9.2392 9.3277 9.3536 9.4376 9.5193 9.5891 10.1593 10.1946 10.7651 10.8562 11.2180 11.3257 11.4230 11.4725 11.6259 11.6437 11.9221 11.9548 12.6481 12.6895 13.0150 13.0201 13.0466 13.0749 k = 0.1705 0.1705 0.1705 ( 8988 PWs) bands (ev): -31.1799 -31.1799 -31.1732 -31.1732 -31.1707 -31.1707 -31.1691 -31.1691 -12.4692 -12.4675 -12.4622 -12.4604 -12.4529 -12.4525 -12.4240 -12.4239 -12.1149 -12.1111 -12.1022 -12.1018 -12.0914 -12.0837 -12.0813 -12.0741 -12.0720 -12.0616 -12.0561 -12.0518 -12.0490 -12.0388 -12.0373 -12.0341 0.0201 0.0218 1.0308 1.0481 1.4414 1.4440 1.7728 1.7794 4.0347 4.0832 4.1318 4.2317 4.2971 4.3763 4.3851 4.4152 4.5093 4.6348 4.9225 5.0511 5.0573 5.2750 5.3099 5.4045 5.4826 5.5225 5.5536 5.5548 5.6392 5.6596 5.7617 5.8509 6.0580 6.1499 6.2545 6.3782 6.4111 6.4533 6.5472 6.5938 6.6205 6.6366 6.7676 6.7745 6.8428 6.9389 6.9393 6.9860 7.2897 7.3103 7.5373 7.5587 7.9596 7.9597 8.1998 8.2547 8.4078 8.4527 8.8826 8.8876 9.2439 9.3604 9.3929 9.4861 9.5506 9.6192 10.1388 10.1817 10.7890 10.8818 11.2842 11.4048 11.4132 11.4534 11.6364 11.6483 11.9522 11.9860 12.6583 12.6986 13.0123 13.0162 13.0540 13.0825 k = 0.1818 0.1818 0.1818 ( 8976 PWs) bands (ev): -31.1797 -31.1797 -31.1734 -31.1734 -31.1707 -31.1707 -31.1691 -31.1691 -12.4692 -12.4675 -12.4621 -12.4602 -12.4525 -12.4519 -12.4250 -12.4249 -12.1149 -12.1108 -12.1021 -12.1020 -12.0901 -12.0839 -12.0811 -12.0744 -12.0724 -12.0618 -12.0561 -12.0508 -12.0505 -12.0389 -12.0373 -12.0341 0.0514 0.0533 1.0067 1.0239 1.4328 1.4357 1.7681 1.7745 4.0470 4.0972 4.1411 4.2429 4.3042 4.3741 4.3885 4.4189 4.5177 4.6558 4.9217 5.0319 5.0436 5.2586 5.3092 5.3918 5.4799 5.5121 5.5446 5.5512 5.6381 5.6595 5.7471 5.8560 6.0485 6.1426 6.2405 6.3735 6.4152 6.4469 6.5479 6.5898 6.6118 6.6285 6.7712 6.7760 6.8421 6.9235 6.9355 6.9919 7.2937 7.3030 7.5219 7.5332 7.9459 7.9719 8.1877 8.2211 8.3859 8.4314 8.8970 8.9169 9.2498 9.3911 9.4318 9.5350 9.5880 9.6493 10.1246 10.1770 10.8123 10.9069 11.3330 11.4161 11.4367 11.4839 11.6546 11.6550 11.9826 12.0175 12.6721 12.7114 13.0089 13.0113 13.0616 13.0901 k = 0.1932 0.1932 0.1932 ( 8970 PWs) bands (ev): -31.1795 -31.1795 -31.1736 -31.1736 -31.1707 -31.1707 -31.1691 -31.1691 -12.4691 -12.4674 -12.4620 -12.4600 -12.4520 -12.4513 -12.4260 -12.4260 -12.1148 -12.1105 -12.1022 -12.1021 -12.0889 -12.0841 -12.0809 -12.0747 -12.0728 -12.0620 -12.0559 -12.0520 -12.0498 -12.0389 -12.0372 -12.0341 0.0841 0.0862 0.9842 1.0013 1.4238 1.4270 1.7603 1.7666 4.0606 4.1125 4.1510 4.2534 4.3125 4.3724 4.3925 4.4234 4.5265 4.6766 4.9220 5.0068 5.0358 5.2422 5.3083 5.3790 5.4781 5.5010 5.5363 5.5475 5.6371 5.6590 5.7318 5.8605 6.0380 6.1342 6.2255 6.3682 6.4184 6.4369 6.5488 6.5865 6.6013 6.6187 6.7736 6.7764 6.8405 6.9109 6.9327 6.9937 7.2905 7.2977 7.5064 7.5104 7.9396 7.9942 8.1698 8.1802 8.3610 8.4050 8.9156 8.9558 9.2575 9.4205 9.4695 9.5836 9.6302 9.6796 10.1175 10.1809 10.8349 10.9313 11.3509 11.4228 11.4399 11.5584 11.6665 11.6867 12.0130 12.0492 12.6885 12.7270 13.0049 13.0055 13.0693 13.0976 k = 0.2045 0.2045 0.2045 ( 8958 PWs) bands (ev): -31.1793 -31.1793 -31.1737 -31.1737 -31.1708 -31.1708 -31.1692 -31.1692 -12.4689 -12.4673 -12.4618 -12.4598 -12.4516 -12.4508 -12.4271 -12.4270 -12.1146 -12.1101 -12.1023 -12.1022 -12.0876 -12.0842 -12.0809 -12.0749 -12.0735 -12.0622 -12.0556 -12.0535 -12.0490 -12.0390 -12.0370 -12.0341 0.1182 0.1205 0.9633 0.9802 1.4144 1.4180 1.7496 1.7558 4.0754 4.1292 4.1614 4.2633 4.3222 4.3711 4.3973 4.4287 4.5358 4.6973 4.9234 4.9820 5.0278 5.2259 5.3068 5.3664 5.4771 5.4890 5.5286 5.5437 5.6362 5.6582 5.7159 5.8643 6.0267 6.1247 6.2099 6.3623 6.4206 6.4229 6.5500 6.5836 6.5885 6.6072 6.7746 6.7757 6.8384 6.9019 6.9303 6.9919 7.2726 7.2996 7.4907 7.4909 7.9384 8.0255 8.1340 8.1514 8.3334 8.3730 8.9426 8.9983 9.2672 9.4495 9.5056 9.6312 9.6758 9.7111 10.1182 10.1927 10.8568 10.9550 11.3522 11.4121 11.4664 11.6118 11.6997 11.7350 12.0430 12.0809 12.7064 12.7443 12.9984 13.0000 13.0772 13.1048 k = 0.2159 0.2159 0.2159 ( 8964 PWs) bands (ev): -31.1790 -31.1790 -31.1738 -31.1738 -31.1708 -31.1708 -31.1692 -31.1692 -12.4687 -12.4671 -12.4617 -12.4596 -12.4513 -12.4503 -12.4282 -12.4282 -12.1144 -12.1096 -12.1024 -12.1022 -12.0863 -12.0843 -12.0809 -12.0752 -12.0744 -12.0624 -12.0552 -12.0549 -12.0484 -12.0390 -12.0369 -12.0342 0.1535 0.1561 0.9440 0.9607 1.4048 1.4087 1.7361 1.7422 4.0913 4.1468 4.1724 4.2725 4.3332 4.3703 4.4026 4.4349 4.5456 4.7177 4.9260 4.9577 5.0199 5.2100 5.3045 5.3540 5.4763 5.4769 5.5216 5.5396 5.6356 5.6572 5.6995 5.8672 6.0147 6.1140 6.1940 6.3556 6.4051 6.4217 6.5516 6.5732 6.5812 6.5938 6.7738 6.7740 6.8358 6.8965 6.9283 6.9873 7.2503 7.2978 7.4738 7.4752 7.9359 8.0633 8.0840 8.1417 8.3049 8.3348 8.9767 9.0439 9.2793 9.4790 9.5400 9.6776 9.7235 9.7445 10.1270 10.2117 10.8778 10.9778 11.3511 11.4048 11.4826 11.6318 11.7661 11.7985 12.0724 12.1123 12.7244 12.7620 12.9899 12.9940 13.0851 13.1117 k = 0.2273 0.2273 0.2273 ( 8967 PWs) bands (ev): -31.1788 -31.1788 -31.1740 -31.1740 -31.1709 -31.1709 -31.1693 -31.1693 -12.4685 -12.4669 -12.4616 -12.4594 -12.4510 -12.4499 -12.4294 -12.4293 -12.1141 -12.1092 -12.1025 -12.1023 -12.0852 -12.0842 -12.0810 -12.0754 -12.0753 -12.0628 -12.0562 -12.0547 -12.0478 -12.0390 -12.0367 -12.0342 0.1898 0.1927 0.9264 0.9429 1.3949 1.3991 1.7199 1.7260 4.1080 4.1653 4.1839 4.2811 4.3456 4.3703 4.4085 4.4420 4.5560 4.7378 4.9297 4.9340 5.0122 5.1945 5.3012 5.3420 5.4629 5.4774 5.5154 5.5353 5.6352 5.6559 5.6830 5.8689 6.0022 6.1022 6.1782 6.3481 6.3838 6.4217 6.5538 6.5555 6.5787 6.5790 6.7709 6.7720 6.8330 6.8943 6.9264 6.9804 7.2249 7.2917 7.4591 7.4593 7.9227 8.0318 8.1009 8.1515 8.2815 8.2905 9.0169 9.0923 9.2940 9.5096 9.5731 9.7230 9.7725 9.7805 10.1435 10.2364 10.8978 10.9999 11.3514 11.4010 11.4889 11.6376 11.8454 11.8721 12.1010 12.1435 12.7409 12.7785 12.9798 12.9870 13.0931 13.1181 k = 0.2386 0.2386 0.2386 ( 8982 PWs) bands (ev): -31.1785 -31.1785 -31.1741 -31.1741 -31.1709 -31.1709 -31.1694 -31.1694 -12.4682 -12.4667 -12.4614 -12.4592 -12.4507 -12.4495 -12.4306 -12.4305 -12.1138 -12.1087 -12.1025 -12.1025 -12.0847 -12.0833 -12.0811 -12.0765 -12.0757 -12.0633 -12.0573 -12.0542 -12.0474 -12.0391 -12.0365 -12.0344 0.2271 0.2303 0.9105 0.9268 1.3847 1.3893 1.7013 1.7074 4.1254 4.1845 4.1960 4.2891 4.3591 4.3709 4.4148 4.4503 4.5672 4.7577 4.9109 4.9345 5.0050 5.1796 5.2969 5.3305 5.4490 5.4782 5.5102 5.5307 5.6352 5.6543 5.6663 5.8694 5.9893 6.0891 6.1625 6.3396 6.3595 6.4204 6.5356 6.5563 6.5618 6.5771 6.7669 6.7686 6.8302 6.8944 6.9244 6.9717 7.1983 7.2815 7.4432 7.4457 7.8948 7.9783 8.1208 8.1854 8.2404 8.2802 9.0621 9.1430 9.3115 9.5417 9.6056 9.7675 9.8192 9.8220 10.1671 10.2656 10.9169 11.0209 11.3541 11.4006 11.4879 11.6384 11.9277 11.9514 12.1283 12.1742 12.7542 12.7922 12.9679 12.9788 13.1014 13.1241 k = 0.2500 0.2500 0.2500 ( 9009 PWs) bands (ev): -31.1783 -31.1783 -31.1742 -31.1742 -31.1710 -31.1710 -31.1695 -31.1695 -12.4678 -12.4664 -12.4613 -12.4590 -12.4505 -12.4492 -12.4318 -12.4317 -12.1133 -12.1082 -12.1027 -12.1025 -12.0847 -12.0821 -12.0814 -12.0777 -12.0759 -12.0641 -12.0581 -12.0537 -12.0471 -12.0391 -12.0362 -12.0345 0.2653 0.2687 0.8963 0.9125 1.3742 1.3792 1.6805 1.6866 4.1432 4.2041 4.2086 4.2966 4.3724 4.3738 4.4214 4.4598 4.5791 4.7772 4.8885 4.9405 4.9982 5.1657 5.2916 5.3194 5.4345 5.4789 5.5061 5.5257 5.6358 5.6496 5.6524 5.8685 5.9762 6.0749 6.1474 6.3300 6.3326 6.4177 6.5137 6.5433 6.5590 6.5756 6.7619 6.7640 6.8275 6.8956 6.9222 6.9615 7.1720 7.2683 7.4269 7.4331 7.8559 7.9244 8.1059 8.1852 8.2395 8.3176 9.1115 9.1958 9.3318 9.5755 9.6385 9.8117 9.8603 9.8716 10.1970 10.2979 10.9348 11.0409 11.3593 11.4036 11.4817 11.6361 12.0096 12.0334 12.1540 12.2046 12.7623 12.8014 12.9540 12.9694 13.1101 13.1294 k = 0.2614 0.2614 0.2614 ( 8997 PWs) bands (ev): -31.1780 -31.1780 -31.1743 -31.1743 -31.1710 -31.1710 -31.1696 -31.1696 -12.4674 -12.4660 -12.4611 -12.4588 -12.4503 -12.4489 -12.4330 -12.4329 -12.1128 -12.1076 -12.1029 -12.1025 -12.0847 -12.0816 -12.0807 -12.0789 -12.0761 -12.0650 -12.0585 -12.0531 -12.0468 -12.0391 -12.0360 -12.0346 0.3041 0.3078 0.8840 0.8999 1.3635 1.3689 1.6575 1.6637 4.1614 4.2218 4.2240 4.3036 4.3748 4.3893 4.4282 4.4709 4.5920 4.7965 4.8668 4.9474 4.9922 5.1528 5.2854 5.3088 5.4195 5.4788 5.5035 5.5205 5.6331 5.6370 5.6502 5.8659 5.9630 6.0595 6.1327 6.3038 6.3192 6.4138 6.4901 6.5232 6.5613 6.5748 6.7560 6.7586 6.8249 6.8967 6.9195 6.9501 7.1474 7.2531 7.4104 7.4209 7.8109 7.8709 8.0680 8.1257 8.3085 8.3819 9.1644 9.2506 9.3551 9.6113 9.6725 9.8561 9.9034 9.9210 10.2319 10.3324 10.9514 11.0597 11.3664 11.4097 11.4716 11.6310 12.0891 12.1161 12.1776 12.2355 12.7637 12.8046 12.9380 12.9587 13.1193 13.1341 k = 0.2727 0.2727 0.2727 ( 8985 PWs) bands (ev): -31.1778 -31.1778 -31.1744 -31.1744 -31.1711 -31.1711 -31.1697 -31.1697 -12.4669 -12.4656 -12.4609 -12.4585 -12.4501 -12.4486 -12.4342 -12.4341 -12.1121 -12.1072 -12.1031 -12.1024 -12.0846 -12.0819 -12.0801 -12.0793 -12.0763 -12.0660 -12.0587 -12.0526 -12.0467 -12.0391 -12.0358 -12.0347 0.3434 0.3475 0.8734 0.8891 1.3526 1.3583 1.6328 1.6391 4.1795 4.2354 4.2439 4.3101 4.3781 4.4053 4.4350 4.4839 4.6059 4.8154 4.8459 4.9553 4.9869 5.1414 5.2784 5.2987 5.4042 5.4776 5.5026 5.5149 5.6169 5.6389 5.6474 5.8615 5.9499 6.0431 6.1187 6.2735 6.3072 6.4085 6.4650 6.5015 6.5625 6.5753 6.7493 6.7524 6.8224 6.8964 6.9162 6.9376 7.1256 7.2370 7.3937 7.4088 7.7630 7.8184 8.0203 8.0629 8.3887 8.4599 9.2205 9.3073 9.3814 9.6490 9.7080 9.9012 9.9480 9.9699 10.2706 10.3683 10.9666 11.0772 11.3744 11.4186 11.4590 11.6231 12.1626 12.1980 12.1985 12.2689 12.7575 12.8011 12.9201 12.9463 13.1291 13.1380 k = 0.2841 0.2841 0.2841 ( 8979 PWs) bands (ev): -31.1775 -31.1775 -31.1744 -31.1744 -31.1711 -31.1711 -31.1698 -31.1698 -12.4664 -12.4652 -12.4607 -12.4583 -12.4500 -12.4484 -12.4354 -12.4353 -12.1114 -12.1068 -12.1033 -12.1022 -12.0846 -12.0822 -12.0813 -12.0779 -12.0766 -12.0671 -12.0588 -12.0521 -12.0466 -12.0392 -12.0356 -12.0348 0.3831 0.3876 0.8647 0.8802 1.3414 1.3475 1.6064 1.6128 4.1976 4.2496 4.2638 4.3164 4.3824 4.4212 4.4417 4.4993 4.6206 4.8260 4.8339 4.9637 4.9824 5.1316 5.2707 5.2890 5.3886 5.4751 5.5031 5.5089 5.6011 5.6414 5.6441 5.8553 5.9371 6.0259 6.1052 6.2425 6.2937 6.4017 6.4386 6.4785 6.5624 6.5770 6.7419 6.7457 6.8200 6.8939 6.9120 6.9241 7.1078 7.2207 7.3768 7.3969 7.7139 7.7675 7.9680 7.9978 8.4777 8.5467 9.2794 9.3658 9.4107 9.6888 9.7453 9.9474 9.9938 10.0183 10.3122 10.4047 10.9803 11.0931 11.3800 11.4301 11.4469 11.6121 12.2159 12.2227 12.2779 12.3109 12.7437 12.7910 12.9007 12.9316 13.1392 13.1406 k = 0.2955 0.2955 0.2955 ( 8973 PWs) bands (ev): -31.1772 -31.1772 -31.1745 -31.1745 -31.1712 -31.1712 -31.1699 -31.1699 -12.4659 -12.4647 -12.4605 -12.4581 -12.4499 -12.4482 -12.4365 -12.4365 -12.1107 -12.1064 -12.1036 -12.1019 -12.0846 -12.0827 -12.0824 -12.0769 -12.0765 -12.0680 -12.0587 -12.0516 -12.0465 -12.0393 -12.0356 -12.0349 0.4231 0.4280 0.8579 0.8731 1.3300 1.3364 1.5786 1.5851 4.2154 4.2641 4.2836 4.3224 4.3877 4.4365 4.4483 4.5175 4.6362 4.8074 4.8522 4.9725 4.9788 5.1241 5.2625 5.2797 5.3727 5.4717 5.5026 5.5044 5.5859 5.6402 5.6446 5.8473 5.9247 6.0079 6.0919 6.2115 6.2787 6.3934 6.4111 6.4542 6.5615 6.5791 6.7340 6.7386 6.8176 6.8882 6.9068 6.9100 7.0944 7.2051 7.3598 7.3849 7.6651 7.7185 