Program PWSCF v.5.4.0 starts on 29Mar2017 at 6:46:29 This program is part of the open-source Quantum ESPRESSO suite for quantum simulation of materials; please cite "P. Giannozzi et al., J. Phys.:Condens. Matter 21 395502 (2009); URL http://www.quantum-espresso.org", in publications or presentations arising from this work. More details at http://www.quantum-espresso.org/quote Parallel version (MPI & OpenMP), running on 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: ./SiPt2.save/ 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 62 25 7 1892 483 77 Max 64 26 8 1897 500 80 Sum 4519 1843 547 136371 35339 5649 bravais-lattice index = 14 lattice parameter (alat) = 12.3305 a.u. unit-cell volume = 896.5044 (a.u.)^3 number of atoms/cell = 9 number of atomic types = 2 number of electrons = 72.00 number of Kohn-Sham states= 86 kinetic-energy cutoff = 44.0000 Ry charge density cutoff = 433.0000 Ry Exchange-correlation = PBE ( 1 4 3 4 0 0) Non magnetic calculation with spin-orbit celldm(1)= 12.330462 celldm(2)= 1.000000 celldm(3)= 0.552184 celldm(4)= 0.000000 celldm(5)= 0.000000 celldm(6)= -0.500000 crystal axes: (cart. coord. in units of alat) a(1) = ( 1.000000 0.000000 0.000000 ) a(2) = ( -0.500000 0.866025 0.000000 ) a(3) = ( 0.000000 0.000000 0.552184 ) reciprocal axes: (cart. coord. in units 2 pi/alat) b(1) = ( 1.000000 0.577350 -0.000000 ) b(2) = ( 0.000000 1.154701 -0.000000 ) b(3) = ( 0.000000 0.000000 1.810991 ) PseudoPot. # 1 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. # 2 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 Pt 10.00 195.08400 Pt( 1.00) Si 4.00 28.08550 Si( 1.00) 12 Sym. Ops. (no inversion) found s frac. trans. isym = 1 identity cryst. s( 1) = ( 1 0 0 ) ( 0 1 0 ) ( 0 0 1 ) cart. s( 1) = ( 1.0000000 -0.0000000 -0.0000000 ) ( 0.0000000 1.0000000 -0.0000000 ) ( 0.0000000 0.0000000 1.0000000 ) isym = 2 180 deg rotation - cart. axis [1,0,0] cryst. s( 2) = ( 1 0 0 ) ( -1 -1 0 ) ( 0 0 -1 ) cart. s( 2) = ( 1.0000000 0.0000000 -0.0000000 ) ( 0.0000000 -1.0000000 0.0000000 ) ( 0.0000000 0.0000000 -1.0000000 ) isym = 3 120 deg rotation - cryst. axis [0,0,1] cryst. s( 3) = ( 0 1 0 ) ( -1 -1 0 ) ( 0 0 1 ) cart. s( 3) = ( -0.5000000 -0.8660254 0.0000000 ) ( 0.8660254 -0.5000000 0.0000000 ) ( 0.0000000 0.0000000 1.0000000 ) isym = 4 120 deg rotation - cryst. axis [0,0,-1] cryst. s( 4) = ( -1 -1 0 ) ( 1 0 0 ) ( 0 0 1 ) cart. s( 4) = ( -0.5000000 0.8660254 -0.0000000 ) ( -0.8660254 -0.5000000 0.0000000 ) ( 0.0000000 0.0000000 1.0000000 ) isym = 5 180 deg rotation - cryst. axis [0,1,0] cryst. s( 5) = ( -1 -1 0 ) ( 0 1 0 ) ( 0 0 -1 ) cart. s( 5) = ( -0.5000000 -0.8660254 0.0000000 ) ( -0.8660254 0.5000000 -0.0000000 ) ( 0.0000000 0.0000000 -1.0000000 ) isym = 6 180 deg rotation - cryst. axis [1,1,0] cryst. s( 6) = ( 0 1 0 ) ( 1 0 0 ) ( 0 0 -1 ) cart. s( 6) = ( -0.5000000 0.8660254 -0.0000000 ) ( 0.8660254 0.5000000 -0.0000000 ) ( 0.0000000 0.0000000 -1.0000000 ) isym = 7 inv. 180 deg rotation - cart. axis [0,0,1] cryst. s( 7) = ( 1 0 0 ) ( 0 1 0 ) ( 0 0 -1 ) cart. s( 7) = ( 1.0000000 -0.0000000 -0.0000000 ) ( 0.0000000 1.0000000 -0.0000000 ) ( 0.0000000 0.0000000 -1.0000000 ) isym = 8 inv. 180 deg rotation - cart. axis [0,1,0] cryst. s( 8) = ( 1 0 0 ) ( -1 -1 0 ) ( 0 0 1 ) cart. s( 8) = ( 1.0000000 0.0000000 -0.0000000 ) ( 0.0000000 -1.0000000 0.0000000 ) ( 0.0000000 0.0000000 1.0000000 ) isym = 9 inv. 60 deg rotation - cryst. axis [0,0,1] cryst. s( 9) = ( -1 -1 0 ) ( 1 0 0 ) ( 0 0 -1 ) cart. s( 9) = ( -0.5000000 0.8660254 -0.0000000 ) ( -0.8660254 -0.5000000 0.0000000 ) ( 0.0000000 0.0000000 -1.0000000 ) isym = 10 inv. 60 deg rotation - cryst. axis [0,0,-1] cryst. s(10) = ( 0 1 0 ) ( -1 -1 0 ) ( 0 0 -1 ) cart. s(10) = ( -0.5000000 -0.8660254 0.0000000 ) ( 0.8660254 -0.5000000 -0.0000000 ) ( 0.0000000 0.0000000 -1.0000000 ) isym = 11 inv. 180 deg rotation - cryst. axis [1,-1,0] cryst. s(11) = ( 0 1 0 ) ( 1 0 0 ) ( 0 0 1 ) cart. s(11) = ( -0.5000000 0.8660254 -0.0000000 ) ( 0.8660254 0.5000000 -0.0000000 ) ( 0.0000000 0.0000000 1.0000000 ) isym = 12 inv. 180 deg rotation - cryst. axis [2,1,0] cryst. s(12) = ( -1 -1 0 ) ( 0 1 0 ) ( 0 0 1 ) cart. s(12) = ( -0.5000000 -0.8660254 0.0000000 ) ( -0.8660254 0.5000000 0.0000000 ) ( 0.0000000 0.0000000 1.0000000 ) double point group D_3h (-62m) there are 9 classes and 3 irreducible representations the character table: E -E 2C3 -2C3 3C2' s_h 2S3 -2S3 3s_v -3C2' -s_h' -3s_v G_7 2.00 -2.00 1.00 -1.00 0.00 0.00 1.73 -1.73 0.00 G_8 2.00 -2.00 1.00 -1.00 0.00 0.00 -1.73 1.73 0.00 G_9 2.00 -2.00 -2.00 2.00 0.00 0.00 0.00 0.00 0.00 the symmetry operations in each class and the name of the first element: E 1 identity -E -1 identity E 2C3 3 4 120 deg rotation - cryst. axis [0,0,1] -2C3 -3 -4 120 deg rotation - cryst. axis [0,0,1] E 3C2'-3C2' 2 5 -6 -2 6 -5 180 deg rotation - cart. axis [1,0,0] 2S3 9 10 inv. 60 deg rotation - cryst. axis [0,0,1] -2S3 -9 -10 inv. 60 deg rotation - cryst. axis [0,0,1] E 3s_v-3s_v 7 -7 inv. 180 deg rotation - cart. axis [0,0,1] 3s_v-3s_v 8 -8 -12 -11 11 12 inv. 180 deg rotation - cart. axis [0,1,0] Cartesian axes number of k points= 297 Fermi-Dirac smearing, width (Ry)= 0.0010 cart. coord. in units 2pi/alat k( 1) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0033670 k( 2) = ( 0.0178571 0.0103098 -0.0000000), wk = 0.0033670 k( 3) = ( 0.0357143 0.0206197 -0.0000000), wk = 0.0033670 k( 4) = ( 0.0535714 0.0309295 -0.0000000), wk = 0.0033670 k( 5) = ( 0.0714286 0.0412393 -0.0000000), wk = 0.0033670 k( 6) = ( 0.0892857 0.0515491 -0.0000000), wk = 0.0033670 k( 7) = ( 0.1071429 0.0618590 -0.0000000), wk = 0.0033670 k( 8) = ( 0.1250000 0.0721688 -0.0000000), wk = 0.0033670 k( 9) = ( 0.1428571 0.0824786 -0.0000000), wk = 0.0033670 k( 10) = ( 0.1607143 0.0927884 -0.0000000), wk = 0.0033670 k( 11) = ( 0.1785714 0.1030983 -0.0000000), wk = 0.0033670 k( 12) = ( 0.1964286 0.1134081 -0.0000000), wk = 0.0033670 k( 13) = ( 0.2142857 0.1237179 -0.0000000), wk = 0.0033670 k( 14) = ( 0.2321429 0.1340277 -0.0000000), wk = 0.0033670 k( 15) = ( 0.2500000 0.1443376 -0.0000000), wk = 0.0033670 k( 16) = ( 0.2678571 0.1546474 -0.0000000), wk = 0.0033670 k( 17) = ( 0.2857143 0.1649572 -0.0000000), wk = 0.0033670 k( 18) = ( 0.3035714 0.1752670 -0.0000000), wk = 0.0033670 k( 19) = ( 0.3214286 0.1855769 -0.0000000), wk = 0.0033670 k( 20) = ( 0.3392857 0.1958867 -0.0000000), wk = 0.0033670 k( 21) = ( 0.3571429 0.2061965 -0.0000000), wk = 0.0033670 k( 22) = ( 0.3750000 0.2165064 -0.0000000), wk = 0.0033670 k( 23) = ( 0.3928571 0.2268162 -0.0000000), wk = 0.0033670 k( 24) = ( 0.4107143 0.2371260 -0.0000000), wk = 0.0033670 k( 25) = ( 0.4285714 0.2474358 -0.0000000), wk = 0.0033670 k( 26) = ( 0.4464286 0.2577457 -0.0000000), wk = 0.0033670 k( 27) = ( 0.4642857 0.2680555 -0.0000000), wk = 0.0033670 k( 28) = ( 0.4821429 0.2783653 -0.0000000), wk = 0.0033670 k( 29) = ( 0.5000000 0.2886751 -0.0000000), wk = 0.0033670 k( 30) = ( 0.5000000 0.2886751 -0.0000000), wk = 0.0033670 k( 31) = ( 0.4901961 0.3056560 -0.0000000), wk = 0.0033670 k( 32) = ( 0.4803922 0.3226369 -0.0000000), wk = 0.0033670 k( 33) = ( 0.4705882 0.3396178 -0.0000000), wk = 0.0033670 k( 34) = ( 0.4607843 0.3565987 -0.0000000), wk = 0.0033670 k( 35) = ( 0.4509804 0.3735796 -0.0000000), wk = 0.0033670 k( 36) = ( 0.4411765 0.3905605 -0.0000000), wk = 0.0033670 k( 37) = ( 0.4313726 0.4075414 -0.0000000), wk = 0.0033670 k( 38) = ( 0.4215686 0.4245223 -0.0000000), wk = 0.0033670 k( 39) = ( 0.4117647 0.4415032 -0.0000000), wk = 0.0033670 k( 40) = ( 0.4019608 0.4584840 -0.0000000), wk = 0.0033670 k( 41) = ( 0.3921569 0.4754649 -0.0000000), wk = 0.0033670 k( 42) = ( 0.3823529 0.4924458 -0.0000000), wk = 0.0033670 k( 43) = ( 0.3725490 0.5094267 -0.0000000), wk = 0.0033670 k( 44) = ( 0.3627451 0.5264076 -0.0000000), wk = 0.0033670 k( 45) = ( 0.3529412 0.5433885 -0.0000000), wk = 0.0033670 k( 46) = ( 0.3431373 0.5603694 -0.0000000), wk = 0.0033670 k( 47) = ( 0.3333333 0.5773503 -0.0000000), wk = 0.0033670 k( 48) = ( 0.3333333 0.5773503 -0.0000000), wk = 0.0033670 k( 49) = ( 0.3232323 0.5598548 -0.0000000), wk = 0.0033670 k( 50) = ( 0.3131313 0.5423593 -0.0000000), wk = 0.0033670 k( 51) = ( 0.3030303 0.5248639 -0.0000000), wk = 0.0033670 k( 52) = ( 0.2929293 0.5073684 -0.0000000), wk = 0.0033670 k( 53) = ( 0.2828283 0.4898730 -0.0000000), wk = 0.0033670 k( 54) = ( 0.2727273 