7.9137 7.9316 8.5738 8.6400 9.3408 9.4260 9.4428 9.7305 9.7846 9.9947 10.0404 10.0659 10.3556 10.4413 10.9922 11.1073 11.3762 11.4422 11.4437 11.5977 12.2286 12.2624 12.3545 12.3668 12.7235 12.7752 12.8804 12.9144 13.1407 13.1411 k = 0.3068 0.3068 0.3068 ( 8979 PWs) bands (ev): -31.1770 -31.1770 -31.1745 -31.1745 -31.1713 -31.1713 -31.1701 -31.1701 -12.4653 -12.4642 -12.4603 -12.4579 -12.4499 -12.4481 -12.4378 -12.4377 -12.1098 -12.1062 -12.1039 -12.1015 -12.0846 -12.0838 -12.0828 -12.0774 -12.0751 -12.0686 -12.0585 -12.0512 -12.0465 -12.0394 -12.0357 -12.0350 0.4632 0.4684 0.8529 0.8678 1.3183 1.3250 1.5496 1.5563 4.2327 4.2791 4.3033 4.3281 4.3940 4.4508 4.4544 4.5386 4.6521 4.7904 4.8702 4.9762 4.9810 5.1194 5.2540 5.2708 5.3567 5.4676 5.4958 5.5060 5.5713 5.6355 5.6482 5.8374 5.9129 5.9896 6.0783 6.1814 6.2619 6.3825 6.3833 6.4288 6.5602 6.5811 6.7260 6.7313 6.8151 6.8793 6.8952 6.9006 7.0858 7.1904 7.3427 7.3728 7.6172 7.6718 7.8590 7.8655 8.6759 8.7387 9.4044 9.4777 9.4877 9.7741 9.8256 10.0434 10.0877 10.1128 10.4001 10.4776 11.0021 11.1196 11.3587 11.4489 11.4592 11.5797 12.2355 12.2866 12.4267 12.4300 12.6981 12.7545 12.8602 12.8953 13.1049 13.1362 k = 0.3182 0.3182 0.3182 ( 8985 PWs) bands (ev): -31.1767 -31.1767 -31.1745 -31.1745 -31.1713 -31.1713 -31.1702 -31.1702 -12.4647 -12.4637 -12.4601 -12.4577 -12.4499 -12.4481 -12.4390 -12.4389 -12.1089 -12.1061 -12.1042 -12.1011 -12.0850 -12.0847 -12.0832 -12.0780 -12.0736 -12.0690 -12.0583 -12.0509 -12.0466 -12.0396 -12.0358 -12.0350 0.5032 0.5088 0.8497 0.8644 1.3063 1.3134 1.5196 1.5264 4.2495 4.2944 4.3227 4.3336 4.4013 4.4602 4.4641 4.5625 4.6674 4.7761 4.8879 4.9745 4.9886 5.1181 5.2452 5.2623 5.3406 5.4630 5.4887 5.5077 5.5576 5.6298 5.6521 5.8258 5.9018 5.9712 6.0634 6.1534 6.2432 6.3529 6.3714 6.4025 6.5588 6.5824 6.7181 6.7241 6.8126 6.8674 6.8801 6.8931 7.0813 7.1772 7.3256 7.3605 7.5710 7.6272 7.8009 7.8051 8.7828 8.8418 9.4701 9.5152 9.5509 9.8196 9.8682 10.0934 10.1357 10.1589 10.4449 10.5132 11.0099 11.1296 11.3316 11.4627 11.4764 11.5579 12.2352 12.3009 12.4925 12.4929 12.6688 12.7298 12.8412 12.8756 13.0726 13.1189 k = 0.3295 0.3295 0.3295 ( 9000 PWs) bands (ev): -31.1765 -31.1765 -31.1746 -31.1746 -31.1714 -31.1714 -31.1704 -31.1704 -12.4640 -12.4632 -12.4599 -12.4575 -12.4499 -12.4481 -12.4402 -12.4400 -12.1080 -12.1061 -12.1045 -12.1006 -12.0861 -12.0847 -12.0836 -12.0789 -12.0722 -12.0691 -12.0581 -12.0507 -12.0467 -12.0398 -12.0360 -12.0351 0.5430 0.5490 0.8484 0.8629 1.2940 1.3014 1.4888 1.4958 4.2656 4.3101 4.3390 4.3419 4.4095 4.4656 4.4763 4.5891 4.6797 4.7669 4.9053 4.9739 4.9947 5.1209 5.2363 5.2541 5.3247 5.4579 5.4811 5.5092 5.5447 5.6229 5.6561 5.8128 5.8916 5.9532 6.0464 6.1288 6.2223 6.3226 6.3574 6.3754 6.5573 6.5827 6.7108 6.7169 6.8097 6.8532 6.8650 6.8845 7.0802 7.1654 7.3086 7.3480 7.5268 7.5845 7.7392 7.7531 8.8937 8.9488 9.5376 9.5551 9.6154 9.8670 9.9121 10.1444 10.1841 10.2042 10.4894 10.5476 11.0155 11.1372 11.2985 11.4798 11.4949 11.5322 12.2263 12.3069 12.5498 12.5509 12.6364 12.7024 12.8248 12.8576 13.0434 13.0904 k = 0.3409 0.3409 0.3409 ( 8997 PWs) bands (ev): -31.1762 -31.1762 -31.1746 -31.1746 -31.1715 -31.1715 -31.1706 -31.1706 -12.4634 -12.4626 -12.4596 -12.4573 -12.4500 -12.4481 -12.4413 -12.4411 -12.1070 -12.1061 -12.1048 -12.1000 -12.0871 -12.0848 -12.0840 -12.0799 -12.0708 -12.0688 -12.0578 -12.0505 -12.0467 -12.0402 -12.0363 -12.0352 0.5825 0.5889 0.8490 0.8632 1.2814 1.2891 1.4573 1.4645 4.2810 4.3261 4.3443 4.3609 4.4186 4.4704 4.4876 4.6178 4.6850 4.7666 4.9224 4.9743 4.9991 5.1280 5.2275 5.2461 5.3090 5.4523 5.4733 5.5105 5.5327 5.6147 5.6597 5.7986 5.8825 5.9361 6.0264 6.1083 6.1991 6.2916 6.3411 6.3477 6.5559 6.5818 6.7044 6.7102 6.8066 6.8377 6.8499 6.8745 7.0817 7.1553 7.2919 7.3351 7.4850 7.5428 7.6822 7.7039 9.0078 9.0588 9.5975 9.6068 9.6810 9.9161 9.9570 10.1964 10.2330 10.2486 10.5332 10.5807 11.0185 11.1420 11.2612 11.4985 11.5026 11.5146 12.2082 12.3044 12.5967 12.5991 12.6009 12.6745 12.8123 12.8435 13.0172 13.0590 k = 0.3523 0.3523 0.3523 ( 8991 PWs) bands (ev): -31.1760 -31.1760 -31.1745 -31.1745 -31.1716 -31.1716 -31.1708 -31.1708 -12.4627 -12.4621 -12.4594 -12.4570 -12.4501 -12.4482 -12.4425 -12.4422 -12.1062 -12.1059 -12.1052 -12.0994 -12.0880 -12.0849 -12.0845 -12.0810 -12.0693 -12.0683 -12.0575 -12.0503 -12.0468 -12.0405 -12.0365 -12.0354 0.6214 0.6283 0.8514 0.8653 1.2684 1.2764 1.4255 1.4328 4.2956 4.3424 4.3495 4.3795 4.4284 4.4748 4.4981 4.6485 4.6814 4.7772 4.9392 4.9759 5.0018 5.1387 5.2188 5.2382 5.2941 5.4463 5.4652 5.5113 5.5216 5.6050 5.6626 5.7835 5.8746 5.9203 6.0039 6.0918 6.1736 6.2601 6.3197 6.3224 6.5546 6.5796 6.6993 6.7039 6.8031 6.8216 6.8353 6.8634 7.0848 7.1467 7.2756 7.3217 7.4458 7.5013 7.6318 7.6583 9.1243 9.1711 9.6420 9.6775 9.7475 9.9670 10.0026 10.2491 10.2823 10.2920 10.5758 10.6119 11.0190 11.1438 11.2206 11.4690 11.5181 11.5355 12.1807 12.2928 12.5619 12.6119 12.6375 12.6621 12.8047 12.8348 12.9943 13.0290 k = 0.3636 0.3636 0.3636 ( 8985 PWs) bands (ev): -31.1757 -31.1757 -31.1745 -31.1745 -31.1717 -31.1717 -31.1709 -31.1709 -12.4620 -12.4615 -12.4591 -12.4568 -12.4502 -12.4483 -12.4436 -12.4432 -12.1064 -12.1055 -12.1048 -12.0988 -12.0889 -12.0851 -12.0849 -12.0821 -12.0679 -12.0676 -12.0571 -12.0502 -12.0469 -12.0409 -12.0367 -12.0356 0.6598 0.6670 0.8556 0.8693 1.2550 1.2633 1.3933 1.4008 4.3094 4.3546 4.3590 4.3977 4.4387 4.4787 4.5077 4.6719 4.6809 4.7954 4.9555 4.9787 5.0036 5.1520 5.2104 5.2304 5.2806 5.4398 5.4571 5.5112 5.5115 5.5935 5.6643 5.7679 5.8682 5.9064 5.9802 6.0782 6.1458 6.2283 6.2914 6.3013 6.5533 6.5763 6.6955 6.6983 6.7990 6.8054 6.8213 6.8513 7.0891 7.1397 7.2600 7.3076 7.4092 7.4591 7.5893 7.6169 9.2423 9.2851 9.6886 9.7496 9.8145 10.0195 10.0487 10.3022 10.3320 10.3343 10.6166 10.6408 11.0168 11.1425 11.1774 11.4317 11.5383 11.5576 12.1447 12.2721 12.5191 12.5840 12.6617 12.6745 12.8023 12.8325 12.9748 13.0022 k = 0.3750 0.3750 0.3750 ( 8985 PWs) bands (ev): -31.1755 -31.1755 -31.1745 -31.1745 -31.1718 -31.1718 -31.1711 -31.1711 -12.4613 -12.4609 -12.4588 -12.4566 -12.4504 -12.4485 -12.4446 -12.4442 -12.1065 -12.1059 -12.1037 -12.0982 -12.0896 -12.0854 -12.0853 -12.0832 -12.0667 -12.0665 -12.0568 -12.0502 -12.0471 -12.0415 -12.0370 -12.0359 0.6974 0.7051 0.8616 0.8750 1.2411 1.2497 1.3611 1.3688 4.3224 4.3596 4.3756 4.4154 4.4494 4.4822 4.5165 4.6596 4.7146 4.8178 4.9706 4.9834 5.0049 5.1657 5.2023 5.2226 5.2699 5.4331 5.4492 5.5015 5.5110 5.5800 5.6643 5.7517 5.8634 5.8950 5.9568 6.0660 6.1163 6.1966 6.2628 6.2778 6.5520 6.5722 6.6932 6.6936 6.7898 6.7944 6.8080 6.8383 7.0941 7.1341 7.2452 7.2928 7.3754 7.4165 7.5548 7.5802 9.3608 9.3999 9.7371 9.8227 9.8816 10.0737 10.0949 10.3553 10.3754 10.3820 10.6553 10.6671 11.0120 11.1324 11.1377 11.3909 11.5588 11.5808 12.1019 12.2430 12.4723 12.5438 12.6675 12.6774 12.8053 12.8364 12.9591 12.9798 k = 0.3864 0.3864 0.3864 ( 8979 PWs) bands (ev): -31.1752 -31.1752 -31.1744 -31.1744 -31.1719 -31.1719 -31.1713 -31.1713 -12.4606 -12.4603 -12.4584 -12.4564 -12.4506 -12.4487 -12.4456 -12.4451 -12.1067 -12.1062 -12.1025 -12.0976 -12.0903 -12.0859 -12.0855 -12.0843 -12.0657 -12.0651 -12.0564 -12.0502 -12.0472 -12.0421 -12.0373 -12.0363 0.7341 0.7422 0.8694 0.8826 1.2267 1.2355 1.3290 1.3368 4.3345 4.3645 4.3924 4.4324 4.4603 4.4853 4.5244 4.6463 4.7496 4.8426 4.9812 4.9932 5.0065 5.1762 5.1944 5.2146 5.2649 5.4262 5.4416 5.4922 5.5095 5.5646 5.6623 5.7351 5.8604 5.8865 5.9350 6.0545 6.0856 6.1652 6.2339 6.2520 6.5507 6.5675 6.6899 6.6921 6.7751 6.7892 6.7955 6.8248 7.0996 7.1300 7.2313 7.2773 7.3443 7.3748 7.5273 7.5485 9.4787 9.5143 9.7875 9.8966 9.9480 10.1296 10.1410 10.4081 10.4150 10.4321 10.6901 10.6916 11.0046 11.0864 11.1294 11.3467 11.5797 11.6053 12.0541 12.2067 12.4217 12.4985 12.6515 12.6607 12.8136 12.8455 12.9476 12.9622 k = 0.3977 0.3977 0.3977 ( 8982 PWs) bands (ev): -31.1750 -31.1750 -31.1743 -31.1743 -31.1720 -31.1720 -31.1715 -31.1715 -12.4599 -12.4597 -12.4581 -12.4562 -12.4509 -12.4490 -12.4466 -12.4460 -12.1069 -12.1066 -12.1013 -12.0970 -12.0908 -12.0864 -12.0858 -12.0853 -12.0646 -12.0637 -12.0560 -12.0503 -12.0474 -12.0428 -12.0375 -12.0367 0.7699 0.7783 0.8790 0.8919 1.2117 1.2207 1.2970 1.3050 4.3458 4.3693 4.4090 4.4486 4.4712 4.4882 4.5313 4.6328 4.7855 4.8686 4.9879 5.0076 5.0087 5.1793 5.1867 5.2063 5.2694 5.4197 5.4345 5.4833 5.5067 5.5475 5.6580 5.7180 5.8595 5.8811 5.9156 6.0430 6.0549 6.1347 6.2046 6.2243 6.5495 6.5627 6.6873 6.6921 6.7615 6.7832 6.7840 6.8111 7.1052 7.1272 7.2185 7.2614 7.3159 7.3355 7.5054 7.5217 9.5946 9.6272 9.8397 9.9711 10.0130 10.1868 10.1873 10.4527 10.4601 10.4821 10.7091 10.7251 10.9949 11.0407 11.1174 11.2996 11.6008 11.6312 12.0036 12.1652 12.3679 12.4494 12.6132 12.6220 12.8262 12.8587 12.9405 12.9489 k = 0.4091 0.4091 0.4091 ( 9006 PWs) bands (ev): -31.1748 -31.1748 -31.1743 -31.1743 -31.1721 -31.1721 -31.1717 -31.1717 -12.4593 -12.4591 -12.4577 -12.4559 -12.4512 -12.4494 -12.4475 -12.4469 -12.1072 -12.1069 -12.1002 -12.0964 -12.0913 -12.0870 -12.0863 -12.0862 -12.0634 -12.0623 -12.0556 -12.0504 -12.0477 -12.0436 -12.0379 -12.0372 0.8046 0.8134 0.8903 0.9030 1.1960 1.2053 1.2654 1.2736 4.3561 4.3740 4.4255 4.4638 4.4818 4.4909 4.5371 4.6193 4.8222 4.8954 4.9941 5.0120 5.0227 5.1742 5.1791 5.1975 5.2835 5.4138 5.4283 5.4747 5.5022 5.5289 5.6515 5.7003 5.8608 5.8785 5.8994 6.0252 6.0309 6.1057 6.1749 6.1950 6.5482 6.5581 6.6858 6.6929 6.7494 6.7734 6.7764 6.7976 7.1109 7.1257 7.2067 7.2452 7.2901 7.2997 7.4879 7.4995 9.7068 9.7369 9.8937 10.0453 10.0753 10.2321 10.2470 10.4884 10.5108 10.5314 10.7235 10.7556 10.9833 10.9968 11.1015 11.2499 11.6224 11.6588 11.9526 12.1205 12.3118 12.3973 12.5551 12.5633 12.8420 12.8751 12.9379 12.9396 k = 0.4205 0.4205 0.4205 ( 8994 PWs) bands (ev): -31.1746 -31.1746 -31.1742 -31.1742 -31.1722 -31.1722 -31.1719 -31.1719 -12.4586 -12.4584 -12.4573 -12.4557 -12.4515 -12.4498 -12.4482 -12.4477 -12.1074 -12.1072 -12.0990 -12.0958 -12.0917 -12.0875 -12.0872 -12.0866 -12.0621 -12.0609 -12.0552 -12.0505 -12.0480 -12.0444 -12.0381 -12.0376 0.8382 0.8473 0.9033 0.9157 1.1796 1.1890 1.2343 1.2426 4.3655 4.3784 4.4417 4.4778 4.4919 4.4936 4.5416 4.6061 4.8593 4.9224 5.0007 5.0165 5.0375 5.1642 5.1714 5.1882 5.3034 5.4091 5.4230 5.4663 5.4957 5.5095 5.6430 5.6817 5.8645 5.8783 5.8870 5.9980 6.0179 6.0789 6.1448 6.1647 6.5469 6.5539 6.6856 6.6944 6.7390 6.7637 6.7688 6.7847 7.1167 7.1255 7.1960 7.2293 7.2666 7.2682 7.4739 7.4816 9.8137 9.8412 9.9498 10.1180 10.1334 10.2765 10.3092 10.5217 10.5597 10.5795 10.7326 10.7830 10.9568 10.9701 11.0818 11.1979 11.6444 11.6882 11.9034 12.0748 12.2544 12.3429 12.4819 12.4886 12.8601 12.8937 12.9344 12.9397 k = 0.4318 0.4318 0.4318 ( 8985 PWs) bands (ev): -31.1744 -31.1743 -31.1741 -31.1741 -31.1723 -31.1723 -31.1721 -31.1721 -12.4580 -12.4578 -12.4568 -12.4554 -12.4518 -12.4504 -12.4489 -12.4484 -12.1076 -12.1075 -12.0978 -12.0951 -12.0919 -12.0881 -12.0880 -12.0871 -12.0607 -12.0596 -12.0548 -12.0507 -12.0483 -12.0453 -12.0384 -12.0380 0.8705 0.8800 0.9180 0.9301 1.1625 1.1720 1.2038 1.2123 4.3739 4.3826 4.4573 4.4904 4.4965 4.5013 4.5447 4.5933 4.8965 4.9493 5.0078 5.0223 5.0514 5.1520 5.1632 5.1781 5.3259 5.4060 5.4187 5.4581 5.4869 5.4898 5.6330 5.6625 5.8707 5.8786 5.8797 5.9748 6.0039 6.0549 6.1145 6.1338 6.5457 6.5502 6.6866 6.6964 6.7303 6.7549 6.7602 6.7729 7.1224 7.1265 7.1863 7.2140 7.2414 7.2455 7.4627 7.4674 9.9134 9.9368 10.0091 10.1855 10.1869 10.3186 10.3746 10.5528 10.6063 10.6250 10.7365 10.8069 10.9231 10.9557 11.0580 11.1442 11.6671 11.7195 11.8588 12.0308 12.1969 12.2869 12.3989 12.4034 12.8796 12.9138 12.9334 12.9458 k = 0.4432 0.4432 0.4432 ( 8981 PWs) bands (ev): -31.1741 -31.1741 -31.1739 -31.1739 -31.1724 -31.1724 -31.1723 -31.1723 -12.4574 -12.4572 -12.4563 -12.4551 -12.4522 -12.4511 -12.4494 -12.4491 -12.1078 -12.1077 -12.0967 -12.0945 -12.0920 -12.0888 -12.0886 -12.0877 -12.0594 -12.0583 -12.0544 -12.0509 -12.0488 -12.0463 -12.0386 -12.0383 0.9015 0.9113 0.9342 0.9461 1.1445 1.1540 1.1741 1.1827 4.3811 4.3865 4.4722 4.4999 4.5014 4.5096 4.5463 4.5810 4.9330 4.9757 5.0154 5.0295 5.0641 5.1390 5.1543 5.1670 5.3489 5.4051 5.4157 5.4502 5.4707 5.4758 5.6219 5.6429 5.8742 5.8795 5.8816 5.9574 5.9890 6.0342 6.0844 6.1028 6.5445 6.5472 6.6889 6.6989 6.7234 6.7469 6.7511 6.7621 7.1281 7.1288 7.1776 7.2000 7.2193 7.2265 7.4537 7.4564 10.0046 10.0195 10.0731 10.2301 10.2480 10.3556 10.4436 10.5823 10.6499 10.6651 10.7390 10.8271 10.8972 10.9403 11.0301 11.0891 11.6905 11.7529 11.8216 11.9910 12.1405 12.2301 12.3111 12.3126 12.8997 12.9347 12.9363 12.9558 k = 0.4545 0.4545 0.4545 ( 8999 PWs) bands (ev): -31.1739 -31.1739 -31.1738 -31.1738 -31.1726 -31.1726 -31.1725 -31.1725 -12.4568 -12.4567 -12.4559 -12.4549 -12.4526 -12.4518 -12.4499 -12.4497 -12.1079 -12.1079 -12.0956 -12.0939 -12.0921 -12.0896 -12.0892 -12.0883 -12.0580 -12.0570 -12.0540 -12.0512 -12.0493 -12.0475 -12.0388 -12.0387 0.9313 0.9413 0.9521 0.9637 1.1256 1.1350 1.1453 1.1538 4.3870 4.3900 4.4862 4.5039 4.5108 4.5168 4.5463 4.5692 4.9681 5.0013 5.0233 5.0379 5.0749 5.1261 5.1445 5.1547 5.3707 5.4064 5.4139 5.4427 5.4531 5.4627 5.6105 5.6238 5.8735 5.8828 5.8910 5.9471 5.9746 6.0166 6.0550 6.0723 6.5434 6.5448 6.6924 6.7017 6.7184 6.7396 6.7421 6.7521 7.1322 7.1339 7.1701 7.1875 7.2015 7.2095 7.4467 7.4481 10.0861 10.0886 10.1400 10.2660 10.2965 10.3818 10.5157 10.6122 10.6900 10.6947 10.7503 10.8431 10.8784 10.9234 10.9980 11.0334 11.7147 11.7844 11.7989 11.9583 12.0867 12.1732 12.2209 12.2235 12.9199 12.9426 12.9559 12.9692 k = 0.4659 0.4659 0.4659 ( 9029 PWs) bands (ev): -31.1738 -31.1738 -31.1737 -31.1737 -31.1727 -31.1727 -31.1727 -31.1727 -12.4563 -12.4561 -12.4554 -12.4547 -12.4531 -12.4525 -12.4503 -12.4502 -12.1081 -12.1081 -12.0945 -12.0933 -12.0921 -12.0902 -12.0898 -12.0891 -12.0566 -12.0558 -12.0536 -12.0515 -12.0500 -12.0487 -12.0390 -12.0390 0.9596 0.9690 0.9723 0.9829 1.1057 1.1144 1.1180 1.1259 4.3916 4.3929 4.4990 4.5087 4.5183 4.5225 4.5446 4.5581 5.0005 5.0258 5.0314 5.0475 5.0830 5.1139 5.1335 5.1411 5.3900 5.4097 5.4133 5.4358 5.4381 5.4488 5.5995 5.6064 5.8756 5.8827 5.9052 5.9441 5.9624 6.0012 6.0272 6.0428 6.5424 6.5430 6.6971 6.7049 6.7153 6.7330 6.7338 6.7427 7.1370 7.1397 7.1641 7.1769 7.1874 7.1944 7.4415 7.4420 10.1494 10.1577 10.2015 10.2926 10.3277 10.3903 10.5884 10.6450 10.7162 10.7258 10.7752 10.8541 10.8640 10.9040 10.9619 10.9778 11.7396 11.7779 11.8293 11.9361 12.0372 12.1168 12.1337 12.1406 12.9395 12.9516 12.9772 12.9857 k = 0.4773 0.4773 0.4773 ( 9032 PWs) bands (ev): -31.1736 -31.1736 -31.1735 -31.1735 -31.1729 -31.1729 -31.1729 -31.1729 -12.4557 -12.4556 -12.4550 -12.4546 -12.4535 -12.4532 -12.4507 -12.4506 -12.1082 -12.1082 -12.0935 -12.0927 -12.0920 -12.0907 -12.0904 -12.0898 -12.0552 -12.0546 -12.0532 -12.0518 -12.0507 -12.0499 -12.0392 -12.0392 0.9865 0.9911 0.9981 1.0034 1.0850 1.0899 1.0947 1.0991 4.3948 4.3952 4.5105 4.5145 4.5239 4.5265 4.5412 4.5476 5.0275 5.0394 5.0491 5.0587 5.0879 5.1031 5.1212 5.1260 5.4052 5.4141 5.4142 5.4269 5.4295 5.4356 5.5898 5.5923 5.8790 5.8822 5.9221 5.9472 5.9550 5.9874 6.0017 6.0146 6.5416 6.5418 6.7028 6.7085 6.7140 6.7266 6.7271 6.7337 7.1430 7.1458 7.1600 7.1685 7.1761 7.1810 7.4378 7.4379 10.2060 10.2189 10.2512 10.3091 10.3393 10.3782 10.6571 10.6818 10.7430 10.7569 10.8035 10.8515 10.8589 10.8809 10.9223 10.9239 11.7638 11.7771 11.8703 11.9275 11.9950 12.0530 12.0646 12.0667 12.9572 12.9621 12.9986 13.0041 k = 0.4886 0.4886 0.4886 ( 9008 PWs) bands (ev): -31.1734 -31.1734 -31.1734 -31.1734 -31.1730 -31.1730 -31.1730 -31.1730 -12.4551 -12.4550 -12.4547 -12.4544 -12.4540 -12.4538 -12.4509 -12.4509 -12.1083 -12.1083 -12.0925 -12.0921 -12.0918 -12.0912 -12.0909 -12.0906 -12.0538 -12.0535 -12.0528 -12.0521 -12.0515 -12.0512 -12.0392 -12.0392 1.0114 1.0124 1.0240 1.0254 1.0638 1.0652 1.0722 1.0733 4.3966 4.3967 4.5206 4.5213 4.5275 4.5288 4.5360 4.5379 5.0446 5.0463 5.0708 5.0735 5.0898 5.0949 5.1071 5.1093 5.4150 5.4163 5.4181 5.4207 5.4240 5.4254 5.5829 5.5832 5.8817 5.8822 5.9417 5.9542 5.9550 5.9749 5.9800 5.9881 6.5411 6.5411 6.7094 6.7125 6.7146 6.7210 6.7218 6.7250 7.1504 7.1521 7.1583 7.1625 7.1669 7.1693 7.4356 7.4356 10.2590 10.2692 10.2866 10.3145 10.3317 10.3487 10.7142 10.7192 10.7757 10.7818 10.8279 10.8408 10.8558 10.8565 10.8756 10.8812 11.7838 11.7857 11.9145 11.9355 11.9658 11.9930 12.0059 12.0116 12.9709 12.9717 13.0207 13.0240 k = 0.5000 0.5000 0.5000 ( 9008 PWs) bands (ev): -31.1732 -31.1732 -31.1732 -31.1732 -31.1732 -31.1732 -31.1732 -31.1732 -12.4545 -12.4545 -12.4545 -12.4545 -12.4545 -12.4545 -12.4510 -12.4510 -12.1083 -12.1083 -12.0915 -12.0915 -12.0915 -12.0915 -12.0915 -12.0915 -12.0525 -12.0525 -12.0525 -12.0525 -12.0525 -12.0525 -12.0393 -12.0393 1.0277 1.0277 1.0487 1.0487 1.0487 1.0487 1.0487 1.0487 4.3972 4.3972 4.5291 4.5291 4.5291 4.5291 4.5291 4.5291 5.0495 5.0495 5.0909 5.0909 5.0909 5.0909 5.0909 5.0909 5.4196 5.4196 5.4196 5.4196 5.4196 5.4196 5.5802 5.5802 5.8825 5.8825 5.9637 5.9637 5.9637 5.9637 5.9637 5.9637 6.5409 6.5409 6.7169 6.7169 6.7169 6.7169 6.7169 6.7169 7.1591 7.1591 7.1591 7.1591 7.1591 7.1591 7.4348 7.4348 10.3075 10.3075 10.3075 10.3075 10.3075 10.3075 10.7401 10.7401 10.7946 10.7946 10.8462 10.8462 10.8462 10.8462 10.8462 10.8462 11.7921 11.7921 11.9616 11.9616 11.9616 11.9616 11.9616 11.9616 12.9762 12.9765 13.0424 13.0424 k = 0.5000 0.5000 0.5000 ( 9008 PWs) bands (ev): -31.1732 -31.1732 -31.1732 -31.1732 -31.1732 -31.1732 -31.1732 -31.1732 -12.4545 -12.4545 -12.4545 -12.4545 -12.4545 -12.4545 -12.4510 -12.4510 -12.1083 -12.1083 -12.0915 -12.0915 -12.0915 -12.0915 -12.0915 -12.0915 -12.0525 -12.0525 -12.0525 -12.0525 -12.0525 -12.0525 -12.0393 -12.0393 1.0277 1.0277 1.0487 1.0487 1.0487 1.0487 1.0487 1.0487 4.3972 4.3972 4.5291 4.5291 4.5291 4.5291 4.5291 4.5291 5.0495 5.0495 5.0909 5.0909 5.0909 5.0909 5.0909 5.0909 5.4196 5.4196 5.4196 5.4196 5.4196 5.4196 5.5802 5.5802 5.8825 5.8825 5.9637 5.9637 5.9637 5.9637 5.9637 5.9637 6.5409 6.5409 6.7169 6.7169 6.7169 6.7169 6.7169 6.7169 7.1591 7.1591 7.1591 7.1591 7.1591 7.1591 7.4348 7.4348 10.3075 10.3075 10.3075 10.3075 10.3075 10.3075 10.7401 10.7401 10.7946 10.7946 10.8462 10.8462 10.8462 10.8462 10.8462 10.8462 11.7921 11.7921 11.9616 11.9616 11.9616 11.9616 11.9616 11.9616 12.9762 12.9775 13.0424 13.0424 k = 0.4861 0.5000 0.4861 ( 9008 PWs) bands (ev): -31.1734 -31.1734 -31.1734 -31.1734 -31.1730 -31.1730 -31.1730 -31.1730 -12.4550 -12.4550 -12.4545 -12.4545 -12.4539 -12.4539 -12.4509 -12.4509 -12.1083 -12.1083 -12.0923 -12.0923 -12.0915 -12.0915 -12.0907 -12.0907 -12.0537 -12.0537 -12.0525 -12.0525 -12.0513 -12.0513 -12.0392 -12.0392 1.0119 1.0119 1.0247 1.0247 1.0645 1.0645 1.0727 1.0727 4.3967 4.3967 4.5209 4.5209 4.5282 4.5282 4.5370 4.5370 5.0455 5.0455 5.0719 5.0719 5.0925 5.0925 5.1082 5.1082 5.4157 5.4157 5.4193 5.4193 5.4248 5.4248 5.5830 5.5830 5.8819 5.8819 5.9452 5.9452 5.9664 5.9664 5.9853 5.9853 6.5411 6.5411 6.7106 6.7106 6.7174 6.7174 6.7241 6.7241 7.1511 7.1511 7.1603 7.1603 7.1683 7.1683 7.4356 7.4356 10.2628 10.2628 10.2998 10.2998 10.3424 10.3424 10.7163 10.7163 10.7798 10.7798 10.8319 10.8319 10.8582 10.8582 10.8782 10.8782 11.7848 11.7848 11.9231 11.9231 11.9801 11.9801 12.0097 12.0097 12.9713 12.9713 13.0218 13.0229 k = 0.4722 0.5000 0.4722 ( 9032 PWs) bands (ev): -31.1736 -31.1736 -31.1736 -31.1736 -31.1729 -31.1729 -31.1729 -31.1729 -12.4556 -12.4556 -12.4548 -12.4548 -12.4533 -12.4533 -12.4507 -12.4507 -12.1082 -12.1082 -12.0932 -12.0932 -12.0914 -12.0914 -12.0900 -12.0900 -12.0550 -12.0550 -12.0526 -12.0526 -12.0502 -12.0502 -12.0392 -12.0392 0.9889 0.9889 1.0008 1.0008 1.0875 1.0875 1.0967 1.0967 4.3950 4.3950 4.5122 4.5122 4.5256 4.5256 4.5444 4.5444 5.0330 5.0330 5.0539 5.0539 5.0957 5.0957 5.1237 5.1237 5.4085 5.4085 5.4213 5.4213 5.4330 5.4330 5.5911 5.5911 5.8806 5.8806 5.9303 5.9303 5.9741 5.9741 6.0095 6.0095 6.5417 6.5417 6.7051 6.7051 6.7190 6.7190 6.7322 6.7322 7.1442 7.1442 7.1639 7.1639 7.1791 7.1791 7.4378 7.4378 10.2105 10.2105 10.2768 10.2768 10.3644 10.3644 10.6670 10.6670 10.7515 10.7515 10.8227 10.8227 10.8754 10.8754 10.9232 10.9232 11.7709 11.7709 11.8945 11.8945 12.0270 12.0270 12.0665 12.0665 12.9596 12.9596 13.0014 13.0016 k = 0.4583 0.5000 0.4583 ( 9036 PWs) bands (ev): -31.1737 -31.1737 -31.1737 -31.1737 -31.1727 -31.1727 -31.1727 -31.1727 -12.4562 -12.4562 -12.4551 -12.4551 -12.4528 -12.4528 -12.4503 -12.4503 -12.1081 -12.1081 -12.0940 -12.0940 -12.0913 -12.0913 -12.0892 -12.0892 -12.0563 -12.0563 -12.0527 -12.0527 -12.0491 -12.0491 -12.0390 -12.0390 0.9652 0.9652 0.9768 0.9768 1.1112 1.1112 1.1207 1.1207 4.3922 4.3922 4.5029 4.5029 4.5212 4.5212 4.5515 4.5515 5.0115 5.0115 5.0406 5.0406 5.0981 5.0981 5.1381 5.1381 5.3980 5.3980 5.4263 5.4263 5.4437 5.4437 5.6030 5.6030 5.8785 5.8785 5.9201 5.9201 5.9859 5.9859 6.0358 6.0358 6.5427 6.5427 6.7005 6.7005 6.7217 6.7217 6.7412 6.7412 7.1383 7.1383 7.1698 7.1698 7.1916 7.1916 7.4417 7.4417 10.1520 10.1520 10.2390 10.2390 10.3698 10.3698 10.6102 10.6102 10.7208 10.7208 10.8125 10.8125 10.8915 10.8915 10.9702 10.9702 11.7601 11.7601 11.8752 11.8752 12.0898 12.0898 12.1303 12.1303 12.9453 12.9453 12.9817 12.9817 k = 0.4444 0.5000 0.4444 ( 8998 PWs) bands (ev): -31.1739 -31.1739 -31.1739 -31.1739 -31.1725 -31.1725 -31.1725 -31.1725 -12.4567 -12.4567 -12.4555 -12.4555 -12.4521 -12.4521 -12.4498 -12.4498 -12.1079 -12.1079 -12.0949 -12.0949 -12.0910 -12.0910 -12.0884 -12.0884 -12.0576 -12.0576 -12.0528 -12.0528 -12.0481 -12.0481 -12.0388 -12.0388 0.9414 0.9414 0.9528 0.9528 1.1350 1.1350 1.1448 1.1448 4.3883 4.3883 4.4930 4.4930 4.5153 4.5153 4.5583 4.5583 4.9846 4.9846 5.0301 5.0301 5.0985 5.0985 5.1519 5.1519 5.3856 5.3856 5.4335 5.4335 5.4559 5.4559 5.6175 5.6175 5.8754 5.8754 5.9155 5.9155 6.0011 6.0011 6.0639 6.0639 6.5441 6.5441 6.6968 6.6968 6.7253 6.7253 6.7509 6.7509 7.1332 7.1332 7.1778 7.1778 7.2064 7.2064 7.4473 7.4473 10.0880 10.0880 10.1872 10.1872 10.3557 10.3557 10.5512 10.5512 10.6928 10.6928 10.8000 10.8000 10.9079 10.9079 11.0156 11.0156 11.7561 11.7561 11.8646 11.8646 12.1613 12.1613 12.1987 12.1987 12.9305 12.9305 12.9634 12.9634 k = 0.4306 0.5000 0.4306 ( 8994 PWs) bands (ev): -31.1740 -31.1740 -31.1740 -31.1740 -31.1724 -31.1724 -31.1724 -31.1724 -12.4573 -12.4573 -12.4559 -12.4559 -12.4515 -12.4515 -12.4493 -12.4493 -12.1077 -12.1077 -12.0957 -12.0957 -12.0908 -12.0908 -12.0877 -12.0877 -12.0589 -12.0589 -12.0530 -12.0530 -12.0472 -12.0472 -12.0385 -12.0385 0.9175 0.9175 0.9289 0.9289 1.1590 1.1590 1.1689 1.1689 4.3834 4.3834 4.4824 4.4824 4.5079 4.5079 4.5648 4.5648 4.9555 