0.4723775 -0.0000000), wk = 0.0033670 k( 55) = ( 0.2626263 0.4548820 -0.0000000), wk = 0.0033670 k( 56) = ( 0.2525252 0.4373866 -0.0000000), wk = 0.0033670 k( 57) = ( 0.2424242 0.4198911 -0.0000000), wk = 0.0033670 k( 58) = ( 0.2323232 0.4023956 -0.0000000), wk = 0.0033670 k( 59) = ( 0.2222222 0.3849002 -0.0000000), wk = 0.0033670 k( 60) = ( 0.2121212 0.3674047 -0.0000000), wk = 0.0033670 k( 61) = ( 0.2020202 0.3499093 -0.0000000), wk = 0.0033670 k( 62) = ( 0.1919192 0.3324138 -0.0000000), wk = 0.0033670 k( 63) = ( 0.1818182 0.3149183 -0.0000000), wk = 0.0033670 k( 64) = ( 0.1717172 0.2974229 -0.0000000), wk = 0.0033670 k( 65) = ( 0.1616162 0.2799274 -0.0000000), wk = 0.0033670 k( 66) = ( 0.1515151 0.2624319 -0.0000000), wk = 0.0033670 k( 67) = ( 0.1414141 0.2449365 -0.0000000), wk = 0.0033670 k( 68) = ( 0.1313131 0.2274410 -0.0000000), wk = 0.0033670 k( 69) = ( 0.1212121 0.2099456 -0.0000000), wk = 0.0033670 k( 70) = ( 0.1111111 0.1924501 -0.0000000), wk = 0.0033670 k( 71) = ( 0.1010101 0.1749546 -0.0000000), wk = 0.0033670 k( 72) = ( 0.0909091 0.1574592 -0.0000000), wk = 0.0033670 k( 73) = ( 0.0808081 0.1399637 -0.0000000), wk = 0.0033670 k( 74) = ( 0.0707071 0.1224682 -0.0000000), wk = 0.0033670 k( 75) = ( 0.0606061 0.1049728 -0.0000000), wk = 0.0033670 k( 76) = ( 0.0505051 0.0874773 -0.0000000), wk = 0.0033670 k( 77) = ( 0.0404040 0.0699819 -0.0000000), wk = 0.0033670 k( 78) = ( 0.0303030 0.0524864 -0.0000000), wk = 0.0033670 k( 79) = ( 0.0202020 0.0349909 -0.0000000), wk = 0.0033670 k( 80) = ( 0.0101010 0.0174955 -0.0000000), wk = 0.0033670 k( 81) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0033670 k( 82) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0033670 k( 83) = ( 0.0000000 0.0000000 0.0205794), wk = 0.0033670 k( 84) = ( 0.0000000 0.0000000 0.0411589), wk = 0.0033670 k( 85) = ( 0.0000000 0.0000000 0.0617383), wk = 0.0033670 k( 86) = ( 0.0000000 0.0000000 0.0823178), wk = 0.0033670 k( 87) = ( 0.0000000 0.0000000 0.1028972), wk = 0.0033670 k( 88) = ( 0.0000000 0.0000000 0.1234767), wk = 0.0033670 k( 89) = ( 0.0000000 0.0000000 0.1440561), wk = 0.0033670 k( 90) = ( 0.0000000 0.0000000 0.1646355), wk = 0.0033670 k( 91) = ( 0.0000000 0.0000000 0.1852150), wk = 0.0033670 k( 92) = ( 0.0000000 0.0000000 0.2057944), wk = 0.0033670 k( 93) = ( 0.0000000 0.0000000 0.2263739), wk = 0.0033670 k( 94) = ( 0.0000000 0.0000000 0.2469533), wk = 0.0033670 k( 95) = ( 0.0000000 0.0000000 0.2675327), wk = 0.0033670 k( 96) = ( 0.0000000 0.0000000 0.2881122), wk = 0.0033670 k( 97) = ( 0.0000000 0.0000000 0.3086916), wk = 0.0033670 k( 98) = ( 0.0000000 0.0000000 0.3292711), wk = 0.0033670 k( 99) = ( 0.0000000 0.0000000 0.3498505), wk = 0.0033670 k( 100) = ( 0.0000000 0.0000000 0.3704299), wk = 0.0033670 k( 101) = ( 0.0000000 0.0000000 0.3910094), wk = 0.0033670 k( 102) = ( 0.0000000 0.0000000 0.4115888), wk = 0.0033670 k( 103) = ( 0.0000000 0.0000000 0.4321683), wk = 0.0033670 k( 104) = ( 0.0000000 0.0000000 0.4527477), wk = 0.0033670 k( 105) = ( 0.0000000 0.0000000 0.4733272), wk = 0.0033670 k( 106) = ( 0.0000000 0.0000000 0.4939066), wk = 0.0033670 k( 107) = ( 0.0000000 0.0000000 0.5144860), wk = 0.0033670 k( 108) = ( 0.0000000 0.0000000 0.5350655), wk = 0.0033670 k( 109) = ( 0.0000000 0.0000000 0.5556449), wk = 0.0033670 k( 110) = ( 0.0000000 0.0000000 0.5762244), wk = 0.0033670 k( 111) = ( 0.0000000 0.0000000 0.5968038), wk = 0.0033670 k( 112) = ( 0.0000000 0.0000000 0.6173832), wk = 0.0033670 k( 113) = ( 0.0000000 0.0000000 0.6379627), wk = 0.0033670 k( 114) = ( 0.0000000 0.0000000 0.6585421), wk = 0.0033670 k( 115) = ( 0.0000000 0.0000000 0.6791216), wk = 0.0033670 k( 116) = ( 0.0000000 0.0000000 0.6997010), wk = 0.0033670 k( 117) = ( 0.0000000 0.0000000 0.7202804), wk = 0.0033670 k( 118) = ( 0.0000000 0.0000000 0.7408599), wk = 0.0033670 k( 119) = ( 0.0000000 0.0000000 0.7614393), wk = 0.0033670 k( 120) = ( 0.0000000 0.0000000 0.7820188), wk = 0.0033670 k( 121) = ( 0.0000000 0.0000000 0.8025982), wk = 0.0033670 k( 122) = ( 0.0000000 0.0000000 0.8231776), wk = 0.0033670 k( 123) = ( 0.0000000 0.0000000 0.8437571), wk = 0.0033670 k( 124) = ( 0.0000000 0.0000000 0.8643365), wk = 0.0033670 k( 125) = ( 0.0000000 0.0000000 0.8849160), wk = 0.0033670 k( 126) = ( 0.0000000 0.0000000 0.9054954), wk = 0.0033670 k( 127) = ( 0.0000000 0.0000000 0.9054954), wk = 0.0033670 k( 128) = ( 0.0178571 0.0103098 0.9054954), wk = 0.0033670 k( 129) = ( 0.0357143 0.0206197 0.9054954), wk = 0.0033670 k( 130) = ( 0.0535714 0.0309295 0.9054954), wk = 0.0033670 k( 131) = ( 0.0714286 0.0412393 0.9054954), wk = 0.0033670 k( 132) = ( 0.0892857 0.0515491 0.9054954), wk = 0.0033670 k( 133) = ( 0.1071429 0.0618590 0.9054954), wk = 0.0033670 k( 134) = ( 0.1250000 0.0721688 0.9054954), wk = 0.0033670 k( 135) = ( 0.1428571 0.0824786 0.9054954), wk = 0.0033670 k( 136) = ( 0.1607143 0.0927884 0.9054954), wk = 0.0033670 k( 137) = ( 0.1785714 0.1030983 0.9054954), wk = 0.0033670 k( 138) = ( 0.1964286 0.1134081 0.9054954), wk = 0.0033670 k( 139) = ( 0.2142857 0.1237179 0.9054954), wk = 0.0033670 k( 140) = ( 0.2321429 0.1340277 0.9054954), wk = 0.0033670 k( 141) = ( 0.2500000 0.1443376 0.9054954), wk = 0.0033670 k( 142) = ( 0.2678571 0.1546474 0.9054954), wk = 0.0033670 k( 143) = ( 0.2857143 0.1649572 0.9054954), wk = 0.0033670 k( 144) = ( 0.3035714 0.1752670 0.9054954), wk = 0.0033670 k( 145) = ( 0.3214286 0.1855769 0.9054954), wk = 0.0033670 k( 146) = ( 0.3392857 0.1958867 0.9054954), wk = 0.0033670 k( 147) = ( 0.3571429 0.2061965 0.9054954), wk = 0.0033670 k( 148) = ( 0.3750000 0.2165064 0.9054954), wk = 0.0033670 k( 149) = ( 0.3928571 0.2268162 0.9054954), wk = 0.0033670 k( 150) = ( 0.4107143 0.2371260 0.9054954), wk = 0.0033670 k( 151) = ( 0.4285714 0.2474358 0.9054954), wk = 0.0033670 k( 152) = ( 0.4464286 0.2577457 0.9054954), wk = 0.0033670 k( 153) = ( 0.4642857 0.2680555 0.9054954), wk = 0.0033670 k( 154) = ( 0.4821429 0.2783653 0.9054954), wk = 0.0033670 k( 155) = ( 0.5000000 0.2886751 0.9054954), wk = 0.0033670 k( 156) = ( 0.5000000 0.2886751 0.9054954), wk = 0.0033670 k( 157) = ( 0.4901961 0.3056560 0.9054954), wk = 0.0033670 k( 158) = ( 0.4803922 0.3226369 0.9054954), wk = 0.0033670 k( 159) = ( 0.4705882 0.3396178 0.9054954), wk = 0.0033670 k( 160) = ( 0.4607843 0.3565987 0.9054954), wk = 0.0033670 k( 161) = ( 0.4509804 0.3735796 0.9054954), wk = 0.0033670 k( 162) = ( 0.4411765 0.3905605 0.9054954), wk = 0.0033670 k( 163) = ( 0.4313726 0.4075414 0.9054954), wk = 0.0033670 k( 164) = ( 0.4215686 0.4245223 0.9054954), wk = 0.0033670 k( 165) = ( 0.4117647 0.4415032 0.9054954), wk = 0.0033670 k( 166) = ( 0.4019608 0.4584840 0.9054954), wk = 0.0033670 k( 167) = ( 0.3921569 0.4754649 0.9054954), wk = 0.0033670 k( 168) = ( 0.3823529 0.4924458 0.9054954), wk = 0.0033670 k( 169) = ( 0.3725490 0.5094267 0.9054954), wk = 0.0033670 k( 170) = ( 0.3627451 0.5264076 0.9054954), wk = 0.0033670 k( 171) = ( 0.3529412 0.5433885 0.9054954), wk = 0.0033670 k( 172) = ( 0.3431373 0.5603694 0.9054954), wk = 0.0033670 k( 173) = ( 0.3333333 0.5773503 0.9054954), wk = 0.0033670 k( 174) = ( 0.3333333 0.5773503 0.9054954), wk = 0.0033670 k( 175) = ( 0.3232323 0.5598548 0.9054954), wk = 0.0033670 k( 176) = ( 0.3131313 0.5423593 0.9054954), wk = 0.0033670 k( 177) = ( 0.3030303 0.5248639 0.9054954), wk = 0.0033670 k( 178) = ( 0.2929293 0.5073684 0.9054954), wk = 0.0033670 k( 179) = ( 0.2828283 0.4898730 0.9054954), wk = 0.0033670 k( 180) = ( 0.2727273 0.4723775 0.9054954), wk = 0.0033670 k( 181) = ( 0.2626263 0.4548820 0.9054954), wk = 0.0033670 k( 182) = ( 0.2525252 0.4373866 0.9054954), wk = 0.0033670 k( 183) = ( 0.2424242 0.4198911 0.9054954), wk = 0.0033670 k( 184) = ( 0.2323232 0.4023956 0.9054954), wk = 0.0033670 k( 185) = ( 0.2222222 0.3849002 0.9054954), wk = 0.0033670 k( 186) = ( 0.2121212 0.3674047 0.9054954), wk = 0.0033670 k( 187) = ( 0.2020202 0.3499093 0.9054954), wk = 0.0033670 k( 188) = ( 0.1919192 0.3324138 0.9054954), wk = 0.0033670 k( 189) = ( 0.1818182 0.3149183 0.9054954), wk = 0.0033670 k( 190) = ( 0.1717172 0.2974229 0.9054954), wk = 0.0033670 k( 191) = ( 0.1616162 0.2799274 0.9054954), wk = 0.0033670 k( 192) = ( 0.1515151 0.2624319 0.9054954), wk = 0.0033670 k( 193) = ( 0.1414141 0.2449365 0.9054954), wk = 0.0033670 k( 194) = ( 0.1313131 0.2274410 0.9054954), wk = 0.0033670 k( 195) = ( 0.1212121 0.2099456 