4.9555 5.0207 5.0207 5.0970 5.0970 5.1653 5.1653 5.3724 5.3724 5.4423 5.4423 5.4687 5.4687 5.6335 5.6335 5.8719 5.8719 5.9168 5.9168 6.0189 6.0189 6.0932 6.0932 6.5459 6.5459 6.6939 6.6939 6.7299 6.7299 6.7615 6.7615 7.1288 7.1288 7.1877 7.1877 7.2239 7.2239 7.4548 7.4548 10.0187 10.0187 10.1229 10.1229 10.3225 10.3225 10.4921 10.4921 10.6686 10.6686 10.7849 10.7849 10.9263 10.9263 11.0581 11.0581 11.7595 11.7595 11.8616 11.8616 12.2366 12.2366 12.2690 12.2690 12.9167 12.9167 12.9467 12.9467 k = 0.4167 0.5000 0.4167 ( 8994 PWs) bands (ev): -31.1742 -31.1742 -31.1742 -31.1742 -31.1722 -31.1722 -31.1722 -31.1722 -12.4578 -12.4578 -12.4563 -12.4563 -12.4509 -12.4509 -12.4488 -12.4488 -12.1075 -12.1075 -12.0966 -12.0966 -12.0905 -12.0905 -12.0870 -12.0870 -12.0602 -12.0602 -12.0532 -12.0532 -12.0463 -12.0463 -12.0382 -12.0382 0.8936 0.8936 0.9049 0.9049 1.1829 1.1829 1.1930 1.1930 4.3774 4.3774 4.4712 4.4712 4.4992 4.4992 4.5711 4.5711 4.9255 4.9255 5.0123 5.0123 5.0940 5.0940 5.1780 5.1780 5.3595 5.3595 5.4518 5.4518 5.4813 5.4813 5.6502 5.6502 5.8689 5.8689 5.9232 5.9232 6.0388 6.0388 6.1232 6.1232 6.5481 6.5481 6.6919 6.6919 6.7354 6.7354 6.7728 6.7728 7.1251 7.1251 7.1991 7.1991 7.2447 7.2447 7.4646 7.4646 9.9442 9.9442 10.0482 10.0482 10.2741 10.2741 10.4338 10.4338 10.6468 10.6468 10.7676 10.7676 10.9475 10.9475 11.0970 11.0970 11.7695 11.7695 11.8654 11.8654 12.3111 12.3111 12.3386 12.3386 12.9047 12.9047 12.9327 12.9327 k = 0.4028 0.5000 0.4028 ( 8996 PWs) bands (ev): -31.1744 -31.1744 -31.1744 -31.1744 -31.1720 -31.1720 -31.1720 -31.1720 -12.4584 -12.4584 -12.4568 -12.4568 -12.4503 -12.4503 -12.4482 -12.4482 -12.1073 -12.1073 -12.0974 -12.0974 -12.0901 -12.0901 -12.0863 -12.0863 -12.0616 -12.0616 -12.0535 -12.0535 -12.0456 -12.0456 -12.0378 -12.0378 0.8697 0.8697 0.8810 0.8810 1.2069 1.2069 1.2171 1.2171 4.3702 4.3702 4.4594 4.4594 4.4895 4.4895 4.5772 4.5772 4.8953 4.8953 5.0047 5.0047 5.0899 5.0899 5.1896 5.1896 5.3476 5.3476 5.4616 5.4616 5.4932 5.4932 5.6667 5.6667 5.8679 5.8679 5.9334 5.9334 6.0602 6.0602 6.1535 6.1535 6.5508 6.5508 6.6906 6.6906 6.7417 6.7417 6.7849 6.7849 7.1220 7.1220 7.2115 7.2115 7.2693 7.2693 7.4768 7.4768 9.8645 9.8645 9.9653 9.9653 10.2158 10.2158 10.3761 10.3761 10.6256 10.6256 10.7483 10.7483 10.9709 10.9709 11.1317 11.1317 11.7849 11.7849 11.8753 11.8753 12.3799 12.3799 12.4052 12.4052 12.8956 12.8956 12.9222 12.9222 k = 0.3889 0.5000 0.3889 ( 8988 PWs) bands (ev): -31.1745 -31.1745 -31.1745 -31.1745 -31.1719 -31.1719 -31.1719 -31.1719 -12.4589 -12.4589 -12.4572 -12.4572 -12.4497 -12.4497 -12.4476 -12.4476 -12.1070 -12.1070 -12.0983 -12.0983 -12.0898 -12.0898 -12.0856 -12.0856 -12.0629 -12.0629 -12.0537 -12.0537 -12.0449 -12.0449 -12.0374 -12.0374 0.8459 0.8459 0.8572 0.8572 1.2309 1.2309 1.2413 1.2413 4.3620 4.3620 4.4471 4.4471 4.4789 4.4789 4.5830 4.5830 4.8656 4.8656 4.9980 4.9980 5.0851 5.0851 5.1995 5.1995 5.3378 5.3378 5.4710 5.4710 5.5045 5.5045 5.6827 5.6827 5.8695 5.8695 5.9466 5.9466 6.0828 6.0828 6.1836 6.1836 6.5538 6.5538 6.6900 6.6900 6.7488 6.7488 6.7977 6.7977 7.1195 7.1195 7.2247 7.2247 7.2982 7.2982 7.4920 7.4920 9.7800 9.7800 9.8764 9.8764 10.1521 10.1521 10.3188 10.3188 10.6038 10.6038 10.7273 10.7273 10.9954 10.9954 11.1619 11.1619 11.8047 11.8047 11.8906 11.8906 12.4378 12.4378 12.4665 12.4665 12.8903 12.8903 12.9166 12.9166 k = 0.3750 0.5000 0.3750 ( 8980 PWs) bands (ev): -31.1747 -31.1747 -31.1747 -31.1747 -31.1717 -31.1717 -31.1717 -31.1717 -12.4594 -12.4594 -12.4577 -12.4577 -12.4490 -12.4490 -12.4470 -12.4470 -12.1068 -12.1068 -12.0991 -12.0991 -12.0893 -12.0893 -12.0849 -12.0849 -12.0642 -12.0642 -12.0540 -12.0540 -12.0443 -12.0443 -12.0370 -12.0370 0.8223 0.8223 0.8335 0.8335 1.2549 1.2549 1.2655 1.2655 4.3527 4.3527 4.4342 4.4342 4.4677 4.4677 4.5885 4.5885 4.8367 4.8367 4.9921 4.9921 5.0802 5.0802 5.2071 5.2071 5.3307 5.3307 5.4795 5.4795 5.5150 5.5150 5.6976 5.6976 5.8745 5.8745 5.9621 5.9621 6.1060 6.1060 6.2130 6.2130 6.5574 6.5574 6.6901 6.6901 6.7566 6.7566 6.8111 6.8111 7.1176 7.1176 7.2383 7.2383 7.3317 7.3317 7.5105 7.5105 9.6911 9.6911 9.7832 9.7832 10.0864 10.0864 10.2614 10.2614 10.5813 10.5813 10.7052 10.7052 11.0196 11.0196 11.1872 11.1872 11.8278 11.8278 11.9105 11.9105 12.4815 12.4815 12.5188 12.5188 12.8899 12.8899 12.9166 12.9166 k = 0.3611 0.5000 0.3611 ( 8980 PWs) bands (ev): -31.1748 -31.1748 -31.1748 -31.1748 -31.1716 -31.1716 -31.1716 -31.1716 -12.4599 -12.4599 -12.4581 -12.4581 -12.4484 -12.4484 -12.4464 -12.4464 -12.1066 -12.1066 -12.0998 -12.0998 -12.0889 -12.0889 -12.0842 -12.0842 -12.0655 -12.0655 -12.0542 -12.0542 -12.0438 -12.0438 -12.0367 -12.0367 0.7987 0.7987 0.8099 0.8099 1.2789 1.2789 1.2896 1.2896 4.3423 4.3423 4.4210 4.4210 4.4561 4.4561 4.5937 4.5937 4.8090 4.8090 4.9869 4.9869 5.0753 5.0753 5.2117 5.2117 5.3272 5.3272 5.4869 5.4869 5.5251 5.5251 5.7110 5.7110 5.8830 5.8830 5.9792 5.9792 6.1294 6.1294 6.2414 6.2414 6.5614 6.5614 6.6906 6.6906 6.7650 6.7650 6.8252 6.8252 7.1162 7.1162 7.2521 7.2521 7.3697 7.3697 7.5327 7.5327 9.5985 9.5985 9.6873 9.6873 10.0204 10.0204 10.2037 10.2037 10.5583 10.5583 10.6821 10.6821 11.0423 11.0423 11.2075 11.2075 11.8530 11.8530 11.9343 11.9343 12.5105 12.5105 12.5578 12.5578 12.8951 12.8951 12.9221 12.9221 k = 0.3472 0.5000 0.3472 ( 9000 PWs) bands (ev): -31.1750 -31.1750 -31.1750 -31.1750 -31.1714 -31.1714 -31.1714 -31.1714 -12.4605 -12.4605 -12.4586 -12.4586 -12.4478 -12.4478 -12.4458 -12.4458 -12.1064 -12.1064 -12.1005 -12.1005 -12.0885 -12.0885 -12.0835 -12.0835 -12.0667 -12.0667 -12.0545 -12.0545 -12.0434 -12.0434 -12.0363 -12.0363 0.7754 0.7754 0.7865 0.7865 1.3028 1.3028 1.3138 1.3138 4.3308 4.3308 4.4076 4.4076 4.4442 4.4442 4.5985 4.5985 4.7826 4.7826 4.9825 4.9825 5.0707 5.0707 5.2132 5.2132 5.3273 5.3273 5.4930 5.4930 5.5348 5.5348 5.7229 5.7229 5.8952 5.8952 5.9975 5.9975 6.1525 6.1525 6.2686 6.2686 6.5660 6.5660 6.6914 6.6914 6.7739 6.7739 6.8398 6.8398 7.1155 7.1155 7.2658 7.2658 7.4124 7.4124 7.5589 7.5589 9.5034 9.5034 9.5898 9.5898 9.9553 9.9553 10.1457 10.1457 10.5349 10.5349 10.6585 10.6585 11.0626 11.0626 11.2229 11.2229 11.8794 11.8794 11.9606 11.9606 12.5263 12.5263 12.5818 12.5818 12.9053 12.9053 12.9311 12.9312 k = 0.3333 0.5000 0.3333 ( 9012 PWs) bands (ev): -31.1752 -31.1752 -31.1752 -31.1752 -31.1713 -31.1713 -31.1713 -31.1713 -12.4610 -12.4610 -12.4591 -12.4591 -12.4472 -12.4472 -12.4452 -12.4452 -12.1064 -12.1064 -12.1010 -12.1010 -12.0881 -12.0881 -12.0828 -12.0828 -12.0679 -12.0679 -12.0548 -12.0548 -12.0431 -12.0431 -12.0359 -12.0359 0.7523 0.7523 0.7633 0.7633 1.3267 1.3267 1.3379 1.3379 4.3182 4.3182 4.3940 4.3940 4.4324 4.4324 4.6029 4.6029 4.7577 4.7577 4.9787 4.9787 5.0665 5.0665 5.2120 5.2120 5.3307 5.3307 5.4977 5.4977 5.5440 5.5440 5.7334 5.7334 5.9106 5.9106 6.0167 6.0167 6.1750 6.1750 6.2943 6.2943 6.5712 6.5712 6.6925 6.6925 6.7832 6.7832 6.8549 6.8549 7.1154 7.1154 7.2793 7.2793 7.4594 7.4594 7.5894 7.5894 9.4066 9.4066 9.4916 9.4916 9.8915 9.8915 10.0874 10.0874 10.5117 10.5117 10.6348 10.6348 11.0798 11.0798 11.2334 11.2334 11.9058 11.9058 11.9880 11.9880 12.5316 12.5316 12.5923 12.5923 12.9179 12.9179 12.9416 12.9416 k = 0.3194 0.5000 0.3194 ( 8980 PWs) bands (ev): -31.1753 -31.1753 -31.1753 -31.1753 -31.1711 -31.1711 -31.1711 -31.1711 -12.4615 -12.4615 -12.4595 -12.4595 -12.4465 -12.4465 -12.4445 -12.4445 -12.1065 -12.1065 -12.1013 -12.1013 -12.0876 -12.0876 -12.0821 -12.0821 -12.0689 -12.0689 -12.0550 -12.0550 -12.0428 -12.0428 -12.0356 -12.0356 0.7296 0.7296 0.7403 0.7403 1.3505 1.3505 1.3619 1.3619 4.3047 4.3047 4.3805 4.3805 4.4208 4.4208 4.6067 4.6067 4.7346 4.7346 4.9755 4.9755 5.0629 5.0629 5.2092 5.2092 5.3365 5.3365 5.5013 5.5013 5.5527 5.5527 5.7430 5.7430 5.9287 5.9287 6.0364 6.0364 6.1965 6.1965 6.3185 6.3185 6.5769 6.5769 6.6938 6.6938 6.7930 6.7930 6.8703 6.8703 7.1160 7.1160 7.2926 7.2926 7.5105 7.5105 7.6242 7.6242 9.3094 9.3094 9.3936 9.3936 9.8291 9.8291 10.0287 10.0287 10.4889 10.4889 10.6111 10.6111 11.0936 11.0936 11.2395 11.2395 11.9307 11.9307 12.0144 12.0144 12.5301 12.5301 12.5932 12.5932 12.9298 12.9298 12.9519 12.9519 k = 0.3056 0.5000 0.3056 ( 8976 PWs) bands (ev): -31.1754 -31.1754 -31.1754 -31.1754 -31.1710 -31.1710 -31.1710 -31.1710 -12.4620 -12.4620 -12.4600 -12.4600 -12.4459 -12.4459 -12.4439 -12.4439 -12.1068 -12.1068 -12.1015 -12.1015 -12.0872 -12.0872 -12.0814 -12.0814 -12.0699 -12.0699 -12.0552 -12.0552 -12.0426 -12.0426 -12.0353 -12.0353 0.7071 0.7071 0.7177 0.7177 1.3741 1.3741 1.3858 1.3858 4.2903 4.2903 4.3671 4.3671 4.4094 4.4094 4.6096 4.6096 4.7135 4.7135 4.9728 4.9728 5.0600 5.0600 5.2056 5.2056 5.3437 5.3437 5.5040 5.5040 5.5606 5.5606 5.7519 5.7519 5.9488 5.9488 6.0565 6.0565 6.2168 6.2168 6.3410 6.3410 6.5831 6.5831 6.6952 6.6952 6.8030 6.8030 6.8859 6.8859 7.1175 7.1175 7.3056 7.3056 7.5652 7.5652 7.6634 7.6634 9.2126 9.2126 9.2965 9.2965 9.7682 9.7682 9.9699 9.9699 10.4666 10.4666 10.5879 10.5879 11.1039 11.1039 11.2414 11.2414 11.9523 11.9523 12.0374 12.0374 12.5253 12.5253 12.5887 12.5887 12.9392 12.9392 12.9612 12.9612 k = 0.2917 0.5000 0.2917 ( 8984 PWs) bands (ev): -31.1756 -31.1756 -31.1756 -31.1756 -31.1709 -31.1709 -31.1708 -31.1708 -12.4625 -12.4625 -12.4604 -12.4604 -12.4452 -12.4452 -12.4433 -12.4433 -12.1073 -12.1073 -12.1015 -12.1015 -12.0869 -12.0869 -12.0807 -12.0807 -12.0707 -12.0707 -12.0554 -12.0554 -12.0425 -12.0425 -12.0350 -12.0350 0.6851 0.6851 0.6954 0.6954 1.3975 1.3975 1.4095 1.4095 4.2752 4.2752 4.3540 4.3540 4.3985 4.3985 4.6110 4.6110 4.6948 4.6948 4.9706 4.9706 5.0578 5.0578 5.2017 5.2017 5.3517 5.3517 5.5059 5.5059 5.5677 5.5677 5.7606 5.7606 5.9701 5.9701 6.0769 6.0769 6.2357 6.2357 6.3619 6.3619 6.5899 6.5899 6.6967 6.6967 6.8134 6.8134 6.9015 6.9015 7.1198 7.1198 7.3185 7.3185 7.6227 7.6227 7.7066 7.7066 9.1171 9.1171 9.2012 9.2012 9.7088 9.7088 9.9111 9.9111 10.4452 10.4452 10.5652 10.5652 11.1107 11.1107 11.2395 11.2395 11.9687 11.9687 12.0547 12.0547 12.5205 12.5205 12.5825 12.5825 12.9460 12.9460 12.9698 12.9698 k = 0.2778 0.5000 0.2778 ( 8994 PWs) bands (ev): -31.1757 -31.1757 -31.1757 -31.1757 -31.1707 -31.1707 -31.1707 -31.1707 -12.4630 -12.4630 -12.4609 -12.4609 -12.4446 -12.4446 -12.4427 -12.4427 -12.1078 -12.1078 -12.1013 -12.1013 -12.0867 -12.0867 -12.0800 -12.0800 -12.0714 -12.0714 -12.0556 -12.0556 -12.0425 -12.0425 -12.0348 -12.0348 0.6635 0.6635 0.6736 0.6736 1.4208 1.4208 1.4330 1.4330 4.2597 4.2597 4.3413 4.3413 4.3880 4.3880 4.6099 4.6099 4.6795 4.6795 4.9687 4.9687 5.0565 5.0565 5.1982 5.1982 5.3598 5.3598 5.5073 5.5073 5.5737 5.5737 5.7694 5.7694 5.9921 5.9921 6.0974 6.0974 6.2531 6.2531 6.3812 6.3812 6.5970 6.5970 6.6985 6.6985 6.8239 6.8239 6.9172 6.9172 7.1231 7.1231 7.3312 7.3312 7.6825 7.6825 7.7533 7.7533 9.0237 9.0237 9.1083 9.1083 9.6509 9.6509 9.8523 9.8523 10.4247 10.4247 10.5434 10.5434 11.1143 11.1143 11.2342 11.2342 11.9774 11.9774 12.0636 12.0636 12.5185 12.5185 12.5777 12.5777 12.9513 12.9513 12.9780 12.9780 k = 0.2639 0.5000 0.2639 ( 8982 PWs) bands (ev): -31.1758 -31.1758 -31.1758 -31.1758 -31.1706 -31.1706 -31.1706 -31.1706 -12.4635 -12.4635 -12.4613 -12.4613 -12.4440 -12.4440 -12.4421 -12.4421 -12.1084 -12.1084 -12.1011 -12.1011 -12.0865 -12.0865 -12.0793 -12.0793 -12.0718 -12.0718 -12.0557 -12.0557 -12.0426 -12.0426 -12.0347 -12.0347 0.6425 0.6425 