0.9054954), wk = 0.0033670 k( 196) = ( 0.1111111 0.1924501 0.9054954), wk = 0.0033670 k( 197) = ( 0.1010101 0.1749546 0.9054954), wk = 0.0033670 k( 198) = ( 0.0909091 0.1574592 0.9054954), wk = 0.0033670 k( 199) = ( 0.0808081 0.1399637 0.9054954), wk = 0.0033670 k( 200) = ( 0.0707071 0.1224682 0.9054954), wk = 0.0033670 k( 201) = ( 0.0606061 0.1049728 0.9054954), wk = 0.0033670 k( 202) = ( 0.0505051 0.0874773 0.9054954), wk = 0.0033670 k( 203) = ( 0.0404040 0.0699819 0.9054954), wk = 0.0033670 k( 204) = ( 0.0303030 0.0524864 0.9054954), wk = 0.0033670 k( 205) = ( 0.0202020 0.0349909 0.9054954), wk = 0.0033670 k( 206) = ( 0.0101010 0.0174955 0.9054954), wk = 0.0033670 k( 207) = ( 0.0000000 0.0000000 0.9054954), wk = 0.0033670 k( 208) = ( 0.5000000 0.2886751 0.9054954), wk = 0.0033670 k( 209) = ( 0.5000000 0.2886751 0.8849160), wk = 0.0033670 k( 210) = ( 0.5000000 0.2886751 0.8643365), wk = 0.0033670 k( 211) = ( 0.5000000 0.2886751 0.8437571), wk = 0.0033670 k( 212) = ( 0.5000000 0.2886751 0.8231776), wk = 0.0033670 k( 213) = ( 0.5000000 0.2886751 0.8025982), wk = 0.0033670 k( 214) = ( 0.5000000 0.2886751 0.7820188), wk = 0.0033670 k( 215) = ( 0.5000000 0.2886751 0.7614393), wk = 0.0033670 k( 216) = ( 0.5000000 0.2886751 0.7408599), wk = 0.0033670 k( 217) = ( 0.5000000 0.2886751 0.7202804), wk = 0.0033670 k( 218) = ( 0.5000000 0.2886751 0.6997010), wk = 0.0033670 k( 219) = ( 0.5000000 0.2886751 0.6791216), wk = 0.0033670 k( 220) = ( 0.5000000 0.2886751 0.6585421), wk = 0.0033670 k( 221) = ( 0.5000000 0.2886751 0.6379627), wk = 0.0033670 k( 222) = ( 0.5000000 0.2886751 0.6173832), wk = 0.0033670 k( 223) = ( 0.5000000 0.2886751 0.5968038), wk = 0.0033670 k( 224) = ( 0.5000000 0.2886751 0.5762244), wk = 0.0033670 k( 225) = ( 0.5000000 0.2886751 0.5556449), wk = 0.0033670 k( 226) = ( 0.5000000 0.2886751 0.5350655), wk = 0.0033670 k( 227) = ( 0.5000000 0.2886751 0.5144860), wk = 0.0033670 k( 228) = ( 0.5000000 0.2886751 0.4939066), wk = 0.0033670 k( 229) = ( 0.5000000 0.2886751 0.4733272), wk = 0.0033670 k( 230) = ( 0.5000000 0.2886751 0.4527477), wk = 0.0033670 k( 231) = ( 0.5000000 0.2886751 0.4321683), wk = 0.0033670 k( 232) = ( 0.5000000 0.2886751 0.4115888), wk = 0.0033670 k( 233) = ( 0.5000000 0.2886751 0.3910094), wk = 0.0033670 k( 234) = ( 0.5000000 0.2886751 0.3704299), wk = 0.0033670 k( 235) = ( 0.5000000 0.2886751 0.3498505), wk = 0.0033670 k( 236) = ( 0.5000000 0.2886751 0.3292711), wk = 0.0033670 k( 237) = ( 0.5000000 0.2886751 0.3086916), wk = 0.0033670 k( 238) = ( 0.5000000 0.2886751 0.2881122), wk = 0.0033670 k( 239) = ( 0.5000000 0.2886751 0.2675327), wk = 0.0033670 k( 240) = ( 0.5000000 0.2886751 0.2469533), wk = 0.0033670 k( 241) = ( 0.5000000 0.2886751 0.2263739), wk = 0.0033670 k( 242) = ( 0.5000000 0.2886751 0.2057944), wk = 0.0033670 k( 243) = ( 0.5000000 0.2886751 0.1852150), wk = 0.0033670 k( 244) = ( 0.5000000 0.2886751 0.1646355), wk = 0.0033670 k( 245) = ( 0.5000000 0.2886751 0.1440561), wk = 0.0033670 k( 246) = ( 0.5000000 0.2886751 0.1234767), wk = 0.0033670 k( 247) = ( 0.5000000 0.2886751 0.1028972), wk = 0.0033670 k( 248) = ( 0.5000000 0.2886751 0.0823178), wk = 0.0033670 k( 249) = ( 0.5000000 0.2886751 0.0617383), wk = 0.0033670 k( 250) = ( 0.5000000 0.2886751 0.0411589), wk = 0.0033670 k( 251) = ( 0.5000000 0.2886751 0.0205794), wk = 0.0033670 k( 252) = ( 0.5000000 0.2886751 -0.0000000), wk = 0.0033670 k( 253) = ( 0.3333333 0.5773503 -0.0000000), wk = 0.0033670 k( 254) = ( 0.3333333 0.5773503 0.0205794), wk = 0.0033670 k( 255) = ( 0.3333333 0.5773503 0.0411589), wk = 0.0033670 k( 256) = ( 0.3333333 0.5773503 0.0617383), wk = 0.0033670 k( 257) = ( 0.3333333 0.5773503 0.0823178), wk = 0.0033670 k( 258) = ( 0.3333333 0.5773503 0.1028972), wk = 0.0033670 k( 259) = ( 0.3333333 0.5773503 0.1234767), wk = 0.0033670 k( 260) = ( 0.3333333 0.5773503 0.1440561), wk = 0.0033670 k( 261) = ( 0.3333333 0.5773503 0.1646355), wk = 0.0033670 k( 262) = ( 0.3333333 0.5773503 0.1852150), wk = 0.0033670 k( 263) = ( 0.3333333 0.5773503 0.2057944), wk = 0.0033670 k( 264) = ( 0.3333333 0.5773503 0.2263739), wk = 0.0033670 k( 265) = ( 0.3333333 0.5773503 0.2469533), wk = 0.0033670 k( 266) = ( 0.3333333 0.5773503 0.2675327), wk = 0.0033670 k( 267) = ( 0.3333333 0.5773503 0.2881122), wk = 0.0033670 k( 268) = ( 0.3333333 0.5773503 0.3086916), wk = 0.0033670 k( 269) = ( 0.3333333 0.5773503 0.3292711), wk = 0.0033670 k( 270) = ( 0.3333333 0.5773503 0.3498505), wk = 0.0033670 k( 271) = ( 0.3333333 0.5773503 0.3704299), wk = 0.0033670 k( 272) = ( 0.3333333 0.5773503 0.3910094), wk = 0.0033670 k( 273) = ( 0.3333333 0.5773503 0.4115888), wk = 0.0033670 k( 274) = ( 0.3333333 0.5773503 0.4321683), wk = 0.0033670 k( 275) = ( 0.3333333 0.5773503 0.4527477), wk = 0.0033670 k( 276) = ( 0.3333333 0.5773503 0.4733272), wk = 0.0033670 k( 277) = ( 0.3333333 0.5773503 0.4939066), wk = 0.0033670 k( 278) = ( 0.3333333 0.5773503 0.5144860), wk = 0.0033670 k( 279) = ( 0.3333333 0.5773503 0.5350655), wk = 0.0033670 k( 280) = ( 0.3333333 0.5773503 0.5556449), wk = 0.0033670 k( 281) = ( 0.3333333 0.5773503 0.5762244), wk = 0.0033670 k( 282) = ( 0.3333333 0.5773503 0.5968038), wk = 0.0033670 k( 283) = ( 0.3333333 0.5773503 0.6173832), wk = 0.0033670 k( 284) = ( 0.3333333 0.5773503 0.6379627), wk = 0.0033670 k( 285) = ( 0.3333333 0.5773503 0.6585421), wk = 0.0033670 k( 286) = ( 0.3333333 0.5773503 0.6791216), wk = 0.0033670 k( 287) = ( 0.3333333 0.5773503 0.6997010), wk = 0.0033670 k( 288) = ( 0.3333333 0.5773503 0.7202804), wk = 0.0033670 k( 289) = ( 0.3333333 0.5773503 0.7408599), wk = 0.0033670 k( 290) = ( 0.3333333 0.5773503 0.7614393), wk = 0.0033670 k( 291) = ( 0.3333333 0.5773503 0.7820188), wk = 0.0033670 k( 292) = ( 0.3333333 0.5773503 0.8025982), wk = 0.0033670 k( 293) = ( 0.3333333 0.5773503 0.8231776), wk = 0.0033670 k( 294) = ( 0.3333333 0.5773503 0.8437571), wk = 0.0033670 k( 295) = ( 0.3333333 0.5773503 0.8643365), wk = 0.0033670 k( 296) = ( 0.3333333 0.5773503 0.8849160), wk = 0.0033670 k( 297) = ( 0.3333333 0.5773503 0.9054954), wk = 0.0033670 cryst. coord. k( 1) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0033670 k( 2) = ( 0.0178571 -0.0000000 -0.0000000), wk = 0.0033670 k( 3) = ( 0.0357143 -0.0000000 -0.0000000), wk = 0.0033670 k( 4) = ( 0.0535714 -0.0000000 -0.0000000), wk = 0.0033670 k( 5) = ( 0.0714286 -0.0000000 -0.0000000), wk = 0.0033670 k( 6) = ( 0.0892857 0.0000000 -0.0000000), wk = 0.0033670 k( 7) = ( 0.1071429 -0.0000000 -0.0000000), wk = 0.0033670 k( 8) = ( 0.1250000 0.0000000 -0.0000000), wk = 0.0033670 k( 9) = ( 0.1428571 -0.0000000 -0.0000000), wk = 0.0033670 k( 10) = ( 0.1607143 0.0000000 -0.0000000), wk = 0.0033670 k( 11) = ( 0.1785714 0.0000000 -0.0000000), wk = 0.0033670 k( 12) = ( 0.1964286 -0.0000000 -0.0000000), wk = 0.0033670 k( 13) = ( 0.2142857 -0.0000000 -0.0000000), wk = 0.0033670 k( 14) = ( 0.2321429 0.0000000 -0.0000000), wk = 0.0033670 k( 15) = ( 0.2500000 0.0000000 -0.0000000), wk = 0.0033670 k( 16) = ( 0.2678571 -0.0000000 -0.0000000), wk = 0.0033670 k( 17) = ( 0.2857143 -0.0000000 -0.0000000), wk = 0.0033670 k( 18) = ( 0.3035714 -0.0000000 -0.0000000), wk = 0.0033670 k( 19) = ( 0.3214286 -0.0000000 -0.0000000), wk = 0.0033670 k( 20) = ( 0.3392857 -0.0000000 -0.0000000), wk = 0.0033670 k( 21) = ( 0.3571429 0.0000000 -0.0000000), wk = 0.0033670 k( 22) = ( 0.3750000 0.0000000 -0.0000000), wk = 0.0033670 k( 23) = ( 0.3928571 -0.0000000 -0.0000000), wk = 0.0033670 k( 24) = ( 0.4107143 -0.0000000 -0.0000000), wk = 0.0033670 k( 25) = ( 0.4285714 -0.0000000 -0.0000000), wk = 0.0033670 k( 26) = ( 0.4464286 -0.0000000 -0.0000000), wk = 0.0033670 k( 27) = ( 0.4642857 0.0000000 -0.0000000), wk = 0.0033670 k( 28) = ( 0.4821429 -0.0000000 -0.0000000), wk = 0.0033670 k( 29) = ( 0.5000000 0.0000000 -0.0000000), wk = 0.0033670 k( 30) = ( 0.5000000 0.0000000 -0.0000000), wk = 0.0033670 k( 31) = ( 0.4901961 0.0196078 -0.0000000), wk = 0.0033670 k( 32) = ( 0.4803922 0.0392157 0.0000000), wk = 0.0033670 k( 33) = ( 0.4705882 0.0588235 -0.0000000), wk = 0.0033670 k( 34) = ( 0.4607843 0.0784314 0.0000000), wk = 0.0033670 k( 35) = ( 0.4509804 0.0980392 -0.0000000), wk = 0.0033670 k( 36) = ( 0.4411765 0.1176471 -0.0000000), wk = 0.0033670 k( 37) = ( 0.4313726 0.1372549 -0.0000000), wk = 0.0033670 k( 38) = ( 0.4215686 0.1568627 -0.0000000), wk = 0.0033670 k( 39) = ( 0.4117647 0.1764706 -0.0000000), wk = 0.0033670 k( 40) = ( 0.4019608 0.1960784 -0.0000000), wk = 0.0033670 k( 41) = ( 0.3921569 0.2156863 -0.0000000), wk = 0.0033670 k( 42) = ( 0.3823529 0.2352941 -0.0000000), wk = 0.0033670 k( 43) = ( 0.3725490 0.2549020 0.0000000), wk = 0.0033670 k( 44) = ( 0.3627451 0.2745098 -0.0000000), wk = 0.0033670 k( 45) = ( 0.3529412 0.2941177 0.0000000), wk = 0.0033670 k( 46) = ( 0.3431373 0.3137255 -0.0000000), wk = 0.0033670 k( 47) = ( 0.3333333 0.3333333 -0.0000000), wk = 0.0033670 k( 48) = ( 0.3333333 0.3333333 -0.0000000), wk = 0.0033670 k( 49) = ( 0.3232323 0.3232323 -0.0000000), wk = 0.0033670 k( 50) = ( 0.3131313 0.3131313 -0.0000000), wk = 0.0033670 k( 51) = ( 0.3030303 0.3030303 0.0000000), wk = 0.0033670 k( 52) = ( 0.2929293 0.2929293 -0.0000000), wk = 0.0033670 k( 53) = ( 0.2828283 0.2828283 -0.0000000), wk = 0.0033670 k( 54) = ( 0.2727273 0.2727273 0.0000000), wk = 0.0033670 k( 55) = ( 0.2626263 0.2626263 -0.0000000), wk = 0.0033670 k( 56) = ( 0.2525252 0.2525252 -0.0000000), wk = 0.0033670 k( 57) = ( 0.2424242 0.2424242 -0.0000000), wk = 0.0033670 k( 58) = ( 0.2323232 0.2323232 -0.0000000), wk = 0.0033670 k( 59) = ( 0.2222222 0.2222222 0.0000000), wk = 0.0033670 k( 60) = ( 0.2121212 0.2121212 -0.0000000), wk = 0.0033670 k( 61) = ( 0.2020202 0.2020202 -0.0000000), wk = 0.0033670 k( 62) = ( 0.1919192 0.1919192 -0.0000000), wk = 0.0033670 k( 63) = ( 0.1818182 0.1818182 -0.0000000), wk = 0.0033670 k( 64) = ( 0.1717172 0.1717172 0.0000000), wk = 0.0033670 k( 65) = ( 0.1616162 0.1616162 -0.0000000), wk = 0.0033670 k( 66) = ( 0.1515151 0.1515151 0.0000000), wk = 0.0033670 k( 67) = ( 0.1414141 0.1414141 -0.0000000), wk = 0.0033670 k( 68) = ( 0.1313131 0.1313131 -0.0000000), wk = 0.0033670 k( 69) = ( 0.1212121 0.1212121 -0.0000000), wk = 0.0033670 k( 70) = ( 0.1111111 0.1111111 0.0000000), wk = 0.0033670 k( 71) = ( 0.1010101 0.1010101 -0.0000000), wk = 0.0033670 k( 72) = ( 0.0909091 0.0909091 -0.0000000), wk = 0.0033670 k( 73) = ( 0.0808081 0.0808081 -0.0000000), wk = 0.0033670 k( 74) = ( 0.0707071 0.0707071 -0.0000000), wk = 0.0033670 k( 75) = ( 0.0606061 0.0606061 -0.0000000), wk = 0.0033670 k( 76) = ( 0.0505051 0.0505050 -0.0000000), wk = 0.0033670 k( 77) = ( 0.0404040 0.0404040 -0.0000000), wk = 0.0033670 k( 78) = ( 0.0303030 0.0303030 -0.0000000), wk = 0.0033670 k( 79) = ( 0.0202020 0.0202020 -0.0000000), wk = 0.0033670 k( 80) = ( 0.0101010 0.0101010 -0.0000000), wk = 0.0033670 k( 81) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0033670 k( 82) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0033670 k( 83) = ( 0.0000000 0.0000000 0.0113636), wk = 0.0033670 k( 84) = ( 0.0000000 0.0000000 0.0227273), wk = 0.0033670 k( 85) = ( 0.0000000 0.0000000 0.0340909), wk = 0.0033670 k( 86) = ( 0.0000000 0.0000000 0.0454546), wk = 0.0033670 k( 87) = ( 0.0000000 0.0000000 0.0568182), wk = 0.0033670 k( 88) = ( 0.0000000 0.0000000 0.0681818), wk = 0.0033670 k( 89) = ( 0.0000000 0.0000000 0.0795455), wk = 0.0033670 k( 90) = ( 0.0000000 0.0000000 0.0909091), wk = 0.0033670 k( 91) = ( 0.0000000 0.0000000 0.1022727), wk = 0.0033670 k( 92) = ( 0.0000000 0.0000000 0.1136364), wk = 0.0033670 k( 93) = ( 0.0000000 0.0000000 0.1250000), wk = 0.0033670 k( 94) = ( 0.0000000 0.0000000 0.1363636), wk = 0.0033670 k( 95) = ( 0.0000000 0.0000000 0.1477273), wk = 0.0033670 k( 96) = ( 0.0000000 0.0000000 0.1590909), wk = 0.0033670 k( 97) = ( 0.0000000 0.0000000 0.1704546), wk = 0.0033670 k( 98) = ( 0.0000000 0.0000000 0.1818182), wk = 0.0033670 k( 99) = ( 0.0000000 0.0000000 0.1931818), wk = 0.0033670 k( 100) = ( 0.0000000 0.0000000 0.2045455), wk = 0.0033670 k( 101) = ( 0.0000000 0.0000000 0.2159091), wk = 0.0033670 k( 102) = ( 0.0000000 0.0000000 0.2272727), wk = 0.0033670 k( 103) = ( 0.0000000 0.0000000 0.2386364), wk = 0.0033670 k( 104) = ( 0.0000000 0.0000000 0.2500000), wk = 0.0033670 k( 105) = ( 0.0000000 0.0000000 0.2613636), wk = 0.0033670 k( 106) = ( 0.0000000 0.0000000 0.2727273), wk = 0.0033670 k( 107) = ( 0.0000000 0.0000000 0.2840909), wk = 0.0033670 k( 108) = ( 0.0000000 0.0000000 0.2954545), wk = 0.0033670 k( 109) = ( 0.0000000 0.0000000 0.3068182), wk = 0.0033670 k( 110) = ( 0.0000000 0.0000000 0.3181818), wk = 0.0033670 k( 111) = ( 0.0000000 0.0000000 0.3295455), wk = 0.0033670 k( 112) = ( 0.0000000 0.0000000 0.3409091), wk = 0.0033670 k( 113) = ( 0.0000000 0.0000000 0.3522727), wk = 0.0033670 k( 114) = ( 0.0000000 0.0000000 0.3636364), wk = 0.0033670 k( 115) = ( 0.0000000 0.0000000 0.3750000), wk = 0.0033670 k( 116) = ( 0.0000000 0.0000000 0.3863636), wk = 0.0033670 k( 117) = ( 0.0000000 0.0000000 0.3977273), wk = 0.0033670 k( 118) = ( 0.0000000 0.0000000 0.4090909), wk = 0.0033670 k( 119) = ( 0.0000000 0.0000000 0.4204545), wk = 0.0033670 k( 120) = ( 0.0000000 0.0000000 0.4318182), wk = 0.0033670 k( 121) = ( 0.0000000 0.0000000 0.4431818), wk = 0.0033670 k( 122) = ( 0.0000000 0.0000000 0.4545455), wk = 0.0033670 k( 123) = ( 0.0000000 0.0000000 0.4659091), wk = 0.0033670 k( 124) = ( 0.0000000 0.0000000 0.4772727), wk = 0.0033670 k( 125) = ( 0.0000000 0.0000000 0.4886364), wk = 0.0033670 k( 126) = ( 0.0000000 0.0000000 0.5000000), wk = 0.0033670 k( 127) = ( 0.0000000 0.0000000 0.5000000), wk = 0.0033670 k( 128) = ( 0.0178571 -0.0000000 0.5000000), wk = 0.0033670 k( 129) = ( 0.0357143 -0.0000000 0.5000000), wk = 0.0033670 k( 130) = ( 0.0535714 -0.0000000 0.5000000), wk = 0.0033670 k( 131) = ( 0.0714286 -0.0000000 0.5000000), wk = 0.0033670 k( 132) = ( 0.0892857 0.0000000 0.5000000), wk = 0.0033670 k( 133) = ( 0.1071429 -0.0000000 0.5000000), wk = 0.0033670 k( 134) = ( 0.1250000 0.0000000 0.5000000), wk = 0.0033670 k( 135) = ( 0.1428571 -0.0000000 0.5000000), wk = 0.0033670 k( 136) = ( 0.1607143 0.0000000 0.5000000), wk = 0.0033670 k( 137) = ( 0.1785714 0.0000000 0.5000000), wk = 0.0033670 k( 138) = ( 0.1964286 -0.0000000 0.5000000), wk = 0.0033670 k( 139) = ( 0.2142857 -0.0000000 0.5000000), wk = 0.0033670 k( 140) = ( 0.2321429 0.0000000 0.5000000), wk = 0.0033670 k( 141) = ( 0.2500000 0.0000000 0.5000000), wk = 0.0033670 k( 142) = ( 0.2678571 -0.0000000 0.5000000), wk = 0.0033670 k( 143) = ( 0.2857143 -0.0000000 0.5000000), wk = 0.0033670 k( 144) = ( 0.3035714 -0.0000000 0.5000000), wk = 0.0033670 k( 145) = ( 0.3214286 -0.0000000 0.5000000), wk = 0.0033670 k( 146) = ( 0.3392857 -0.0000000 0.5000000), wk = 0.0033670 k( 147) = ( 0.3571429 0.0000000 0.5000000), wk = 0.0033670 k( 148) = ( 0.3750000 0.0000000 0.5000000), wk = 0.0033670 k( 149) = ( 0.3928571 -0.0000000 0.5000000), wk = 0.0033670 k( 150) = ( 0.4107143 -0.0000000 0.5000000), wk = 0.0033670 k( 151) = ( 0.4285714 -0.0000000 0.5000000), wk = 0.0033670 k( 152) = ( 0.4464286 -0.0000000 0.5000000), wk = 0.0033670 k( 153) = ( 0.4642857 0.0000000 0.5000000), wk = 0.0033670 k( 154) = ( 0.4821429 -0.0000000 0.5000000), wk = 0.0033670 k( 155) = ( 0.5000000 0.0000000 0.5000000), wk = 0.0033670 k( 156) = ( 0.5000000 0.0000000 0.5000000), wk = 0.0033670 k( 157) = ( 0.4901961 0.0196078 0.5000000), wk = 0.0033670 k( 158) = ( 0.4803922 0.0392157 0.5000000), wk = 0.0033670 k( 159) = ( 0.4705882 0.0588235 0.5000000), wk = 0.0033670 k( 160) = ( 0.4607843 0.0784314 0.5000000), wk = 0.0033670 k( 161) = ( 0.4509804 0.0980392 0.5000000), wk = 0.0033670 k( 162) = ( 0.4411765 0.1176471 0.5000000), wk = 0.0033670 k( 163) = ( 0.4313726 0.1372549 0.5000000), wk = 0.0033670 k( 164) = ( 0.4215686 0.1568627 0.5000000), wk = 0.0033670 k( 165) = ( 0.4117647 0.1764706 0.5000000), wk = 0.0033670 k( 166) = ( 0.4019608 0.1960784 0.5000000), wk = 0.0033670 k( 167) = ( 0.3921569 0.2156863 0.5000000), wk = 0.0033670 k( 168) = ( 0.3823529 0.2352941 0.5000000), wk = 0.0033670 k( 169) = ( 0.3725490 0.2549020 0.5000000), wk = 0.0033670 k( 170) = ( 0.3627451 0.2745098 0.5000000), wk = 0.0033670 k( 171) = ( 0.3529412 0.2941177 0.5000000), wk = 0.0033670 k( 172) = ( 0.3431373 0.3137255 0.5000000), wk = 0.0033670 k( 173) = ( 0.3333333 0.3333333 0.5000000), wk = 0.0033670 k( 174) = ( 0.3333333 0.3333333 0.5000000), wk = 0.0033670 k( 175) = ( 0.3232323 0.3232323 0.5000000), wk = 0.0033670 k( 176) = ( 0.3131313 0.3131313 0.5000000), wk = 0.0033670 k( 177) = ( 0.3030303 0.3030303 0.5000000), wk = 0.0033670 k( 178) = ( 0.2929293 0.2929293 0.5000000), wk = 0.0033670 k( 179) = ( 0.2828283 0.2828283 0.5000000), wk = 0.0033670 k( 180) = ( 0.2727273 