0.6523 0.6523 1.4437 1.4437 1.4562 1.4562 4.2439 4.2439 4.3292 4.3292 4.3780 4.3780 4.6052 4.6052 4.6686 4.6686 4.9672 4.9672 5.0561 5.0561 5.1951 5.1951 5.3679 5.3679 5.5084 5.5084 5.5787 5.5787 5.7783 5.7783 6.0141 6.0141 6.1180 6.1180 6.2692 6.2692 6.3991 6.3991 6.6043 6.6043 6.7006 6.7006 6.8345 6.8345 6.9326 6.9326 7.1275 7.1275 7.3440 7.3440 7.7433 7.7433 7.8032 7.8032 8.9333 8.9333 9.0187 9.0187 9.5944 9.5944 9.7938 9.7938 10.4053 10.4053 10.5226 10.5226 11.1148 11.1148 11.2259 11.2259 11.9766 11.9766 12.0624 12.0624 12.5210 12.5210 12.5764 12.5764 12.9563 12.9563 12.9867 12.9867 k = 0.2500 0.5000 0.2500 ( 8986 PWs) bands (ev): -31.1760 -31.1760 -31.1760 -31.1760 -31.1705 -31.1705 -31.1705 -31.1705 -12.4640 -12.4640 -12.4618 -12.4618 -12.4433 -12.4433 -12.4415 -12.4415 -12.1091 -12.1091 -12.1009 -12.1009 -12.0864 -12.0864 -12.0786 -12.0786 -12.0720 -12.0720 -12.0558 -12.0558 -12.0427 -12.0427 -12.0346 -12.0346 0.6220 0.6220 0.6315 0.6315 1.4663 1.4663 1.4790 1.4790 4.2280 4.2280 4.3178 4.3178 4.3683 4.3683 4.5963 4.5963 4.6625 4.6625 4.9659 4.9659 5.0566 5.0566 5.1927 5.1927 5.3757 5.3757 5.5092 5.5092 5.5827 5.5827 5.7874 5.7874 6.0357 6.0357 6.1386 6.1386 6.2839 6.2839 6.4155 6.4155 6.6113 6.6113 6.7033 6.7033 6.8452 6.8452 6.9479 6.9479 7.1330 7.1330 7.3568 7.3568 7.8039 7.8039 7.8554 7.8554 8.8467 8.8467 8.9334 8.9334 9.5395 9.5395 9.7357 9.7357 10.3870 10.3870 10.5030 10.5030 11.1125 11.1125 11.2150 11.2150 11.9653 11.9653 12.0503 12.0503 12.5288 12.5288 12.5794 12.5794 12.9621 12.9621 12.9969 12.9969 k = 0.2361 0.5000 0.2361 ( 8988 PWs) bands (ev): -31.1761 -31.1761 -31.1761 -31.1761 -31.1704 -31.1704 -31.1704 -31.1704 -12.4644 -12.4644 -12.4622 -12.4622 -12.4427 -12.4427 -12.4409 -12.4409 -12.1098 -12.1098 -12.1007 -12.1007 -12.0864 -12.0864 -12.0780 -12.0780 -12.0721 -12.0721 -12.0559 -12.0559 -12.0429 -12.0429 -12.0346 -12.0346 0.6022 0.6022 0.6114 0.6114 1.4884 1.4884 1.5013 1.5013 4.2123 4.2123 4.3071 4.3071 4.3591 4.3591 4.5842 4.5842 4.6603 4.6603 4.9649 4.9649 5.0580 5.0580 5.1910 5.1910 5.3829 5.3829 5.5100 5.5100 5.5856 5.5856 5.7966 5.7966 6.0565 6.0565 6.1590 6.1590 6.2974 6.2974 6.4305 6.4305 6.6179 6.6179 6.7071 6.7071 6.8559 6.8559 6.9628 6.9628 7.1398 7.1398 7.3697 7.3697 7.8623 7.8623 7.9095 7.9095 8.7648 8.7648 8.8538 8.8538 9.4861 9.4861 9.6783 9.6783 10.3699 10.3699 10.4848 10.4848 11.1077 11.1077 11.2016 11.2016 11.9437 11.9437 12.0279 12.0279 12.5411 12.5411 12.5863 12.5863 12.9697 12.9697 13.0092 13.0092 k = 0.2222 0.5000 0.2222 ( 8984 PWs) bands (ev): -31.1762 -31.1762 -31.1762 -31.1762 -31.1703 -31.1703 -31.1702 -31.1702 -12.4649 -12.4649 -12.4626 -12.4626 -12.4421 -12.4421 -12.4403 -12.4403 -12.1104 -12.1104 -12.1005 -12.1005 -12.0865 -12.0865 -12.0773 -12.0773 -12.0718 -12.0718 -12.0559 -12.0559 -12.0432 -12.0432 -12.0346 -12.0346 0.5832 0.5832 0.5919 0.5919 1.5101 1.5101 1.5232 1.5232 4.1968 4.1968 4.2972 4.2972 4.3502 4.3502 4.5703 4.5703 4.6603 4.6603 4.9641 4.9641 5.0604 5.0604 5.1899 5.1899 5.3896 5.3896 5.5107 5.5107 5.5877 5.5877 5.8059 5.8059 6.0761 6.0761 6.1791 6.1791 6.3100 6.3100 6.4440 6.4440 6.6235 6.6235 6.7123 6.7123 6.8666 6.8666 6.9774 6.9774 7.1478 7.1478 7.3827 7.3827 7.9161 7.9161 7.9645 7.9645 8.6888 8.6888 8.7813 8.7813 9.4346 9.4346 9.6218 9.6218 10.3542 10.3542 10.4682 10.4682 11.1006 11.1006 11.1861 11.1861 11.9131 11.9131 11.9963 11.9963 12.5567 12.5567 12.5959 12.5959 12.9794 12.9794 13.0241 13.0241 k = 0.2083 0.5000 0.2083 ( 8976 PWs) bands (ev): -31.1763 -31.1763 -31.1763 -31.1763 -31.1701 -31.1701 -31.1701 -31.1701 -12.4653 -12.4653 -12.4630 -12.4630 -12.4415 -12.4415 -12.4398 -12.4398 -12.1111 -12.1111 -12.1003 -12.1003 -12.0866 -12.0866 -12.0767 -12.0767 -12.0715 -12.0715 -12.0559 -12.0559 -12.0435 -12.0435 -12.0347 -12.0347 0.5649 0.5649 0.5733 0.5733 1.5311 1.5311 1.5443 1.5443 4.1817 4.1817 4.2882 4.2882 4.3418 4.3418 4.5557 4.5557 4.6616 4.6616 4.9636 4.9636 5.0636 5.0636 5.1893 5.1893 5.3955 5.3955 5.5116 5.5116 5.5890 5.5890 5.8152 5.8152 6.0945 6.0945 6.1986 6.1986 6.3218 6.3218 6.4560 6.4560 6.6280 6.6280 6.7191 6.7191 6.8770 6.8770 6.9916 6.9916 7.1572 7.1572 7.3959 7.3959 7.9625 7.9625 8.0185 8.0185 8.6203 8.6203 8.7185 8.7185 9.3851 9.3851 9.5665 9.5665 10.3398 10.3398 10.4533 10.4533 11.0913 11.0913 11.1687 11.1687 11.8752 11.8752 11.9575 11.9575 12.5739 12.5739 12.6066 12.6066 12.9914 12.9914 13.0413 13.0413 k = 0.1944 0.5000 0.1944 ( 8976 PWs) bands (ev): -31.1764 -31.1764 -31.1764 -31.1764 -31.1700 -31.1700 -31.1700 -31.1700 -12.4657 -12.4657 -12.4634 -12.4634 -12.4409 -12.4409 -12.4392 -12.4392 -12.1117 -12.1117 -12.1003 -12.1003 -12.0868 -12.0868 -12.0761 -12.0761 -12.0709 -12.0709 -12.0558 -12.0558 -12.0438 -12.0438 -12.0349 -12.0349 0.5475 0.5475 0.5554 0.5554 1.5515 1.5515 1.5648 1.5648 4.1672 4.1672 4.2801 4.2801 4.3338 4.3338 4.5408 4.5408 4.6634 4.6634 4.9633 4.9633 5.0678 5.0678 5.1892 5.1892 5.4005 5.4005 5.5128 5.5128 5.5896 5.5896 5.8242 5.8242 6.1113 6.1113 6.2176 6.2176 6.3329 6.3329 6.4662 6.4662 6.6316 6.6316 6.7276 6.7276 6.8872 6.8872 7.0053 7.0053 7.1679 7.1679 7.4090 7.4090 7.9985 7.9985 8.0685 8.0685 8.5613 8.5613 8.6684 8.6684 9.3378 9.3378 9.5127 9.5127 10.3269 10.3269 10.4404 10.4404 11.0801 11.0801 11.1496 11.1496 11.8319 11.8319 11.9133 11.9133 12.5912 12.5912 12.6175 12.6175 13.0054 13.0054 13.0601 13.0601 k = 0.1806 0.5000 0.1806 ( 8984 PWs) bands (ev): -31.1765 -31.1765 -31.1765 -31.1765 -31.1700 -31.1700 -31.1699 -31.1699 -12.4661 -12.4661 -12.4638 -12.4638 -12.4404 -12.4404 -12.4388 -12.4388 -12.1123 -12.1123 -12.1003 -12.1003 -12.0870 -12.0870 -12.0755 -12.0755 -12.0703 -12.0703 -12.0557 -12.0557 -12.0442 -12.0442 -12.0351 -12.0351 0.5309 0.5309 0.5385 0.5385 1.5711 1.5711 1.5845 1.5845 4.1535 4.1535 4.2730 4.2730 4.3263 4.3263 4.5261 4.5261 4.6654 4.6654 4.9632 4.9632 5.0728 5.0728 5.1896 5.1896 5.4047 5.4047 5.5143 5.5143 5.5897 5.5897 5.8330 5.8330 6.1265 6.1265 6.2357 6.2357 6.3434 6.3434 6.4744 6.4744 6.6346 6.6346 6.7378 6.7378 6.8971 6.8971 7.0184 7.0184 7.1799 7.1799 7.4220 7.4220 8.0212 8.0212 8.1097 8.1097 8.5155 8.5155 8.6344 8.6344 9.2930 9.2930 9.4609 9.4609 10.3154 10.3154 10.4295 10.4295 11.0668 11.0668 11.1289 11.1289 11.7849 11.7849 11.8653 11.8653 12.6073 12.6073 12.6280 12.6280 13.0205 13.0205 13.0793 13.0793 k = 0.1667 0.5000 0.1667 ( 8968 PWs) bands (ev): -31.1766 -31.1766 -31.1766 -31.1766 -31.1699 -31.1699 -31.1698 -31.1698 -12.4664 -12.4664 -12.4641 -12.4641 -12.4398 -12.4398 -12.4383 -12.4383 -12.1128 -12.1128 -12.1003 -12.1003 -12.0871 -12.0871 -12.0748 -12.0748 -12.0696 -12.0696 -12.0555 -12.0555 -12.0446 -12.0446 -12.0355 -12.0355 0.5154 0.5154 0.5225 0.5225 1.5898 1.5898 1.6032 1.6032 4.1405 4.1405 4.2667 4.2667 4.3193 4.3193 4.5117 4.5117 4.6675 4.6675 4.9633 4.9633 5.0786 5.0786 5.1902 5.1902 5.4078 5.4078 5.5161 5.5161 5.5892 5.5892 5.8413 5.8413 6.1401 6.1401 6.2531 6.2531 6.3534 6.3534 6.4804 6.4804 6.6376 6.6376 6.7492 6.7492 6.9064 6.9064 7.0311 7.0311 7.1931 7.1931 7.4344 7.4344 8.0284 8.0284 8.1361 8.1361 8.4876 8.4876 8.6186 8.6186 9.2512 9.2512 9.4116 9.4116 10.3056 10.3056 10.4210 10.4210 11.0515 11.0515 11.1069 11.1069 11.7358 11.7358 11.8152 11.8152 12.6215 12.6215 12.6385 12.6385 13.0356 13.0356 13.0976 13.0976 k = 0.1528 0.5000 0.1528 ( 8978 PWs) bands (ev): -31.1767 -31.1767 -31.1767 -31.1767 -31.1698 -31.1698 -31.1698 -31.1698 -12.4668 -12.4668 -12.4645 -12.4645 -12.4393 -12.4393 -12.4379 -12.4379 -12.1133 -12.1133 -12.1004 -12.1004 -12.0873 -12.0873 -12.0741 -12.0741 -12.0689 -12.0689 -12.0553 -12.0553 -12.0451 -12.0451 -12.0359 -12.0359 0.5009 0.5009 0.5075 0.5075 1.6075 1.6075 1.6209 1.6209 4.1283 4.1283 4.2612 4.2612 4.3130 4.3130 4.4977 4.4977 4.6695 4.6695 4.9635 4.9635 5.0850 5.0850 5.1909 5.1909 5.4100 5.4100 5.5184 5.5184 5.5884 5.5884 5.8493 5.8493 6.1519 6.1519 6.2696 6.2696 6.3627 6.3627 6.4839 6.4839 6.6412 6.6412 6.7616 6.7616 6.9151 6.9151 7.0433 7.0433 7.2072 7.2072 7.4460 7.4460 8.0208 8.0208 8.1428 8.1428 8.4814 8.4814 8.6203 8.6203 9.2128 9.2128 9.3655 9.3655 10.2975 10.2975 10.4149 10.4149 11.0339 11.0339 11.0837 11.0837 11.6859 11.6859 11.7645 11.7645 12.6334 12.6334 12.6490 12.6490 13.0496 13.0496 13.1137 13.1137 k = 0.1389 0.5000 0.1389 ( 8980 PWs) bands (ev): -31.1768 -31.1768 -31.1768 -31.1768 -31.1697 -31.1697 -31.1697 -31.1697 -12.4671 -12.4671 -12.4648 -12.4648 -12.4388 -12.4388 -12.4375 -12.4375 -12.1138 -12.1138 -12.1006 -12.1006 -12.0875 -12.0875 -12.0735 -12.0735 -12.0682 -12.0682 -12.0551 -12.0551 -12.0456 -12.0456 -12.0363 -12.0363 0.4875 0.4875 0.4936 0.4936 1.6241 1.6241 1.6375 1.6375 4.1171 4.1171 4.2565 4.2565 4.3073 4.3073 4.4842 4.4842 4.6715 4.6715 4.9638 4.9638 5.0921 5.0921 5.1917 5.1917 5.4112 5.4112 5.5212 5.5212 5.5873 5.5873 5.8567 5.8567 6.1621 6.1621 6.2852 6.2852 6.3713 6.3713 6.4849 6.4849 6.6456 6.6456 6.7748 6.7748 6.9227 6.9227 7.0552 7.0552 7.2219 7.2219 7.4563 7.4563 8.0015 8.0015 8.1314 8.1314 8.4947 8.4947 8.6354 8.6354 9.1781 9.1781 9.3235 9.3235 10.2912 10.2912 10.4115 10.4115 11.0138 11.0138 11.0597 11.0597 11.6363 11.6363 11.7145 11.7145 12.6432 12.6432 12.6594 12.6594 13.0617 13.0617 13.1271 13.1271 k = 0.1250 0.5000 0.1250 ( 8986 PWs) bands (ev): -31.1768 -31.1768 -31.1768 -31.1768 -31.1696 -31.1696 -31.1696 -31.1696 -12.4674 -12.4674 -12.4651 -12.4651 -12.4384 -12.4384 -12.4372 -12.4372 -12.1142 -12.1142 -12.1008 -12.1008 -12.0876 -12.0876 -12.0728 -12.0728 -12.0674 -12.0674 -12.0549 -12.0549 -12.0460 -12.0460 -12.0368 -12.0368 0.4752 0.4752 0.4808 0.4808 1.6395 1.6395 1.6529 1.6529 4.1068 4.1068 4.2525 4.2525 4.3024 4.3024 4.4712 4.4712 4.6733 4.6733 4.9643 4.9643 5.0996 5.0996 5.1924 5.1924 5.4114 5.4114 5.5242 5.5242 5.5861 5.5861 5.8636 5.8636 6.1709 6.1709 6.2998 6.2998 6.3792 6.3792 6.4835 6.4835 6.6510 6.6510 6.7884 6.7884 6.9291 6.9291 7.0670 7.0670 7.2368 7.2368 7.4648 7.4648 7.9752 7.9752 8.1091 8.1091 8.5197 8.5197 8.6585 8.6585 9.1476 9.1476 9.2868 9.2868 10.2869 10.2869 10.4108 10.4108 10.9911 10.9911 11.0349 11.0349 11.5883 11.5883 11.6666 11.6666 12.6517 12.6517 12.6694 12.6694 13.0715 13.0715 13.1377 13.1377 k = 0.1111 0.5000 0.1111 ( 8976 PWs) bands (ev): -31.1769 -31.1769 -31.1769 -31.1769 -31.1696 -31.1696 -31.1695 -31.1695 -12.4677 -12.4677 -12.4654 -12.4654 -12.4380 -12.4380 -12.4368 -12.4368 -12.1145 -12.1145 -12.1011 -12.1011 -12.0876 -12.0876 -12.0722 -12.0722 -12.0667 -12.0667 -12.0547 -12.0547 -12.0463 -12.0463 -12.0374 -12.0374 0.4641 0.4641 0.4692 0.4692 1.6536 1.6536 1.6670 1.6670 4.0975 4.0975 4.2490 4.2490 4.2983 4.2983 4.4589 4.4589 4.6749 4.6749 4.9648 4.9648 5.1074 5.1074 5.1930 5.1930 5.4109 5.4109 5.5275 5.5275 5.5847 5.5847 5.8698 5.8698 6.1783 6.1783 6.3135 6.3135 6.3861 6.3861 6.4800 6.4800 6.6573 6.6573 6.8024 6.8024 6.9341 6.9341 7.0788 7.0788 7.2513 7.2513 7.4712 7.4712 7.9459 7.9459 8.0829 8.0829 8.5491 8.5491 8.6840 8.6840 9.1216 9.1216 9.2564 9.2564 10.2846 10.2846 10.4131 10.4131 10.9657 10.9657 11.0094 11.0094 11.5428 11.5428 11.6218 11.6218 12.6594 12.6594 12.6785 12.6785 13.0792 13.0792 13.1460 13.1460 k = 0.0972 0.5000 0.0972 ( 8962 PWs) bands (ev): -31.1769 -31.1769 -31.1769 -31.1769 -31.1695 -31.1695 -31.1695 -31.1695 -12.4679 -12.4679 -12.4656 -12.4656 -12.4376 -12.4376 -12.4366 -12.4366 -12.1148 -12.1148 -12.1013 -12.1013 -12.0877 -12.0877 -12.0716 -12.0716 -12.0659 -12.0659 -12.0546 -12.0546 -12.0465 -12.0465 -12.0380 -12.0380 0.4542 0.4542 0.4588 0.4588 1.6664 1.6664 1.6796 1.6796 4.0893 4.0893 4.2461 4.2461 4.2951 4.2951 4.4473 4.4473 4.6764 4.6764 4.9653 4.9653 5.1155 5.1155 5.1933 5.1933 5.4098 5.4098 5.5308 5.5308 5.5833 5.5833 5.8754 5.8754 6.1846 6.1846 6.3260 6.3260 6.3922 6.3922 6.4749 6.4749 6.6641 6.6641 6.8166 6.8166 6.9373 6.9373 7.0906 7.0906 7.2649 7.2649 7.4751 7.4751 7.9162 7.9162 8.0574 8.0574 8.5777 8.5777 8.7078 8.7078 9.1004 9.1004 9.2336 9.2336 10.2844 10.2844 10.4182 10.4182 10.9384 10.9384 10.9832 10.9832 11.5008 11.5008 11.5810 11.5810 12.6667 12.6667 12.6867 12.6867 13.0852 13.0852 13.1530 13.1530 k = 0.0833 0.5000 0.0833 ( 8958 PWs) bands (ev): -31.1770 -31.1770 -31.1770 -31.1770 -31.1695 -31.1695 -31.1694 -31.1694 -12.4681 -12.4681 -12.4658 -12.4658 -12.4372 -12.4372 -12.4363 -12.4363 -12.1151 -12.1151 -12.1016 -12.1016 -12.0877 -12.0877 -12.0711 -12.0711 -12.0651 -12.0651 -12.0546 -12.0546 -12.0466 -12.0466 -12.0387 -12.0387 0.4456 0.4456 0.4497 0.4497 1.6776 1.6776 1.6908 1.6908 4.0822 4.0822 4.2435 4.2435 4.2928 4.2928 4.4367 4.4367 4.6777 4.6777 4.9658 4.9658 5.1235 5.1235 5.1933 5.1933 5.4083 5.4083 5.5341 5.5341 5.5820 5.5820 5.8804 5.8804 6.1900 6.1900 6.3372 6.3372 6.3976 6.3976 6.4688 6.4688 6.6711 6.6711 6.8308 6.8308 6.9387 6.9387 7.1023 7.1023 7.2770 7.2770 7.4767 7.4767 7.8883 7.8883 8.0353 8.0353 8.6031 8.6031 8.7266 8.7266 9.0845 9.0845 9.2185 9.2185 10.2862 10.2862 10.4260 10.4260 10.9101 10.9101 10.9561 10.9561 11.4633 11.4633 11.5451 11.5451 12.6735 12.6735 12.6938 12.6938 13.0902 13.0902 13.1593 13.1593 k = 0.0694 0.5000 0.0694 ( 8962 PWs) bands (ev): -31.1770 -31.1770 -31.1770 -31.1770 -31.1694 -31.1694 -31.1694 -31.1694 -12.4683 -12.4683 -12.4660 -12.4660 -12.4369 -12.4369 -12.4361 -12.4361 -12.1153 -12.1153 -12.1018 -12.1018 -12.0877 -12.0877 -12.0707 -12.0707 -12.0643 -12.0643 -12.0547 -12.0547 -12.0464 -12.0464 -12.0394 -12.0394 0.4383 0.4383 0.4419 0.4419 1.6873 1.6873 1.7004 1.7004 4.0761 4.0761 4.2413 4.2413 4.2914 4.2914 4.4271 4.4271 4.6788 4.6788 4.9663 4.9663 5.1313 5.1313 5.1928 5.1928 5.4065 5.4065 5.5371 5.5371 5.5808 5.5808 5.8846 5.8846 6.1945 6.1945 6.3468 6.3468 6.4023 6.4023 6.4621 6.4621 6.6777 6.6777 6.8449 6.8449 6.9382 6.9382 7.1137 7.1137 7.2871 7.2871 7.4764 7.4764 7.8633 7.8633 8.0176 8.0176 8.6241 8.6241 8.7386 8.7386 9.0740 9.0740 9.2108 9.2108 10.2898 10.2898 10.4359 10.4359 10.8822 10.8822 10.9285 10.9285 11.4308 11.4308 11.5144 11.5144 12.6799 12.6799 12.6998 12.6998 13.0947 13.0947 13.1653 13.1653 k = 0.0556 0.5000 0.0556 ( 8960 PWs) bands (ev): -31.1771 -31.1771 -31.1771 -31.1771 -31.1694 -31.1694 -31.1694 -31.1694 -12.4684 -12.4684 -12.4661 -12.4661 -12.4366 -12.4366 -12.4360 -12.4360 -12.1155 -12.1155 -12.1020 -12.1020 -12.0877 -12.0877 -12.0703 -12.0703 -12.0635 -12.0635 -12.0550 -12.0550 -12.0461 -12.0461 -12.0402 -12.0402 0.4323 0.4323 0.4355 0.4355 1.6953 1.6953 1.7083 1.7083 4.0711 4.0711 4.2395 4.2395 4.2907 4.2907 4.4188 4.4188 4.6797 4.6797 4.9667 4.9667 5.1386 5.1386 5.1920 5.1920 5.4047 5.4047 5.5398 5.5398 5.5798 5.5798 5.8881 5.8881 6.1982 6.1982 6.3546 6.3546 6.4067 6.4067 6.4553 6.4553 6.6837 6.6837 6.8587 6.8587 6.9358 6.9358 7.1243 7.1243 7.2947 7.2947 7.4748 7.4748 7.8419 7.8419 8.0045 8.0045 8.6408 8.6408 8.7434 8.7434 9.0686 9.0686 9.2089 9.2089 10.2947 10.2947 10.4473 10.4473 10.8563 10.8563 10.9009 10.9009 11.4040 11.4040 11.4893 11.4893 12.6856 12.6856 12.7045 12.7045 13.0989 13.0989 13.1713 13.1713 k = 0.0417 0.5000 0.0417 ( 8974 PWs) bands (ev): -31.1771 -31.1771 -31.1771 -31.1771 -31.1694 -31.1694 -31.1693 -31.1693 -12.4685 -12.4685 -12.4663 -12.4663 -12.4364 -12.4364 -12.4359 -12.4359 -12.1157 -12.1157 -12.1022 -12.1022 -12.0877 -12.0877 -12.0701 -12.0701 -12.0628 -12.0628 -12.0554 -12.0554 -12.0457 -12.0457 -12.0409 -12.0409 0.4277 0.4277 0.4304 0.4304 1.7016 1.7016 1.7145 1.7145 4.0672 4.0672 4.2380 4.2380 4.2905 4.2905 4.4119 4.4119 4.6804 4.6804 4.9671 4.9671 5.1451 5.1451 5.1907 5.1907 5.4030 5.4030 5.5420 5.5420 5.5790 5.5790 5.8908 5.8908 6.2012 6.2012 6.3605 6.3605 6.4111 6.4111 6.4486 6.4486 6.6887 6.6887 6.8719 6.8719 6.9318 6.9318 7.1337 7.1337 7.2999 7.2999 7.4728 7.4728 7.8247 7.8247 7.9955 7.9955 8.6540 8.6540 8.7423 8.7423 9.0672 9.0672 9.2104 9.2104 10.3002 10.3002 10.4590 10.4590 10.8343 10.8343 10.8749 10.8749 11.3832 11.3832 11.4699 11.4699 12.6904 12.6904 12.7081 12.7081 13.1029 13.1029 13.1769 13.1769 k = 0.0278 0.5000 0.0278 ( 8978 PWs) bands (ev): -31.1771 -31.1771 -31.1771 -31.1771 -31.1693 -31.1693 -31.1693 -31.1693 -12.4686 -12.4686 -12.4664 -12.4664 -12.4362 -12.4362 -12.4359 -12.4359 -12.1158 -12.1158 -12.1023 -12.1023 -12.0877 -12.0877 -12.0699 -12.0699 -12.0622 -12.0622 -12.0559 -12.0559 -12.0451 -12.0451 -12.0417 -12.0417 0.4244 0.4244 0.4267 0.4267 1.7062 1.7062 1.7190 1.7190 4.0644 4.0644 4.2369 4.2369 4.2906 4.2906 4.4068 4.4068 4.6809 4.6809 4.9674 4.9674 5.1505 5.1505 5.1893 5.1893 5.4017 5.4017 5.5437 5.5437 5.5784 5.5784 5.8928 5.8928 6.2034 6.2034 6.3645 6.3645 6.4157 6.4157 6.4424 6.4424 6.6925 6.6925 6.8841 6.8841 6.9262 6.9262 7.1412 7.1412 7.3028 7.3028 7.4710 7.4710 7.8122 7.8122 7.9898 7.9898 8.6641 8.6641 8.7377 8.7377 9.0680 9.0680 9.2134 9.2134 10.3053 10.3053 10.4694 10.4694 10.8180 10.8180 10.8525 10.8525 11.3684 11.3684 11.4560 11.4560 12.6941 12.6941 12.7105 12.7105 13.1062 13.1062 13.1816 13.1816 k = 0.0139 0.5000 0.0139 ( 8978 PWs) bands (ev): -31.1771 -31.1771 -31.1771 -31.1771 -31.1693 -31.1693 -31.1693 -31.1693 -12.4687 -12.4687 -12.4664 -12.4664 -12.4361 -12.4361 -12.4359 -12.4359 -12.1159 -12.1159 -12.1024 -12.1024 -12.0877 -12.0877 -12.0698 -12.0698 -12.0617 -12.0617 -12.0562 -12.0562 -12.0445 -12.0445 -12.0424 -12.0424 0.4224 0.4224 0.4245 0.4245 1.7089 1.7089 1.7217 1.7217 4.0627 4.0627 4.2363 4.2363 4.2907 4.2907 4.4037 4.4037 4.6812 4.6812 4.9675 4.9675 5.1541 5.1541 5.1881 5.1881 5.4008 5.4008 5.5447 5.5447 5.5780 5.5780 5.8940 5.8940 6.2047 6.2047 6.3667 6.3667 6.4199 6.4199 6.4371 6.4371 6.6949 6.6949 6.8946 6.8946 6.9196 6.9196 7.1460 7.1460 7.3042 7.3042 7.4698 7.4698 7.8045 7.8045 7.9868 7.9868 8.6712 8.6712 8.7326 8.7326 9.0693 9.0693 9.2159 9.2159 10.3089 10.3089 10.4766 10.4766 10.8086 10.8086 10.8366 10.8366 11.3595 11.3595 11.4478 11.4478 12.6965 12.6965 12.7119 12.7119 13.1086 13.1086 13.1849 13.1849 k = 0.0000 0.5000-0.0000 ( 8930 PWs) bands (ev): -31.1771 -31.1771 -31.1771 -31.1771 -31.1693 -31.1693 -31.1693 -31.1693 -12.4686 -12.4686 -12.4664 -12.4664 -12.4360 -12.4360 -12.4358 -12.4358 -12.1158 -12.1158 -12.1024 -12.1024 -12.0877 -12.0877 -12.0697 -12.0697 -12.0615 -12.0615 -12.0563 -12.0563 -12.0441 -12.0441 -12.0428 -12.0428 0.4218 0.4218 0.4238 0.4238 1.7098 1.7098 1.7227 1.7227 4.0622 4.0622 4.2360 4.2360 4.2908 4.2908 4.4026 4.4026 4.6813 4.6813 4.9676 4.9676 5.1555 5.1555 5.1877 5.1877 5.4005 5.4005 5.5450 5.5450 5.5779 5.5779 5.8944 5.8944 6.2052 6.2052 6.3674 6.3674 6.4222 6.4222 6.4346 6.4346 6.6957 6.6957 6.9001 6.9001 6.9155 6.9155 7.1477 7.1477 7.3045 7.3045 7.4694 7.4694 7.8019 7.8019 7.9859 7.9859 8.6738 8.6738 8.7304 8.7304 9.0699 9.0699 9.2168 9.2168 10.3102 10.3102 10.4793 10.4793 10.8058 10.8058 10.8306 10.8306 11.3566 11.3566 11.4450 11.4450 12.6974 12.6974 12.7124 12.7124 13.1094 13.1094 13.1860 13.1860 k = 0.5000 0.5000-0.0000 ( 8956 PWs) bands (ev): -31.1759 -31.1759 -31.1759 -31.1759 -31.1705 -31.1705 -31.1705 -31.1705 -12.4618 -12.4618 -12.4618 -12.4618 -12.4434 -12.4434 -12.4434 -12.4434 -12.1020 -12.1020 -12.1020 -12.1020 -12.0864 -12.0864 -12.0864 -12.0864 -12.0674 -12.0674 -12.0674 -12.0674 -12.0343 -12.0343 -12.0343 -12.0343 0.6558 0.6558 0.6558 0.6558 1.4320 1.4320 1.4320 1.4320 4.1846 4.1846 4.1846 4.1846 4.4999 4.4999 4.4999 4.4999 4.8673 4.8673 4.8673 4.8673 5.1124 5.1124 5.1124 5.1124 5.3547 5.3547 5.3547 5.3547 5.7965 5.7965 5.7965 5.7965 6.0648 6.0648 6.0648 6.0648 6.3767 6.3767 6.3767 6.3767 6.6911 6.6911 6.6911 6.6911 6.8308 6.8308 6.8308 6.8308 7.5087 7.5087 7.5087 7.5087 8.2764 8.2764 8.2764 8.2764 8.5306 8.5306 8.5306 8.5306 8.8071 8.8071 8.8071 8.8071 10.5696 10.5696 10.5696 10.5696 11.7173 11.7173 11.7173 11.7173 12.2663 12.2663 12.2663 12.2663 12.3772 12.3772 12.3772 12.3772 12.7779 12.7779 12.7779 12.7779 k = 0.5000 0.5000 0.0200 ( 8980 PWs) bands (ev): -31.1759 -31.1759 -31.1759 -31.1759 -31.1705 -31.1705 -31.1705 -31.1705 -12.4619 -12.4619 -12.4618 -12.4618 -12.4435 -12.4435 -12.4434 -12.4434 -12.1021 -12.1021 -12.1019 -12.1019 -12.0873 -12.0873 -12.0854 -12.0854 -12.0682 -12.0682 -12.0666 -12.0666 -12.0345 -12.0345 -12.0342 -12.0342 0.6562 0.6562 0.6569 0.6569 1.4310 1.4310 1.4315 1.4315 4.1835 4.1835 4.1879 4.1879 4.4984 4.4984 4.5016 4.5016 4.8646 4.8646 4.8701 4.8701 5.1111 5.1111 5.1139 5.1139 5.3505 5.3505 5.3595 5.3595 5.7913 5.7913 5.8003 5.8003 6.0616 6.0616 6.0660 6.0660 6.3739 6.3739 6.3783 6.3783 6.6854 6.6854 6.6964 6.6964 6.8192 6.8192 6.8415 6.8415 7.4918 7.4918 7.5190 7.5190 8.2465 8.2465 8.2579 8.2579 8.5517 8.5517 8.5584 8.5584 8.8124 8.8124 8.8188 8.8188 10.5694 10.5694 10.5700 10.5700 11.7087 11.7087 11.7199 11.7199 12.2663 12.2663 12.2673 12.2673 12.3735 12.3735 12.3797 12.3797 12.7780 12.7780 12.7794 12.7794 k = 0.5000 0.5000 0.0400 ( 8968 PWs) bands (ev): -31.1759 -31.1759 -31.1759 -31.1759 -31.1705 -31.1705 -31.1705 -31.1705 -12.4619 -12.4619 -12.4616 -12.4616 -12.4436 -12.4436 -12.4434 -12.4434 -12.1022 -12.1022 -12.1018 -12.1018 -12.0882 -12.0882 -12.0843 -12.0843 -12.0690 -12.0690 -12.0657 -12.0657 -12.0347 -12.0347 -12.0342 -12.0342 0.6581 0.6581 0.6595 0.6595 1.4285 1.4285 1.4295 1.4295 4.1845 4.1845 4.1933 4.1933 4.4972 4.4972 4.5035 4.5035 4.8621 4.8621 4.8729 4.8729 5.1099 5.1099 5.1155 5.1155 5.3469 5.3469 5.3648 5.3648 5.7846 5.7846 5.8026 5.8026 6.0566 6.0566 6.0651 6.0651 6.3701 6.3701 6.3785 6.3785 6.6793 6.6793 6.7013 6.7013 6.8069 6.8069 6.8512 6.8512 7.4692 7.4692 7.5226 7.5226 8.1852 8.1852 8.2074 8.2074 8.6051 8.6051 8.6184 8.6184 8.8352 8.8352 8.8465 8.8465 10.5694 10.5694 10.5705 10.5705 11.6942 11.6942 11.7166 11.7166 12.2670 12.2670 12.2696 12.2696 12.3691 12.3691 12.3810 12.3810 12.7796 12.7796 12.7824 12.7824 k = 0.5000 0.5000 0.0600 ( 8960 PWs) bands (ev): -31.1759 -31.1759 -31.1759 -31.1759 -31.1705 -31.1705 -31.1705 -31.1705 -12.4618 -12.4618 -12.4615 -12.4615 -12.4437 -12.4437 -12.4434 -12.4434 -12.1023 -12.1023 -12.1017 -12.1017 -12.0890 -12.0890 -12.0832 -12.0832 -12.0698 -12.0698 -12.0649 -12.0649 -12.0350 -12.0350 -12.0342 -12.0342 0.6616 0.6616 0.6637 0.6637 1.4245 1.4245 1.4259 1.4259 4.1876 4.1876 4.2008 4.2008 4.4963 4.4963 4.5058 4.5058 4.8597 4.8597 4.8759 4.8759 5.1089 5.1089 5.1172 5.1172 5.3440 5.3440 5.3704 5.3704 5.7765 5.7765 5.8035 5.8035 6.0497 6.0497 6.0624 6.0624 6.3652 6.3652 6.3772 6.3772 6.6727 6.6727 6.7057 6.7057 6.7944 6.7944 6.8597 6.8597 7.4420 7.4420 7.5198 7.5198 8.1120 8.1120 8.1449 8.1449 8.6715 8.6715 8.6902 8.6902 8.8752 8.8752 8.8886 8.8886 10.5696 10.5696 10.5711 10.5711 11.6741 11.6741 11.7075 11.7075 12.2677 12.2677 12.2731 12.2731 12.3646 12.3646 12.3807 12.3807 12.7828 12.7828 12.7870 12.7870 k = 0.5000 0.5000 0.0800 ( 8976 PWs) bands (ev): -31.1759 -31.1759 -31.1759 -31.1759 -31.1706 -31.1706 -31.1706 -31.1706 -12.4618 -12.4618 -12.4614 -12.4614 -12.4439 -12.4439 -12.4435 -12.4435 -12.1024 -12.1024 -12.1016 -12.1016 -12.0898 -12.0898 -12.0822 -12.0822 -12.0706 -12.0706 -12.0641 -12.0641 -12.0353 -12.0353 -12.0342 -12.0342 0.6665 0.6665 0.6693 0.6693 1.4189 1.4189 1.4208 1.4208 4.1927 4.1927 4.2103 4.2103 4.4956 4.4956 4.5084 4.5084 4.8576 4.8576 4.8789 4.8789 5.1080 5.1080 5.1190 5.1190 5.3417 5.3417 5.3764 5.3764 5.7668 5.7668 5.8030 5.8030 6.0410 6.0410 6.0577 6.0577 6.3595 6.3595 6.3741 6.3741 6.6655 6.6655 6.7096 6.7096 6.7820 6.7820 6.8670 6.8670 7.4116 7.4116 7.5115 7.5115 8.0350 8.0350 8.0788 8.0788 8.7434 8.7434 8.7660 8.7660 8.9310 8.9310 8.9434 8.9434 10.5701 10.5701 10.5720 10.5720 11.6488 11.6488 11.6927 11.6927 12.2674 12.2674 12.2772 12.2772 12.3605 12.3605 12.3790 12.3790 12.7874 12.7874 12.7930 12.7930 k = 0.5000 0.5000 0.1000 ( 8980 PWs) bands (ev): -31.1758 -31.1758 -31.1758 -31.1758 -31.1706 -31.1706 -31.1706 -31.1706 -12.4617 -12.4617 -12.4612 -12.4612 -12.4442 -12.4442 -12.4436 -12.4436 -12.1026 -12.1026 -12.1015 -12.1015 -12.0904 -12.0904 -12.0811 -12.0811 -12.0713 -12.0713 -12.0633 -12.0633 -12.0356 -12.0356 -12.0343 -12.0343 0.6729 0.6729 0.6764 0.6764 1.4119 1.4119 1.4143 1.4143 4.1998 4.1998 4.2217 4.2217 4.4952 4.4952 4.5113 4.5113 4.8558 4.8558 4.8820 4.8820 5.1073 5.1073 5.1210 5.1210 5.3403 5.3403 5.3826 5.3826 5.7557 5.7557 5.8012 5.8012 6.0309 6.0309 6.0511 6.0511 6.3529 6.3529 6.3690 6.3690 6.6576 6.6576 6.7128 6.7128 6.7702 6.7702 6.8731 6.8731 7.3794 7.3794 7.4988 7.4988 7.9573 7.9573 8.0123 8.0123 8.8184 8.8184 8.8436 8.8436 9.0002 9.0002 9.0087 9.0087 10.5711 10.5711 10.5732 10.5732 11.6187 11.6187 11.6727 11.6727 12.2647 12.2647 12.2809 12.2809 12.3581 12.3581 12.3766 12.3766 12.7934 12.7934 12.8003 12.8003 k = 0.5000 0.5000 0.1200 ( 8980 PWs) bands (ev): -31.1757 -31.1757 -31.1757 -31.1757 -31.1707 -31.1707 -31.1707 -31.1707 -12.4616 -12.4616 -12.4610 -12.4610 -12.4445 -12.4445 -12.4438 -12.4438 -12.1028 -12.1028 -12.1013 -12.1013 -12.0910 -12.0910 -12.0801 -12.0801 -12.0720 -12.0720 -12.0625 -12.0625 -12.0360 -12.0360 -12.0344 -12.0344 0.6807 0.6807 0.6849 0.6849 1.4034 1.4034 1.4063 1.4063 4.2086 4.2086 4.2349 4.2349 4.4949 4.4949 4.5146 4.5146 4.8544 4.8544 4.8853 4.8853 5.1067 5.1067 5.1230 5.1230 5.3396 5.3396 5.3890 5.3890 5.7430 5.7430 5.7980 5.7980 6.0194 6.0194 6.0429 6.0429 6.3453 6.3453 6.3617 6.3617 6.6487 6.6487 6.7153 6.7153 6.7596 6.7596 6.8777 6.8777 7.3465 7.3465 7.4826 7.4826 7.8807 7.8807 7.9472 7.9472 8.8956 8.8956 8.9235 8.9235 9.0793 9.0793 9.0825 9.0825 10.5728 10.5728 10.5750 10.5750 11.5842 11.5842 11.6479 11.6479 12.2579 12.2579 12.2821 12.2821 12.3584 12.3584 12.3748 12.3748 12.8006 12.8006 12.8088 12.8088 k = 0.5000 0.5000 0.1400 ( 8960 PWs) bands (ev): -31.1757 -31.1757 -31.1757 -31.1757 -31.1707 -31.1707 -31.1707 -31.1707 -12.4615 -12.4615 -12.4608 -12.4608 -12.4448 -12.4448 -12.4440 -12.4440 -12.1031 -12.1031 -12.1011 -12.1011 -12.0914 -12.0914 -12.0793 -12.0793 -12.0724 -12.0724 -12.0618 -12.0618 -12.0365 -12.0365 -12.0345 -12.0345 0.6900 0.6900 0.6948 0.6948 1.3935 1.3935 1.3969 1.3969 4.2190 4.2190 4.2498 4.2498 4.4949 4.4949 4.5182 4.5182 4.8535 4.8535 4.8887 4.8887 5.1064 5.1064 5.1252 5.1252 5.3397 5.3397 5.3954 5.3954 5.7290 5.7290 5.7934 5.7934 6.0068 6.0068 6.0332 6.0332 6.3367 6.3367 6.3518 6.3518 6.6390 6.6390 6.7170 6.7170 6.7504 6.7504 6.8809 6.8809 7.3141 7.3141 7.4641 7.4641 7.8061 7.8061 7.8843 7.8843 8.9746 8.9746 9.0063 9.0063 9.1630 9.1630 9.1655 9.1655 10.5752 10.5752 10.5773 10.5773 11.5460 11.5460 11.6188 11.6188 12.2457 12.2457 12.2784 12.2784 12.3621 12.3621 12.3758 12.3758 12.8088 12.8088 12.8182 12.8182 k = 0.5000 0.5000 0.1600 ( 8960 PWs) bands (ev): -31.1756 -31.1756 -31.1756 -31.1756 -31.1708 -31.1708 -31.1708 -31.1708 -12.4613 -12.4613 -12.4605 -12.4605 -12.4451 -12.4451 -12.4442 -12.4442 -12.1034 -12.1034 -12.1009 -12.1009 -12.0917 -12.0917 -12.0787 -12.0787 -12.0725 -12.0725 -12.0610 -12.0610 -12.0370 -12.0370 -12.0347 -12.0347 0.7007 0.7007 0.7061 0.7061 1.3822 1.3822 1.3861 1.3861 4.2309 4.2309 4.2660 4.2660 4.4952 4.4952 4.5220 4.5220 4.8533 4.8533 4.8924 4.8924 5.1064 5.1064 5.1275 5.1275 5.3405 5.3405 5.4017 5.4017 5.7135 5.7135 5.7875 5.7875 5.9934 5.9934 6.0221 6.0221 6.3270 6.3270 6.3391 6.3391 6.6286 6.6286 6.7179 6.7179 6.7429 6.7429 6.8826 6.8826 7.2830 7.2830 7.4438 7.4438 7.7343 7.7343 7.8246 7.8246 9.0552 9.0552 9.0922 9.0922 9.2488 9.2488 9.2565 9.2565 10.5785 10.5785 10.5805 10.5805 11.5047 11.5047 11.5860 11.5860 12.2277 12.2277 12.2677 12.2677 12.3688 12.3688 12.3808 12.3808 12.8177 12.8177 12.8284 12.8284 k = 0.5000 0.5000 0.1800 ( 8960 PWs) bands (ev): -31.1755 -31.1755 -31.1755 -31.1755 -31.1709 -31.1709 -31.1709 -31.1709 -12.4611 -12.4611 -12.4602 -12.4602 -12.4455 -12.4455 -12.4445 -12.4445 -12.1037 -12.1037 -12.1006 -12.1006 -12.0920 -12.0920 -12.0786 -12.0786 -12.0722 -12.0722 -12.0602 -12.0602 -12.0375 -12.0375 -12.0349 -12.0349 0.7127 0.7127 0.7188 0.7188 1.3696 1.3696 1.3740 1.3740 4.2440 4.2440 4.2835 4.2835 4.4957 4.4957 4.5262 4.5262 4.8540 4.8540 4.8964 4.8964 5.1066 5.1066 5.1299 5.1299 5.3420 5.3420 5.4079 5.4079 5.6966 5.6966 5.7803 5.7803 5.9795 5.9795 6.0099 6.0099 6.3160 6.3160 6.3236 6.3236 6.6178 6.6178 6.7179 6.7179 6.7370 6.7370 6.8826 6.8826 7.2539 7.2539 7.4224 7.4224 7.6659 7.6659 7.7686 7.7686 9.1371 9.1371 9.1810 9.1810 9.3388 9.3388 9.3509 9.3509 10.5829 10.5829 10.5845 10.5845 11.4607 11.4607 11.5501 11.5501 12.2043 12.2043 12.2500 12.2500 12.3776 12.3776 12.3894 12.3894 12.8271 12.8271 12.8390 12.8390 k = 0.5000 0.5000 0.2000 ( 8960 PWs) bands (ev): -31.1754 -31.1754 -31.1754 -31.1754 -31.1710 -31.1710 -31.1710 -31.1710 -12.4609 -12.4609 -12.4599 -12.4599 -12.4459 -12.4459 -12.4449 -12.4449 -12.1041 -12.1041 -12.1003 -12.1003 -12.0922 -12.0922 -12.0789 -12.0789 -12.0715 -12.0715 -12.0595 -12.0595 -12.0381 -12.0381 -12.0352 -12.0352 0.7260 0.7260 0.7327 0.7327 1.3557 1.3557 1.3605 1.3605 4.2580 4.2580 4.3019 4.3019 4.4965 4.4965 4.5307 4.5307 4.8557 4.8557 4.9009 4.9009 5.1071 5.1071 5.1324 5.1324 5.3442 5.3442 5.4138 5.4138 5.6786 5.6786 5.7719 5.7719 5.9654 5.9654 5.9968 5.9968 6.3036 6.3036 6.3051 6.3051 6.6072 6.6072 6.7170 6.7170 6.7326 6.7326 6.8808 6.8808 7.2274 7.2274 7.4002 7.4002 7.6015 7.6015 7.7170 7.7170 9.2199 9.2199 9.2722 9.2722 9.4320 9.4320 9.4479 9.4479 10.5886 10.5886 10.5897 10.5897 11.4146 11.4146 11.5116 11.5116 12.1759 12.1759 12.2260 12.2260 12.3872 12.3872 12.4000 12.4000 12.8366 12.8366 12.8498 12.8498 k = 0.5000 0.5000 0.2200 ( 8964 PWs) bands (ev): -31.1753 -31.1753 -31.1753 -31.1753 -31.1711 -31.1711 -31.1711 -31.1711 -12.4607 -12.4607 -12.4596 -12.4596 -12.4464 -12.4464 -12.4452 -12.4452 -12.1045 -12.1045 -12.1000 -12.1000 -12.0923 -12.0923 -12.0794 -12.0794 -12.0705 -12.0705 -12.0588 -12.0588 -12.0388 -12.0388 -12.0355 -12.0355 0.7406 0.7406 0.7478 0.7478 1.3405 1.3405 1.3459 1.3459 4.2727 4.2727 4.3210 4.3210 4.4976 4.4976 4.5352 4.5352 4.8587 4.8587 4.9060 4.9060 5.1078 5.1078 5.1349 5.1349 5.3469 5.3469 5.4193 5.4193 5.6594 5.6594 5.7623 5.7623 5.9514 5.9514 5.9832 5.9832 6.2838 6.2838 6.2897 6.2897 6.5971 6.5971 6.7155 6.7155 6.7293 6.7293 6.8770 6.8770 7.2039 7.2039 7.3774 7.3774 7.5416 7.5416 7.6700 7.6700 9.3033 9.3033 9.3650 9.3650 9.5277 9.5277 9.5469 9.5469 10.5955 10.5955 10.5961 10.5961 11.3669 11.3669 11.4710 11.4710 12.1428 12.1428 12.1971 12.1971 12.3964 12.3964 12.4110 12.4110 12.8458 12.8458 12.8603 12.8603 k = 0.5000 0.5000 0.2400 ( 8972 PWs) bands (ev): -31.1752 -31.1752 -31.1752 -31.1752 -31.1712 -31.1712 -31.1712 -31.1712 -12.4604 -12.4604 -12.4593 -12.4593 -12.4469 -12.4469 -12.4456 -12.4456 -12.1049 -12.1049 -12.0996 -12.0996 -12.0923 -12.0923 -12.0801 -12.0801 -12.0694 -12.0694 -12.0581 -12.0581 -12.0395 -12.0395 -12.0358 -12.0358 0.7564 0.7564 0.7641 0.7641 1.3241 1.3241 1.3300 1.3300 4.2877 4.2877 4.3404 4.3404 4.4990 4.4990 4.5399 4.5399 4.8633 4.8633 4.9119 4.9119 5.1089 5.1089 5.1375 5.1375 5.3502 5.3502 5.4241 5.4241 5.6392 5.6392 5.7515 5.7515 5.9381 5.9381 5.9693 5.9693 6.2599 6.2599 6.2741 6.2741 6.5878 6.5878 6.7134 6.7134 6.7270 6.7270 6.8709 6.8709 7.1835 7.1835 7.3541 7.3541 7.4865 7.4865 7.6281 7.6281 9.3868 9.3868 9.4585 9.4585 9.6251 9.6251 9.6473 9.6473 10.6039 10.6039 10.6039 10.6039 11.3182 11.3182 11.4289 11.4289 12.1058 12.1058 12.1643 12.1643 12.4038 12.4038 12.4206 12.4206 12.8543 12.8543 12.8701 12.8701 k = 0.5000 0.5000 0.2600 ( 8980 PWs) bands (ev): -31.1751 -31.1751 -31.1751 -31.1751 -31.1713 -31.1713 -31.1713 -31.1713 -12.4601 -12.4601 -12.4589 -12.4589 -12.4474 -12.4474 -12.4460 -12.4460 -12.1053 -12.1053 -12.0992 -12.0992 -12.0923 -12.0923 -12.0809 -12.0809 -12.0682 -12.0682 -12.0574 -12.0574 -12.0402 -12.0402 -12.0361 -12.0361 0.7733 0.7733 0.7815 0.7815 1.3067 1.3067 1.3130 1.3130 4.3027 4.3027 4.3598 4.3598 4.5007 4.5007 4.5444 4.5444 4.8696 4.8696 4.9186 4.9186 5.1101 5.1101 5.1400 5.1400 5.3539 5.3539 5.4282 5.4282 5.6183 5.6183 5.7396 5.7396 5.9256 5.9256 5.9553 5.9553 6.2338 6.2338 6.2566 6.2566 6.5794 6.5794 6.7108 6.7108 6.7252 6.7252 6.8627 6.8627 7.1666 7.1666 7.3306 7.3306 7.4367 7.4367 7.5915 7.5915 9.4699 9.4699 9.5519 9.5519 9.7233 9.7233 9.7489 9.7489 10.6132 10.6132 10.6138 10.6138 11.2688 11.2688 11.3856 11.3856 12.0655 12.0655 12.1285 12.1285 12.4078 12.4078 12.4272 12.4272 12.8618 12.8618 12.8790 12.8790 k = 0.5000 0.5000 0.2800 ( 8972 PWs) bands (ev): -31.1749 -31.1749 -31.1749 -31.1749 -31.1715 -31.1715 -31.1715 -31.1715 -12.4598 -12.4598 -12.4585 -12.4585 -12.4479 -12.4479 -12.4465 -12.4465 -12.1057 -12.1057 -12.0988 -12.0988 -12.0923 -12.0923 -12.0818 -12.0818 -12.0669 -12.0669 -12.0568 -12.0568 -12.0410 -12.0410 -12.0364 -12.0364 0.7913 0.7913 0.8000 0.8000 1.2882 1.2882 1.2950 1.2950 4.3173 4.3173 4.3789 4.3789 4.5029 4.5029 4.5486 4.5486 4.8781 4.8781 4.9263 4.9263 5.1114 5.1114 5.1424 5.1424 5.3581 5.3581 5.4313 5.4313 5.5969 5.5969 5.7268 5.7268 5.9145 5.9145 5.9417 5.9417 6.2058 6.2058 6.2373 6.2373 6.5721 6.5721 6.7080 6.7080 6.7239 6.7239 6.8523 6.8523 7.1531 7.1531 7.3072 7.3072 7.3922 7.3922 7.5599 7.5599 9.5525 9.5525 9.6445 9.6445 9.8215 9.8215 9.8511 9.8511 10.6242 10.6242 10.6251 10.6251 11.2194 11.2194 11.3415 11.3415 12.0227 12.0227 12.0907 12.0907 12.4066 12.4066 12.4288 12.4288 12.8683 12.8683 12.8870 12.8870 k = 0.5000 0.5000 0.3000 ( 8996 PWs) bands (ev): -31.1748 -31.1748 -31.1748 -31.1748 -31.1716 -31.1716 -31.1716 -31.1716 -12.4594 -12.4594 -12.4581 -12.4581 -12.4485 -12.4485 -12.4469 -12.4469 -12.1062 -12.1062 -12.0983 -12.0983 -12.0922 -12.0922 -12.0827 -12.0827 -12.0656 -12.0656 -12.0561 -12.0561 -12.0419 -12.0419 -12.0368 -12.0368 0.8103 0.8103 0.8194 0.8194 1.2687 1.2687 1.2759 1.2759 4.3312 4.3312 4.3974 4.3974 4.5053 4.5053 4.5523 4.5523 4.8889 4.8889 4.9351 4.9351 5.1127 5.1127 5.1447 5.1447 5.3626 5.3626 5.4334 5.4334 5.5752 5.5752 5.7131 5.7131 5.9051 5.9051 5.9288 5.9288 6.1767 6.1767 6.2160 6.2160 6.5658 6.5658 6.7052 6.7052 6.7229 6.7229 6.8400 6.8400 7.1428 7.1428 7.2842 7.2842 7.3528 7.3528 7.5332 7.5332 9.6341 9.6341 9.7355 9.7355 9.9183 9.9183 9.9533 9.9533 10.6367 10.6367 10.6378 10.6378 11.1705 11.1705 11.2970 11.2970 11.9785 11.9785 12.0520 12.0520 12.3981 12.3981 12.4235 12.4235 12.8739 12.8739 12.8942 12.8942 k = 0.5000 0.5000 0.3200 ( 8988 PWs) bands (ev): -31.1747 -31.1747 -31.1747 -31.1747 -31.1717 -31.1717 -31.1717 -31.1717 -12.4590 -12.4590 -12.4577 -12.4577 -12.4491 -12.4491 -12.4474 -12.4474 -12.1065 -12.1065 -12.0978 -12.0978 -12.0921 -12.0921 -12.0836 -12.0836 -12.0642 -12.0642 -12.0555 -12.0555 -12.0428 -12.0428 -12.0372 -12.0372 0.8302 0.8302 0.8398 0.8398 1.2483 1.2483 1.2560 1.2560 4.3442 4.3442 4.4152 4.4152 4.5081 4.5081 4.5553 4.5553 4.9022 4.9022 4.9451 4.9451 5.1139 5.1139 5.1465 5.1465 5.3675 5.3675 5.4342 5.4342 5.5536 5.5536 5.6985 5.6985 5.8978 5.8978 5.9168 5.9168 6.1470 6.1470 6.1929 6.1929 6.5604 6.5604 6.7026 6.7026 6.7220 6.7220 6.8263 6.8263 7.1356 7.1356 7.2621 7.2621 7.3185 7.3185 7.5109 7.5109 9.7144 9.7144 9.8239 9.8239 10.0124 10.0124 10.0547 10.0547 10.6510 10.6510 10.6519 10.6519 11.1226 11.1226 11.2521 11.2521 11.9340 11.9340 12.0137 12.0137 12.3806 12.3806 12.4094 12.4094 12.8793 12.8793 12.9013 12.9013 k = 0.5000 0.5000 0.3400 ( 8992 PWs) bands (ev): -31.1745 -31.1745 -31.1745 -31.1745 -31.1719 -31.1719 -31.1719 -31.1719 -12.4586 -12.4586 -12.4573 -12.4573 -12.4497 -12.4497 -12.4479 -12.4479 -12.1069 -12.1069 -12.0972 -12.0972 -12.0920 -12.0920 -12.0845 -12.0845 -12.0629 -12.0629 -12.0550 -12.0550 -12.0437 -12.0437 -12.0375 -12.0375 0.8510 0.8510 0.8609 0.8609 1.2271 1.2271 1.2352 1.2352 4.3558 4.3558 4.4320 4.4320 4.5112 4.5112 4.5573 4.5573 4.9181 4.9181 4.9563 4.9563 5.1146 5.1146 5.1478 5.1478 5.3728 5.3728 5.4337 5.4337 5.5323 5.5323 5.6832 5.6832 5.8930 5.8930 5.9061 5.9061 6.1173 6.1173 6.1682 6.1682 6.5558 6.5558 6.7005 6.7005 6.7212 6.7212 6.8118 6.8118 7.1312 7.1312 7.2415 7.2415 7.2888 7.2888 7.4924 7.4924 9.7931 9.7931 9.9089 9.9089 10.1018 10.1018 10.1544 10.1544 10.6670 10.6670 10.6673 10.6673 11.0765 11.0765 11.2070 11.2070 11.8908 11.8908 11.9771 11.9771 12.3525 12.3525 12.3849 12.3849 12.8855 12.8855 12.9091 12.9091 k = 0.5000 0.5000 0.3600 ( 9004 PWs) bands (ev): -31.1744 -31.1744 -31.1744 -31.1744 -31.1721 -31.1721 -31.1720 -31.1720 -12.4582 -12.4582 -12.4569 -12.4569 -12.4503 -12.4503 -12.4484 -12.4484 -12.1072 -12.1072 -12.0966 -12.0966 -12.0919 -12.0919 -12.0854 -12.0854 -12.0616 -12.0616 -12.0545 -12.0545 -12.0447 -12.0447 -12.0379 -12.0379 0.8725 0.8725 0.8828 0.8828 1.2052 1.2052 1.2136 1.2136 4.3660 4.3660 4.4478 4.4478 4.5144 4.5144 4.5582 4.5582 4.9364 4.9364 4.9686 4.9686 5.1148 5.1148 5.1483 5.1483 5.3786 5.3786 5.4320 5.4320 5.5117 5.5117 5.6673 5.6673 5.8910 5.8910 5.8970 5.8970 6.0884 6.0884 6.1422 6.1422 6.5520 6.5520 6.6990 6.6990 6.7204 6.7204 6.7969 6.7969 7.1290 7.1290 7.2227 7.2227 7.2632 7.2632 7.4773 7.4773 9.8699 9.8699 9.9896 9.9896 10.1840 10.1840 10.2514 10.2514 10.6841 10.6841 10.6844 10.6844 11.0331 11.0331 11.1617 11.1617 11.8507 11.8507 11.9439 11.9439 12.3137 12.3137 12.3496 12.3496 12.8934 12.8934 12.9188 12.9188 k = 0.5000 0.5000 0.3800 ( 9004 PWs) bands (ev): -31.1742 -31.1742 -31.1742 -31.1742 -31.1722 -31.1722 -31.1722 -31.1722 -12.4577 -12.4577 -12.4564 -12.4564 -12.4509 -12.4509 -12.4489 -12.4489 -12.1075 -12.1075 -12.0960 -12.0960 -12.0918 -12.0918 -12.0863 -12.0863 -12.0602 -12.0602 -12.0540 -12.0540 -12.0457 -12.0457 -12.0382 -12.0382 0.8948 0.8948 0.9053 0.9053 1.1826 1.1826 1.1914 1.1914 4.3747 4.3747 4.4625 4.4625 4.5176 4.5176 4.5578 4.5578 4.9569 4.9569 4.9818 4.9818 5.1140 5.1140 5.1475 5.1475 5.3849 5.3849 5.4292 5.4292 5.4922 5.4922 5.6510 5.6510 5.8899 5.8899 5.8920 5.8920 6.0608 6.0608 6.1153 6.1153 6.5489 6.5489 6.6983 6.6983 6.7196 6.7196 6.7824 6.7824 7.1290 7.1290 7.2060 7.2060 7.2411 7.2411 7.4650 7.4650 9.9443 9.9443 10.0647 10.0647 10.2556 10.2556 10.3444 10.3444 10.7024 10.7024 10.7030 10.7030 10.9936 10.9936 11.1160 11.1160 11.8158 11.8158 11.9160 11.9160 12.2648 12.2648 12.3040 12.3040 12.9034 12.9034 12.9308 12.9308 k = 0.5000 0.5000 0.4000 ( 8992 PWs) bands (ev): -31.1741 -31.1741 -31.1740 -31.1740 -31.1724 -31.1724 -31.1724 -31.1724 -12.4572 -12.4572 -12.4559 -12.4559 -12.4514 -12.4514 -12.4494 -12.4494 -12.1077 -12.1077 -12.0953 -12.0953 -12.0917 -12.0917 -12.0872 -12.0872 -12.0589 -12.0589 -12.0535 -12.0535 -12.0467 -12.0467 -12.0385 -12.0385 0.9176 0.9176 0.9284 0.9284 1.1595 1.1595 1.1685 1.1685 4.3819 4.3819 4.4761 4.4761 4.5208 4.5208 4.5561 4.5561 4.9790 4.9790 4.9956 4.9956 5.1120 5.1120 5.1449 5.1449 5.3918 5.3918 5.4257 5.4257 5.4742 5.4742 5.6345 5.6345 5.8847 5.8847 5.8962 5.8962 6.0352 6.0352 6.0880 6.0880 6.5463 6.5463 6.6985 6.6985 6.7189 6.7189 6.7685 6.7685 7.1306 7.1306 7.1918 7.1918 7.2222 7.2222 7.4552 7.4552 10.0159 10.0159 10.1327 10.1327 10.3125 10.3125 10.4324 10.4324 10.7222 10.7222 10.7227 10.7227 10.9589 10.9589 11.0697 11.0697 11.7887 11.7887 11.8953 11.8953 12.2080 12.2080 12.2501 12.2501 12.9156 12.9156 12.9453 12.9453 k = 0.5000 0.5000 0.4200 ( 9008 PWs) bands (ev): -31.1739 -31.1739 -31.1739 -31.1739 -31.1725 -31.1725 -31.1725 -31.1725 -12.4567 -12.4567 -12.4555 -12.4555 -12.4521 -12.4521 -12.4498 -12.4498 -12.1079 -12.1079 -12.0946 -12.0946 -12.0917 -12.0917 -12.0881 -12.0881 -12.0576 -12.0576 -12.0532 -12.0532 -12.0478 -12.0478 -12.0388 -12.0388 0.9408 0.9408 0.9519 0.9519 1.1360 1.1360 1.1452 1.1452 4.3876 4.3876 4.4887 4.4887 4.5236 4.5236 4.5531 4.5531 5.0023 5.0023 5.0097 5.0097 5.1088 5.1088 5.1402 5.1402 5.3992 5.3992 5.4221 5.4221 5.4581 5.4581 5.6185 5.6185 5.8817 5.8817 5.9036 5.9036 6.0122 6.0122 6.0609 6.0609 6.5443 6.5443 6.6997 6.6997 6.7183 6.7183 6.7556 6.7556 7.1338 7.1338 7.1800 7.1800 7.2058 7.2058 7.4476 7.4476 10.0842 10.0842 10.1921 10.1921 10.3508 10.3508 10.5145 10.5145 10.7409 10.7409 10.7457 10.7457 10.9297 10.9297 11.0224 11.0224 11.7716 11.7716 11.8840 11.8840 12.1464 12.1464 12.1905 12.1905 12.9296 12.9296 12.9621 12.9621 k = 0.5000 0.5000 0.4400 ( 9032 PWs) bands (ev): -31.1737 -31.1737 -31.1737 -31.1737 -31.1727 -31.1727 -31.1727 -31.1727 -12.4562 -12.4562 -12.4552 -12.4552 -12.4527 -12.4527 -12.4503 -12.4503 -12.1081 -12.1081 -12.0939 -12.0939 -12.0916 -12.0916 -12.0890 -12.0890 -12.0563 -12.0563 -12.0529 -12.0529 -12.0490 -12.0490 -12.0390 -12.0390 0.9645 0.9645 0.9758 0.9758 1.1122 1.1122 1.1215 1.1215 4.3919 4.3919 4.5002 4.5002 4.5259 4.5259 4.5488 4.5488 5.0234 5.0234 5.0259 5.0259 5.1042 5.1042 5.1327 5.1327 5.4065 5.4065 5.4189 5.4189 5.4443 5.4443 5.6037 5.6037 5.8806 5.8806 5.9142 5.9142 5.9927 5.9927 6.0344 6.0344 6.5428 6.5428 6.7021 6.7021 6.7177 6.7177 6.7439 6.7439 7.1383 7.1383 7.1709 7.1709 7.1916 7.1916 7.4419 7.4419 10.1487 10.1487 10.2409 10.2409 10.3678 10.3678 10.5899 10.5899 10.7579 10.7579 10.7711 10.7711 10.9058 10.9058 10.9738 10.9738 11.7662 11.7662 11.8841 11.8841 12.0838 12.0838 12.1284 12.1284 12.9445 12.9445 12.9807 12.9807 k = 0.5000 0.5000 0.4600 ( 9040 PWs) bands (ev): -31.1736 -31.1736 -31.1736 -31.1736 -31.1729 -31.1729 -31.1729 -31.1729 -12.4556 -12.4556 -12.4548 -12.4548 -12.4533 -12.4533 -12.4507 -12.4507 -12.1082 -12.1082 -12.0932 -12.0932 -12.0916 -12.0916 -12.0899 -12.0899 -12.0550 -12.0550 -12.0527 -12.0527 -12.0501 -12.0501 -12.0392 -12.0392 0.9882 0.9882 1.0000 1.0000 1.0883 1.0883 1.0974 1.0974 4.3949 4.3949 4.5108 4.5108 4.5277 4.5277 4.5434 4.5434 5.0359 5.0359 5.0491 5.0491 5.0986 5.0986 5.1220 5.1220 5.4131 5.4131 5.4170 5.4170 5.4332 5.4332 5.5914 5.5914 5.8810 5.8810 5.9279 5.9279 5.9773 5.9773 6.0091 6.0091 6.5417 6.5417 6.7058 6.7058 6.7173 6.7173 6.7335 6.7335 7.1441 7.1441 7.1643 7.1643 7.1792 7.1792 7.4379 7.4379 10.2082 10.2082 10.2773 10.2773 10.3642 10.3642 10.6579 10.6579 10.7722 10.7722 10.7977 10.7977 10.8856 10.8856 10.9241 10.9241 11.7721 11.7721 11.8970 11.8970 12.0256 12.0256 12.0673 12.0673 12.9591 12.9592 13.0006 13.0009 k = 0.5000 0.5000 0.4800 ( 9008 PWs) bands (ev): -31.1734 -31.1734 -31.1734 -31.1734 -31.1730 -31.1730 -31.1730 -31.1730 -12.4550 -12.4550 -12.4546 -12.4546 -12.4539 -12.4539 -12.4509 -12.4509 -12.1083 -12.1083 -12.0923 -12.0923 -12.0915 -12.0915 -12.0907 -12.0907 -12.0537 -12.0537 -12.0525 -12.0525 -12.0513 -12.0513 -12.0392 -12.0392 1.0116 1.0116 1.0243 1.0243 1.0649 1.0649 1.0731 1.0731 4.3966 4.3966 4.5205 4.5205 4.5288 4.5288 4.5368 4.5368 5.0456 5.0456 5.0710 5.0710 5.0933 5.0933 5.1081 5.1081 5.4170 5.4170 5.4178 5.4178 5.4249 5.4249 5.5831 5.5831 5.8820 5.8820 5.9445 5.9445 5.9673 5.9673 5.9854 5.9854 6.5411 6.5411 6.7107 6.7107 6.7170 6.7170 6.7245 6.7245 7.1510 7.1510 7.1604 7.1604 7.1685 7.1685 7.4356 7.4356 10.2618 10.2618 10.2998 10.2998 10.3427 10.3427 10.7143 10.7143 10.7843 10.7843 10.8233 10.8233 10.8665 10.8665 10.8756 10.8756 11.7847 11.7847 11.9231 11.9231 11.9802 11.9802 12.0106 12.0106 12.9711 12.9712 13.0215 13.0232 k = 0.5000 0.5000 0.5000 ( 9008 PWs) bands (ev): -31.1732 -31.1732 -31.1732 -31.1732 -31.1732 -31.1732 -31.1732 -31.1732 -12.4545 -12.4545 -12.4545 -12.4545 -12.4545 -12.4545 -12.4510 -12.4510 -12.1083 -12.1083 -12.0915 -12.0915 -12.0915 -12.0915 -12.0915 -12.0915 -12.0525 -12.0525 -12.0525 -12.0525 -12.0525 -12.0525 -12.0393 -12.0393 1.0277 1.0277 1.0487 1.0487 1.0487 1.0487 1.0487 1.0487 4.3972 4.3972 4.5291 4.5291 4.5291 4.5291 4.5291 4.5291 5.0495 5.0495 5.0909 5.0909 5.0909 5.0909 5.0909 5.0909 5.4196 5.4196 5.4196 5.4196 5.4196 5.4196 5.5802 5.5802 5.8825 5.8825 5.9637 5.9637 5.9637 5.9637 5.9637 5.9637 6.5409 6.5409 6.7169 6.7169 6.7169 6.7169 6.7169 6.7169 7.1591 7.1591 7.1591 7.1591 7.1591 7.1591 7.4348 7.4348 10.3075 10.3075 10.3075 10.3075 10.3075 10.3075 10.7401 10.7401 10.7946 10.7946 10.8462 10.8462 10.8462 10.8462 10.8462 10.8462 11.7921 11.7921 11.9616 11.9616 11.9616 11.9616 11.9616 11.9616 12.9762 12.9768 13.0424 13.0424 Writing output data file CaSiPt.save init_run : 1.92s CPU 1.12s WALL ( 1 calls) electrons : 1651.34s CPU 1549.39s WALL ( 1 calls) Called by init_run: wfcinit : 0.01s CPU 0.01s WALL ( 1 calls) potinit : 0.23s CPU 0.13s WALL ( 1 calls) Called by electrons: c_bands : 1651.33s CPU 1549.37s WALL ( 1 calls) v_of_rho : 0.04s CPU 0.02s WALL ( 1 calls) v_h : 0.00s CPU 0.00s WALL ( 1 calls) v_xc : 0.03s CPU 0.02s WALL ( 1 calls) newd : 0.80s CPU 0.43s WALL ( 1 calls) Called by c_bands: init_us_2 : 0.29s CPU 0.30s WALL ( 197 calls) cegterg : 1525.42s CPU 1473.49s WALL ( 726 calls) Called by sum_band: Called by *egterg: h_psi : 784.65s CPU 683.99s WALL ( 13748 calls) s_psi : 62.22s CPU 59.74s WALL ( 13748 calls) g_psi : 0.77s CPU 0.72s WALL ( 12825 calls) cdiaghg : 666.30s CPU 666.33s WALL ( 13022 calls) cegterg:over : 56.16s CPU 56.02s WALL ( 12825 calls) cegterg:upda : 35.05s CPU 35.82s WALL ( 12825 calls) cegterg:last : 17.74s CPU 17.76s WALL ( 1537 calls) cdiaghg:chol : 23.62s CPU 23.78s WALL ( 13022 calls) cdiaghg:inve : 18.88s CPU 19.04s WALL ( 13022 calls) cdiaghg:para : 42.76s CPU 43.89s WALL ( 26044 calls) Called by h_psi: h_psi:vloc : 671.20s CPU 575.79s WALL ( 13748 calls) h_psi:vnl : 112.64s CPU 107.36s WALL ( 13748 calls) add_vuspsi : 60.81s CPU 57.50s WALL ( 13748 calls) General routines calbec : 51.72s CPU 49.81s WALL ( 13748 calls) fft : 0.13s CPU 0.07s WALL ( 19 calls) ffts : 0.04s CPU 0.02s WALL ( 4 calls) fftw : 648.95s CPU 553.71s WALL ( 2167532 calls) interpolate : 0.05s CPU 0.03s WALL ( 4 calls) davcio : 0.34s CPU 2.00s WALL ( 394 calls) Parallel routines fft_scatter : 397.57s CPU 398.17s WALL ( 2167555 calls) PWSCF : 28m45.77s CPU 27m22.50s WALL This run was terminated on: 15:12: 1 21Mar2017 =------------------------------------------------------------------------------= JOB DONE. =------------------------------------------------------------------------------=