0.2727273 0.5000000), wk = 0.0033670 k( 181) = ( 0.2626263 0.2626263 0.5000000), wk = 0.0033670 k( 182) = ( 0.2525252 0.2525252 0.5000000), wk = 0.0033670 k( 183) = ( 0.2424242 0.2424242 0.5000000), wk = 0.0033670 k( 184) = ( 0.2323232 0.2323232 0.5000000), wk = 0.0033670 k( 185) = ( 0.2222222 0.2222222 0.5000000), wk = 0.0033670 k( 186) = ( 0.2121212 0.2121212 0.5000000), wk = 0.0033670 k( 187) = ( 0.2020202 0.2020202 0.5000000), wk = 0.0033670 k( 188) = ( 0.1919192 0.1919192 0.5000000), wk = 0.0033670 k( 189) = ( 0.1818182 0.1818182 0.5000000), wk = 0.0033670 k( 190) = ( 0.1717172 0.1717172 0.5000000), wk = 0.0033670 k( 191) = ( 0.1616162 0.1616162 0.5000000), wk = 0.0033670 k( 192) = ( 0.1515151 0.1515151 0.5000000), wk = 0.0033670 k( 193) = ( 0.1414141 0.1414141 0.5000000), wk = 0.0033670 k( 194) = ( 0.1313131 0.1313131 0.5000000), wk = 0.0033670 k( 195) = ( 0.1212121 0.1212121 0.5000000), wk = 0.0033670 k( 196) = ( 0.1111111 0.1111111 0.5000000), wk = 0.0033670 k( 197) = ( 0.1010101 0.1010101 0.5000000), wk = 0.0033670 k( 198) = ( 0.0909091 0.0909091 0.5000000), wk = 0.0033670 k( 199) = ( 0.0808081 0.0808081 0.5000000), wk = 0.0033670 k( 200) = ( 0.0707071 0.0707071 0.5000000), wk = 0.0033670 k( 201) = ( 0.0606061 0.0606061 0.5000000), wk = 0.0033670 k( 202) = ( 0.0505051 0.0505050 0.5000000), wk = 0.0033670 k( 203) = ( 0.0404040 0.0404040 0.5000000), wk = 0.0033670 k( 204) = ( 0.0303030 0.0303030 0.5000000), wk = 0.0033670 k( 205) = ( 0.0202020 0.0202020 0.5000000), wk = 0.0033670 k( 206) = ( 0.0101010 0.0101010 0.5000000), wk = 0.0033670 k( 207) = ( 0.0000000 0.0000000 0.5000000), wk = 0.0033670 k( 208) = ( 0.5000000 0.0000000 0.5000000), wk = 0.0033670 k( 209) = ( 0.5000000 0.0000000 0.4886364), wk = 0.0033670 k( 210) = ( 0.5000000 0.0000000 0.4772727), wk = 0.0033670 k( 211) = ( 0.5000000 0.0000000 0.4659091), wk = 0.0033670 k( 212) = ( 0.5000000 0.0000000 0.4545455), wk = 0.0033670 k( 213) = ( 0.5000000 0.0000000 0.4431818), wk = 0.0033670 k( 214) = ( 0.5000000 0.0000000 0.4318182), wk = 0.0033670 k( 215) = ( 0.5000000 0.0000000 0.4204545), wk = 0.0033670 k( 216) = ( 0.5000000 0.0000000 0.4090909), wk = 0.0033670 k( 217) = ( 0.5000000 0.0000000 0.3977273), wk = 0.0033670 k( 218) = ( 0.5000000 0.0000000 0.3863636), wk = 0.0033670 k( 219) = ( 0.5000000 0.0000000 0.3750000), wk = 0.0033670 k( 220) = ( 0.5000000 0.0000000 0.3636364), wk = 0.0033670 k( 221) = ( 0.5000000 0.0000000 0.3522727), wk = 0.0033670 k( 222) = ( 0.5000000 0.0000000 0.3409091), wk = 0.0033670 k( 223) = ( 0.5000000 0.0000000 0.3295455), wk = 0.0033670 k( 224) = ( 0.5000000 0.0000000 0.3181818), wk = 0.0033670 k( 225) = ( 0.5000000 0.0000000 0.3068182), wk = 0.0033670 k( 226) = ( 0.5000000 0.0000000 0.2954545), wk = 0.0033670 k( 227) = ( 0.5000000 0.0000000 0.2840909), wk = 0.0033670 k( 228) = ( 0.5000000 0.0000000 0.2727273), wk = 0.0033670 k( 229) = ( 0.5000000 0.0000000 0.2613636), wk = 0.0033670 k( 230) = ( 0.5000000 0.0000000 0.2500000), wk = 0.0033670 k( 231) = ( 0.5000000 0.0000000 0.2386364), wk = 0.0033670 k( 232) = ( 0.5000000 0.0000000 0.2272727), wk = 0.0033670 k( 233) = ( 0.5000000 0.0000000 0.2159091), wk = 0.0033670 k( 234) = ( 0.5000000 0.0000000 0.2045455), wk = 0.0033670 k( 235) = ( 0.5000000 0.0000000 0.1931818), wk = 0.0033670 k( 236) = ( 0.5000000 0.0000000 0.1818182), wk = 0.0033670 k( 237) = ( 0.5000000 0.0000000 0.1704546), wk = 0.0033670 k( 238) = ( 0.5000000 0.0000000 0.1590909), wk = 0.0033670 k( 239) = ( 0.5000000 0.0000000 0.1477273), wk = 0.0033670 k( 240) = ( 0.5000000 0.0000000 0.1363636), wk = 0.0033670 k( 241) = ( 0.5000000 0.0000000 0.1250000), wk = 0.0033670 k( 242) = ( 0.5000000 0.0000000 0.1136364), wk = 0.0033670 k( 243) = ( 0.5000000 0.0000000 0.1022727), wk = 0.0033670 k( 244) = ( 0.5000000 0.0000000 0.0909091), wk = 0.0033670 k( 245) = ( 0.5000000 0.0000000 0.0795455), wk = 0.0033670 k( 246) = ( 0.5000000 0.0000000 0.0681818), wk = 0.0033670 k( 247) = ( 0.5000000 0.0000000 0.0568182), wk = 0.0033670 k( 248) = ( 0.5000000 0.0000000 0.0454546), wk = 0.0033670 k( 249) = ( 0.5000000 0.0000000 0.0340909), wk = 0.0033670 k( 250) = ( 0.5000000 0.0000000 0.0227273), wk = 0.0033670 k( 251) = ( 0.5000000 0.0000000 0.0113636), wk = 0.0033670 k( 252) = ( 0.5000000 0.0000000 -0.0000000), wk = 0.0033670 k( 253) = ( 0.3333333 0.3333333 -0.0000000), wk = 0.0033670 k( 254) = ( 0.3333333 0.3333333 0.0113636), wk = 0.0033670 k( 255) = ( 0.3333333 0.3333333 0.0227273), wk = 0.0033670 k( 256) = ( 0.3333333 0.3333333 0.0340909), wk = 0.0033670 k( 257) = ( 0.3333333 0.3333333 0.0454546), wk = 0.0033670 k( 258) = ( 0.3333333 0.3333333 0.0568182), wk = 0.0033670 k( 259) = ( 0.3333333 0.3333333 0.0681818), wk = 0.0033670 k( 260) = ( 0.3333333 0.3333333 0.0795455), wk = 0.0033670 k( 261) = ( 0.3333333 0.3333333 0.0909091), wk = 0.0033670 k( 262) = ( 0.3333333 0.3333333 0.1022727), wk = 0.0033670 k( 263) = ( 0.3333333 0.3333333 0.1136364), wk = 0.0033670 k( 264) = ( 0.3333333 0.3333333 0.1250000), wk = 0.0033670 k( 265) = ( 0.3333333 0.3333333 0.1363636), wk = 0.0033670 k( 266) = ( 0.3333333 0.3333333 0.1477273), wk = 0.0033670 k( 267) = ( 0.3333333 0.3333333 0.1590909), wk = 0.0033670 k( 268) = ( 0.3333333 0.3333333 0.1704546), wk = 0.0033670 k( 269) = ( 0.3333333 0.3333333 0.1818182), wk = 0.0033670 k( 270) = ( 0.3333333 0.3333333 0.1931818), wk = 0.0033670 k( 271) = ( 0.3333333 0.3333333 0.2045454), wk = 0.0033670 k( 272) = ( 0.3333333 0.3333333 0.2159091), wk = 0.0033670 k( 273) = ( 0.3333333 0.3333333 0.2272727), wk = 0.0033670 k( 274) = ( 0.3333333 0.3333333 0.2386364), wk = 0.0033670 k( 275) = ( 0.3333333 0.3333333 0.2500000), wk = 0.0033670 k( 276) = ( 0.3333333 0.3333333 0.2613636), wk = 0.0033670 k( 277) = ( 0.3333333 0.3333333 0.2727273), wk = 0.0033670 k( 278) = ( 0.3333333 0.3333333 0.2840909), wk = 0.0033670 k( 279) = ( 0.3333333 0.3333333 0.2954545), wk = 0.0033670 k( 280) = ( 0.3333333 0.3333333 0.3068182), wk = 0.0033670 k( 281) = ( 0.3333333 0.3333333 0.3181818), wk = 0.0033670 k( 282) = ( 0.3333333 0.3333333 0.3295455), wk = 0.0033670 k( 283) = ( 0.3333333 0.3333333 0.3409091), wk = 0.0033670 k( 284) = ( 0.3333333 0.3333333 0.3522727), wk = 0.0033670 k( 285) = ( 0.3333333 0.3333333 0.3636364), wk = 0.0033670 k( 286) = ( 0.3333333 0.3333333 0.3750000), wk = 0.0033670 k( 287) = ( 0.3333333 0.3333333 0.3863636), wk = 0.0033670 k( 288) = ( 0.3333333 0.3333333 0.3977273), wk = 0.0033670 k( 289) = ( 0.3333333 0.3333333 0.4090909), wk = 0.0033670 k( 290) = ( 0.3333333 0.3333333 0.4204545), wk = 0.0033670 k( 291) = ( 0.3333333 0.3333333 0.4318182), wk = 0.0033670 k( 292) = ( 0.3333333 0.3333333 0.4431818), wk = 0.0033670 k( 293) = ( 0.3333333 0.3333333 0.4545455), wk = 0.0033670 k( 294) = ( 0.3333333 0.3333333 0.4659091), wk = 0.0033670 k( 295) = ( 0.3333333 0.3333333 0.4772727), wk = 0.0033670 k( 296) = ( 0.3333333 0.3333333 0.4886364), wk = 0.0033670 k( 297) = ( 0.3333333 0.3333333 0.5000000), wk = 0.0033670 Dense grid: 136371 G-vectors FFT dimensions: ( 81, 81, 45) Smooth grid: 35339 G-vectors FFT dimensions: ( 54, 54, 30) Largest allocated arrays est. size (Mb) dimensions Kohn-Sham Wavefunctions 0.19 Mb ( 142, 86) NL pseudopotentials 0.33 Mb ( 71, 306) Each V/rho on FFT grid 0.10 Mb ( 6561) Each G-vector array 0.01 Mb ( 1893) G-vector shells 0.01 Mb ( 884) Largest temporary arrays est. size (Mb) dimensions Auxiliary wavefunctions 0.75 Mb ( 142, 344) Each subspace H/S matrix 0.05 Mb ( 57, 57) Each matrix 0.80 Mb ( 306, 2, 86) The potential is recalculated from file : ./SiPt2.save/charge-density.dat Starting wfc are 132 randomized atomic wfcs Band Structure Calculation Davidson diagonalization with overlap Computing kpt #: 1 total cpu time spent up to now is 6.5 secs Computing kpt #: 2 total cpu time spent up to now is 10.1 secs Computing kpt #: 3 total cpu time spent up to now is 13.6 secs Computing kpt #: 4 total cpu time spent up to now is 17.0 secs Computing kpt #: 5 total cpu time spent up to now is 20.3 secs Computing kpt #: 6 total cpu time spent up to now is 23.5 secs Computing kpt #: 7 total cpu time spent up to now is 26.8 secs Computing kpt #: 8 total cpu time spent up to now is 31.0 secs Computing kpt #: 9 total cpu time spent up to now is 34.7 secs Computing kpt #: 10 total cpu time spent up to now is 39.2 secs Computing kpt #: 11 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 43.7 secs Computing kpt #: 12 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 48.3 secs Computing kpt #: 13 total cpu time spent up to now is 52.3 secs Computing kpt #: 14 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 56.9 secs Computing kpt #: 15 total cpu time spent up to now is 60.3 secs Computing kpt #: 16 total cpu time spent up to now is 64.0 secs Computing kpt #: 17 total cpu time spent up to now is 67.2 secs Computing kpt #: 18 total cpu time spent up to now is 70.4 secs Computing kpt #: 19 total cpu time spent up to now is 73.2 secs Computing kpt #: 20 total cpu time spent up to now is 75.9 secs Computing kpt #: 21 total cpu time spent up to now is 78.5 secs Computing kpt #: 22 total cpu time spent up to now is 81.2 secs Computing kpt #: 23 total cpu time spent up to now is 84.6 secs Computing kpt #: 24 total cpu time spent up to now is 88.7 secs Computing kpt #: 25 total cpu time spent up to now is 92.2 secs Computing kpt #: 26 total cpu time spent up to now is 94.9 secs Computing kpt #: 27 total cpu time spent up to now is 97.5 secs Computing kpt #: 28 total cpu time spent up to now is 99.7 secs Computing kpt #: 29 total cpu time spent up to now is 102.0 secs Computing kpt #: 30 total cpu time spent up to now is 104.2 secs Computing kpt #: 31 total cpu time spent up to now is 106.6 secs Computing kpt #: 32 total cpu time spent up to now is 109.2 secs Computing kpt #: 33 total cpu time spent up to now is 112.1 secs Computing kpt #: 34 total cpu time spent up to now is 115.5 secs Computing kpt #: 35 total cpu time spent up to now is 119.7 secs Computing kpt #: 36 total cpu time spent up to now is 123.7 secs Computing kpt #: 37 total cpu time spent up to now is 127.3 secs Computing kpt #: 38 total cpu time spent up to now is 130.1 secs Computing kpt #: 39 total cpu time spent up to now is 132.7 secs Computing kpt #: 40 total cpu time spent up to now is 135.0 secs Computing kpt #: 41 total cpu time spent up to now is 137.3 secs Computing kpt #: 42 total cpu time spent up to now is 139.7 secs Computing kpt #: 43 total cpu time spent up to now is 142.1 secs Computing kpt #: 44 total cpu time spent up to now is 144.6 secs Computing kpt #: 45 total cpu time spent up to now is 147.2 secs Computing kpt #: 46 total cpu time spent up to now is 149.7 secs Computing kpt #: 47 total cpu time spent up to now is 152.2 secs Computing kpt #: 48 total cpu time spent up to now is 154.8 secs Computing kpt #: 49 total cpu time spent up to now is 157.3 secs Computing kpt #: 50 total cpu time spent up to now is 159.8 secs Computing kpt #: 51 total cpu time spent up to now is 162.4 secs Computing kpt #: 52 total cpu time spent up to now is 165.0 secs Computing kpt #: 53 total cpu time spent up to now is 167.7 secs Computing kpt #: 54 total cpu time spent up to now is 170.1 secs Computing kpt #: 55 total cpu time spent up to now is 172.4 secs Computing kpt #: 56 total cpu time spent up to now is 174.7 secs Computing kpt #: 57 total cpu time spent up to now is 177.0 secs Computing kpt #: 58 total cpu time spent up to now is 179.4 secs Computing kpt #: 59 total cpu time spent up to now is 181.7 secs Computing kpt #: 60 total cpu time spent up to now is 183.9 secs Computing kpt #: 61 total cpu time spent up to now is 186.1 secs Computing kpt #: 62 total cpu time spent up to now is 188.2 secs Computing kpt #: 63 total cpu time spent up to now is 190.3 secs Computing kpt #: 64 total cpu time spent up to now is 192.5 secs Computing kpt #: 65 total cpu time spent up to now is 194.8 secs Computing kpt #: 66 total cpu time spent up to now is 197.1 secs Computing kpt #: 67 total cpu time spent up to now is 199.7 secs Computing kpt #: 68 total cpu time spent up to now is 202.4 secs Computing kpt #: 69 total cpu time spent up to now is 205.2 secs Computing kpt #: 70 total cpu time spent up to now is 209.6 secs Computing kpt #: 71 total cpu time spent up to now is 213.1 secs Computing kpt #: 72 total cpu time spent up to now is 217.0 secs Computing kpt #: 73 total cpu time spent up to now is 220.5 secs Computing kpt #: 74 total cpu time spent up to now is 223.8 secs Computing kpt #: 75 total cpu time spent up to now is 227.1 secs Computing kpt #: 76 total cpu time spent up to now is 230.4 secs Computing kpt #: 77 total cpu time spent up to now is 233.7 secs Computing kpt #: 78 total cpu time spent up to now is 237.1 secs Computing kpt #: 79 total cpu time spent up to now is 240.5 secs Computing kpt #: 80 total cpu time spent up to now is 243.9 secs Computing kpt #: 81 total cpu time spent up to now is 247.1 secs Computing kpt #: 82 total cpu time spent up to now is 250.6 secs Computing kpt #: 83 total cpu time spent up to now is 254.0 secs Computing kpt #: 84 total cpu time spent up to now is 256.7 secs Computing kpt #: 85 total cpu time spent up to now is 259.1 secs Computing kpt #: 86 total cpu time spent up to now is 261.4 secs Computing kpt #: 87 total cpu time spent up to now is 263.5 secs Computing kpt #: 88 total cpu time spent up to now is 265.5 secs Computing kpt #: 89 total cpu time spent up to now is 267.6 secs Computing kpt #: 90 total cpu time spent up to now is 269.7 secs Computing kpt #: 91 total cpu time spent up to now is 271.8 secs Computing kpt #: 92 total cpu time spent up to now is 273.9 secs Computing kpt #: 93 total cpu time spent up to now is 275.9 secs Computing kpt #: 94 total cpu time spent up to now is 278.0 secs Computing kpt #: 95 total cpu time spent up to now is 280.1 secs Computing kpt #: 96 total cpu time spent up to now is 282.6 secs Computing kpt #: 97 total cpu time spent up to now is 287.0 secs Computing kpt #: 98 total cpu time spent up to now is 290.3 secs Computing kpt #: 99 total cpu time spent up to now is 293.3 secs Computing kpt #: 100 total cpu time spent up to now is 297.7 secs Computing kpt #: 101 total cpu time spent up to now is 301.0 secs Computing kpt #: 102 total cpu time spent up to now is 303.7 secs Computing kpt #: 103 total cpu time spent up to now is 306.5 secs Computing kpt #: 104 total cpu time spent up to now is 309.7 secs Computing kpt #: 105 total cpu time spent up to now is 312.7 secs Computing kpt #: 106 total cpu time spent up to now is 315.4 secs Computing kpt #: 107 total cpu time spent up to now is 318.0 secs Computing kpt #: 108 total cpu time spent up to now is 320.6 secs Computing kpt #: 109 total cpu time spent up to now is 323.2 secs Computing kpt #: 110 total cpu time spent up to now is 325.8 secs Computing kpt #: 111 total cpu time spent up to now is 328.4 secs Computing kpt #: 112 total cpu time spent up to now is 331.0 secs Computing kpt #: 113 total cpu time spent up to now is 333.6 secs Computing kpt #: 114 total cpu time spent up to now is 336.0 secs Computing kpt #: 115 total cpu time spent up to now is 338.5 secs Computing kpt #: 116 total cpu time spent up to now is 340.9 secs Computing kpt #: 117 total cpu time spent up to now is 343.4 secs Computing kpt #: 118 total cpu time spent up to now is 345.8 secs Computing kpt #: 119 total cpu time spent up to now is 348.2 secs Computing kpt #: 120 total cpu time spent up to now is 350.7 secs Computing kpt #: 121 total cpu time spent up to now is 353.1 secs Computing kpt #: 122 total cpu time spent up to now is 355.6 secs Computing kpt #: 123 total cpu time spent up to now is 358.0 secs Computing kpt #: 124 total cpu time spent up to now is 360.6 secs Computing kpt #: 125 total cpu time spent up to now is 363.2 secs Computing kpt #: 126 total cpu time spent up to now is 365.7 secs Computing kpt #: 127 total cpu time spent up to now is 368.6 secs Computing kpt #: 128 total cpu time spent up to now is 371.0 secs Computing kpt #: 129 total cpu time spent up to now is 373.4 secs Computing kpt #: 130 total cpu time spent up to now is 375.8 secs Computing kpt #: 131 total cpu time spent up to now is 378.4 secs Computing kpt #: 132 total cpu time spent up to now is 380.9 secs Computing kpt #: 133 total cpu time spent up to now is 383.4 secs Computing kpt #: 134 total cpu time spent up to now is 385.9 secs Computing kpt #: 135 total cpu time spent up to now is 388.4 secs Computing kpt #: 136 total cpu time spent up to now is 390.8 secs Computing kpt #: 137 total cpu time spent up to now is 393.3 secs Computing kpt #: 138 total cpu time spent up to now is 395.7 secs Computing kpt #: 139 total cpu time spent up to now is 398.1 secs Computing kpt #: 140 total cpu time spent up to now is 400.4 secs Computing kpt #: 141 total cpu time spent up to now is 402.8 secs Computing kpt #: 142 total cpu time spent up to now is 405.1 secs Computing kpt #: 143 total cpu time spent up to now is 407.4 secs Computing kpt #: 144 total cpu time spent up to now is 409.8 secs Computing kpt #: 145 total cpu time spent up to now is 412.4 secs Computing kpt #: 146 total cpu time spent up to now is 415.1 secs Computing kpt #: 147 total cpu time spent up to now is 417.8 secs Computing kpt #: 148 total cpu time spent up to now is 420.7 secs Computing kpt #: 149 total cpu time spent up to now is 423.2 secs Computing kpt #: 150 total cpu time spent up to now is 425.6 secs Computing kpt #: 151 total cpu time spent up to now is 428.2 secs Computing kpt #: 152 total cpu time spent up to now is 430.8 secs Computing kpt #: 153 total cpu time spent up to now is 433.4 secs Computing kpt #: 154 total cpu time spent up to now is 436.1 secs Computing kpt #: 155 total cpu time spent up to now is 438.7 secs Computing kpt #: 156 total cpu time spent up to now is 441.5 secs Computing kpt #: 157 total cpu time spent up to now is 444.1 secs Computing kpt #: 158 total cpu time spent up to now is 446.7 secs Computing kpt #: 159 total cpu time spent up to now is 449.3 secs Computing kpt #: 160 total cpu time spent up to now is 451.6 secs Computing kpt #: 161 total cpu time spent up to now is 453.9 secs Computing kpt #: 162 total cpu time spent up to now is 456.2 secs Computing kpt #: 163 total cpu time spent up to now is 458.8 secs Computing kpt #: 164 total cpu time spent up to now is 461.3 secs Computing kpt #: 165 total cpu time spent up to now is 463.9 secs Computing kpt #: 166 total cpu time spent up to now is 466.5 secs Computing kpt #: 167 total cpu time spent up to now is 469.3 secs Computing kpt #: 168 total cpu time spent up to now is 472.1 secs Computing kpt #: 169 total cpu time spent up to now is 475.2 secs Computing kpt #: 170 total cpu time spent up to now is 478.8 secs Computing kpt #: 171 total cpu time spent up to now is 483.0 secs Computing kpt #: 172 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 487.6 secs Computing kpt #: 173 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 492.2 secs Computing kpt #: 174 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 496.8 secs Computing kpt #: 175 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 501.4 secs Computing kpt #: 176 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 506.0 secs Computing kpt #: 177 total cpu time spent up to now is 510.0 secs Computing kpt #: 178 total cpu time spent up to now is 513.7 secs Computing kpt #: 179 total cpu time spent up to now is 517.0 secs Computing kpt #: 180 total cpu time spent up to now is 520.1 secs Computing kpt #: 181 total cpu time spent up to now is 522.9 secs Computing kpt #: 182 total cpu time spent up to now is 525.8 secs Computing kpt #: 183 total cpu time spent up to now is 528.6 secs Computing kpt #: 184 total cpu time spent up to now is 531.2 secs Computing kpt #: 185 total cpu time spent up to now is 533.9 secs Computing kpt #: 186 total cpu time spent up to now is 536.6 secs Computing kpt #: 187 total cpu time spent up to now is 539.3 secs Computing kpt #: 188 total cpu time spent up to now is 541.9 secs Computing kpt #: 189 total cpu time spent up to now is 544.7 secs Computing kpt #: 190 total cpu time spent up to now is 547.4 secs Computing kpt #: 191 total cpu time spent up to now is 550.2 secs Computing kpt #: 192 total cpu time spent up to now is 552.9 secs Computing kpt #: 193 total cpu time spent up to now is 555.5 secs Computing kpt #: 194 total cpu time spent up to now is 558.2 secs Computing kpt #: 195 total cpu time spent up to now is 560.8 secs Computing kpt #: 196 total cpu time spent up to now is 563.4 secs Computing kpt #: 197 total cpu time spent up to now is 565.9 secs Computing kpt #: 198 total cpu time spent up to now is 568.4 secs Computing kpt #: 199 total cpu time spent up to now is 570.9 secs Computing kpt #: 200 total cpu time spent up to now is 573.4 secs Computing kpt #: 201 total cpu time spent up to now is 575.9 secs Computing kpt #: 202 total cpu time spent up to now is 578.5 secs Computing kpt #: 203 total cpu time spent up to now is 581.0 secs Computing kpt #: 204 total cpu time spent up to now is 583.6 secs Computing kpt #: 205 total cpu time spent up to now is 586.1 secs Computing kpt #: 206 total cpu time spent up to now is 588.7 secs Computing kpt #: 207 total cpu time spent up to now is 591.2 secs Computing kpt #: 208 total cpu time spent up to now is 593.8 secs Computing kpt #: 209 total cpu time spent up to now is 596.4 secs Computing kpt #: 210 total cpu time spent up to now is 598.9 secs Computing kpt #: 211 total cpu time spent up to now is 601.5 secs Computing kpt #: 212 total cpu time spent up to now is 604.0 secs Computing kpt #: 213 total cpu time spent up to now is 606.7 secs Computing kpt #: 214 total cpu time spent up to now is 609.0 secs Computing kpt #: 215 total cpu time spent up to now is 611.3 secs Computing kpt #: 216 total cpu time spent up to now is 613.5 secs Computing kpt #: 217 total cpu time spent up to now is 616.0 secs Computing kpt #: 218 total cpu time spent up to now is 618.7 secs Computing kpt #: 219 total cpu time spent up to now is 621.3 secs Computing kpt #: 220 total cpu time spent up to now is 623.6 secs Computing kpt #: 221 total cpu time spent up to now is 625.9 secs Computing kpt #: 222 total cpu time spent up to now is 628.1 secs Computing kpt #: 223 total cpu time spent up to now is 630.2 secs Computing kpt #: 224 total cpu time spent up to now is 632.3 secs Computing kpt #: 225 total cpu time spent up to now is 634.4 secs Computing kpt #: 226 total cpu time spent up to now is 636.5 secs Computing kpt #: 227 total cpu time spent up to now is 638.5 secs Computing kpt #: 228 total cpu time spent up to now is 640.5 secs Computing kpt #: 229 total cpu time spent up to now is 642.5 secs Computing kpt #: 230 total cpu time spent up to now is 644.3 secs Computing kpt #: 231 total cpu time spent up to now is 646.0 secs Computing kpt #: 232 total cpu time spent up to now is 647.7 secs Computing kpt #: 233 total cpu time spent up to now is 649.5 secs Computing kpt #: 234 total cpu time spent up to now is 651.4 secs Computing kpt #: 235 total cpu time spent up to now is 653.4 secs Computing kpt #: 236 total cpu time spent up to now is 655.3 secs Computing kpt #: 237 total cpu time spent up to now is 657.3 secs Computing kpt #: 238 total cpu time spent up to now is 659.3 secs Computing kpt #: 239 total cpu time spent up to now is 661.3 secs Computing kpt #: 240 total cpu time spent up to now is 663.3 secs Computing kpt #: 241 total cpu time spent up to now is 665.2 secs Computing kpt #: 242 total cpu time spent up to now is 667.2 secs Computing kpt #: 243 total cpu time spent up to now is 669.1 secs Computing kpt #: 244 total cpu time spent up to now is 671.0 secs Computing kpt #: 245 total cpu time spent up to now is 672.9 secs Computing kpt #: 246 total cpu time spent up to now is 674.8 secs Computing kpt #: 247 total cpu time spent up to now is 676.7 secs Computing kpt #: 248 total cpu time spent up to now is 678.7 secs Computing kpt #: 249 total cpu time spent up to now is 680.7 secs Computing kpt #: 250 total cpu time spent up to now is 682.9 secs Computing kpt #: 251 total cpu time spent up to now is 685.1 secs Computing kpt #: 252 total cpu time spent up to now is 687.3 secs Computing kpt #: 253 total cpu time spent up to now is 689.8 secs Computing kpt #: 254 total cpu time spent up to now is 692.4 secs Computing kpt #: 255 total cpu time spent up to now is 695.0 secs Computing kpt #: 256 total cpu time spent up to now is 697.8 secs Computing kpt #: 257 total cpu time spent up to now is 700.6 secs Computing kpt #: 258 total cpu time spent up to now is 703.3 secs Computing kpt #: 259 total cpu time spent up to now is 706.1 secs Computing kpt #: 260 total cpu time spent up to now is 708.8 secs Computing kpt #: 261 total cpu time spent up to now is 711.4 secs Computing kpt #: 262 total cpu time spent up to now is 714.3 secs Computing kpt #: 263 total cpu time spent up to now is 717.1 secs Computing kpt #: 264 total cpu time spent up to now is 720.4 secs Computing kpt #: 265 total cpu time spent up to now is 723.2 secs Computing kpt #: 266 total cpu time spent up to now is 726.1 secs Computing kpt #: 267 total cpu time spent up to now is 729.9 secs Computing kpt #: 268 total cpu time spent up to now is 732.8 secs Computing kpt #: 269 total cpu time spent up to now is 735.9 secs Computing kpt #: 270 total cpu time spent up to now is 739.2 secs Computing kpt #: 271 total cpu time spent up to now is 742.0 secs Computing kpt #: 272 total cpu time spent up to now is 745.2 secs Computing kpt #: 273 total cpu time spent up to now is 747.9 secs Computing kpt #: 274 total cpu time spent up to now is 750.6 secs Computing kpt #: 275 total cpu time spent up to now is 753.1 secs Computing kpt #: 276 total cpu time spent up to now is 755.5 secs Computing kpt #: 277 total cpu time spent up to now is 757.9 secs Computing kpt #: 278 total cpu time spent up to now is 760.3 secs Computing kpt #: 279 total cpu time spent up to now is 762.8 secs Computing kpt #: 280 total cpu time spent up to now is 765.3 secs Computing kpt #: 281 total cpu time spent up to now is 768.0 secs Computing kpt #: 282 total cpu time spent up to now is 770.8 secs Computing kpt #: 283 total cpu time spent up to now is 773.6 secs Computing kpt #: 284 total cpu time spent up to now is 776.9 secs Computing kpt #: 285 total cpu time spent up to now is 779.8 secs Computing kpt #: 286 total cpu time spent up to now is 783.8 secs Computing kpt #: 287 total cpu time spent up to now is 787.8 secs Computing kpt #: 288 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 792.4 secs Computing kpt #: 289 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 797.0 secs Computing kpt #: 290 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 801.6 secs Computing kpt #: 291 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 806.2 secs Computing kpt #: 292 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 810.8 secs Computing kpt #: 293 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 815.4 secs Computing kpt #: 294 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 819.9 secs Computing kpt #: 295 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 824.5 secs Computing kpt #: 296 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 829.1 secs Computing kpt #: 297 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 833.7 secs ethr = 1.39E-08, avg # of iterations = 51.7 total cpu time spent up to now is 833.7 secs End of band structure calculation k = 0.0000 0.0000 0.0000 ( 4413 PWs) bands (ev): 3.3315 3.3315 5.7701 5.7701 6.7117 6.7117 8.4674 8.4674 8.6713 8.6713 8.8080 8.8080 8.8460 8.8460 9.1887 9.1887 9.4622 9.4622 10.0598 10.0598 10.0935 10.0935 10.2823 10.2823 10.7715 10.7715 10.8322 10.8322 10.9379 10.9379 11.0582 11.0582 11.2744 11.2744 11.4028 11.4028 11.4876 11.4876 11.7162 11.7162 11.7710 11.7710 12.5621 12.5621 12.6371 12.6371 12.9355 12.9355 13.0166 13.0166 13.1618 13.1618 13.4771 13.4771 13.6944 13.6944 13.9339 13.9339 14.1893 14.1893 14.2374 14.2374 14.3582 14.3582 14.4386 14.4386 14.6192 14.6192 14.6732 14.6732 14.8988 14.8988 15.2014 15.2014 15.5580 15.5580 18.9808 18.9808 20.2278 20.2278 20.3454 20.3454 20.7804 20.7804 21.3519 21.3519 k = 0.0179 0.0103-0.0000 ( 4401 PWs) bands (ev): 3.3331 3.3331 5.7692 5.7692 6.7085 6.7085 8.4630 8.4631 8.6590 8.6593 8.8083 8.8091 8.8590 8.8596 9.1894 9.1894 9.4633 9.4633 10.0604 10.0604 10.0944 10.0944 10.2825 10.2825 10.7696 10.7697 10.8326 10.8326 10.9402 10.9403 11.0585 11.0586 11.2744 11.2745 11.4033 11.4034 11.4880 11.4881 11.7167 11.7167 11.7737 11.7737 12.5603 12.5605 12.6399 12.6399 12.9340 12.9340 13.0176 13.0177 13.1597 13.1598 13.4757 13.4758 13.6962 13.6963 13.9341 13.9342 14.1868 14.1868 14.2379 14.2382 14.3564 14.3578 14.4386 14.4399 14.6120 14.6140 14.6658 14.6683 14.9028 14.9038 15.2053 15.2055 15.5710 15.5710 18.9807 18.9808 20.2148 20.2149 20.3424 20.3430 20.7797 20.7798 21.3360 21.3373 k = 0.0357 0.0206-0.0000 ( 4397 PWs) bands (ev): 3.3380 3.3380 5.7664 5.7664 6.6988 6.6988 8.4501 8.4507 8.6282 8.6299 8.8130 8.8159 8.8881 8.8898 9.1915 9.1915 9.4665 9.4666 10.0620 10.0623 10.0968 10.0971 10.2831 10.2831 10.7643 10.7644 10.8337 10.8339 10.9467 10.9474 11.0595 11.0601 11.2744 11.2750 11.4048 11.4051 11.4891 11.4897 11.7184 11.7187 11.7812 11.7816 12.5553 12.5567 12.6475 12.6475 12.9295 12.9296 13.0204 13.0205 13.1532 13.1541 13.4716 13.4721 13.7015 13.7020 13.9344 13.9346 14.1802 14.1804 14.2379 14.2400 14.3490 14.3585 14.4360 14.4454 14.5901 14.6025 14.6437 14.6589 14.9106 14.9170 15.2179 15.2195 15.6081 15.6081 18.9802 18.9806 20.1793 20.1794 20.3305 20.3340 20.7778 20.7779 21.2943 21.3024 k = 0.0536 0.0309-0.0000 ( 4397 PWs) bands (ev): 3.3461 3.3461 5.7616 5.7617 6.6829 6.6830 8.4293 8.4309 8.5891 8.5923 8.8236 8.8274 8.9232 8.9253 9.1950 9.1951 9.4717 9.4719 10.0644 10.0654 10.1007 10.1016 10.2842 10.2843 10.7564 10.7566 10.8346 10.8351 10.9564 10.9584 11.0614 11.0632 11.2743 11.2763 11.4068 11.4078 11.4910 11.4931 11.7217 11.7230 11.7928 11.7938 12.5479 12.5520 12.6586 12.6589 12.9223 12.9227 13.0241 13.0247 13.1424 13.1452 13.4653 13.4667 13.7099 13.7115 13.9339 13.9346 14.1711 14.1717 14.2354 14.2415 14.3346 14.3610 14.4277 14.4537 14.5604 14.5897 14.6134 14.6484 14.9171 14.9326 15.2410 15.2449 15.6649 15.6650 18.9785 18.9797 20.1251 20.1281 20.3063 20.3145 20.7746 20.7750 21.2387 21.2598 k = 0.0714 0.0412-0.0000 ( 4397 PWs) bands (ev): 3.3575 3.3575 5.7549 5.7550 6.6610 6.6613 8.4020 8.4046 8.5478 8.5518 8.8385 8.8412 8.9606 8.9615 9.1999 9.2003 9.4786 9.4789 10.0675 10.0698 10.1057 10.1078 10.2861 10.2861 10.7467 10.7470 10.8349 10.8359 10.9681 10.9721 11.0646 11.0685 11.2739 11.2787 11.4090 11.4111 11.4941 11.4988 11.7269 11.7307 11.8079 11.8096 12.5389 12.5476 12.6720 12.6733 12.9123 12.9137 13.0274 13.0295 13.1279 13.1340 13.4572 13.4603 13.7210 13.7248 13.9316 13.9331 14.1609 14.1618 14.2297 14.2418 14.3144 14.3598 14.4169 14.4562 14.5361 14.5645 14.5963 14.6380 14.9209 14.9467 15.2752 15.2814 15.7371 15.7373 18.9744 18.9774 20.0555 20.0670 20.2698 20.2815 20.7704 20.7711 21.1784 21.2168 k = 0.0893 0.0515-0.0000 ( 4399 PWs) bands (ev): 3.3721 3.3721 5.7461 5.7464 6.6335 6.6340 8.3692 8.3723 8.5075 8.5111 8.8552 8.8556 8.9965 8.9988 9.2059 9.2076 9.4869 9.4873 10.0708 10.0755 10.1116 10.1158 10.2888 10.2889 10.7357 10.7361 10.8339 10.8357 10.9805 10.9871 11.0701 11.0763 11.2733 11.2825 11.4113 11.4148 11.4988 11.5076 11.7342 11.7425 11.8263 11.8281 12.5289 12.5441 12.6868 12.6903 12.8994 12.9030 13.0278 13.0337 13.1116 13.1220 13.4480 13.4536 13.7344 13.7416 13.9265 13.9288 14.1503 14.1507 14.2209 14.2407 14.2907 14.3429 14.4151 14.4383 14.5267 14.5331 14.5983 14.6303 14.9228 14.9585 15.3191 15.3267 15.8208 15.8214 18.9663 18.9725 19.9724 20.0007 20.2240 20.2341 20.7651 20.7663 21.1194 21.1768 k = 0.1071 0.0619-0.0000 ( 4397 PWs) bands (ev): 3.3898 3.3898 5.7351 5.7356 6.6009 6.6016 8.3322 8.3348 8.4701 8.4717 8.8681 8.8733 9.0295 9.0376 9.2129 9.2177 9.4964 9.4966 10.0743 10.0824 10.1181 10.1251 10.2924 10.2927 10.7238 10.7244 10.8316 10.8345 10.9925 11.0018 11.0787 11.0868 11.2725 11.2878 11.4137 11.4186 11.5054 11.5200 11.7436 11.7585 11.8476 11.8487 12.5181 12.5418 12.7023 12.7096 12.8834 12.8910 13.0207 13.0347 13.0978 13.1121 13.4382 13.4470 13.7495 13.7615 13.9179 13.9205 14.1374 14.1397 14.2099 14.2387 14.2665 14.3117 14.4041 14.4203 14.4920 14.5458 14.6088 14.6285 14.9245 14.9689 15.3705 15.3785 15.9135 15.9144 18.9519 18.9632 19.8773 19.9321 20.1734 20.1741 20.7583 20.7604 21.0646 21.1406 k = 0.1250 0.0722-0.0000 ( 4405 PWs) bands (ev): 3.4107 3.4108 5.7217 5.7225 6.5637 6.5648 8.2921 8.2934 8.4345 8.4359 8.8787 8.8897 9.0598 9.0770 9.2207 9.2316 9.5065 9.5068 10.0776 10.0903 10.1247 10.1355 10.2971 10.2976 10.7110 10.7118 10.8280 10.8325 11.0036 11.0153 11.0906 11.0995 11.2719 11.2945 11.4162 11.4229 11.5140 11.5366 11.7549 11.7788 11.8708 11.8716 12.5067 12.5409 12.7180 12.7309 12.8644 12.8779 13.0014 13.0291 13.0915 13.1082 13.4281 13.4407 13.7654 13.7840 13.9053 13.9074 14.1212 14.1291 14.1969 14.2366 14.2445 14.2761 14.3645 14.4121 14.4765 14.5606 14.6248 14.6358 14.9271 14.9794 15.4272 15.4350 16.0132 16.0146 18.9287 18.9476 19.7717 19.8617 20.1066 20.1233 20.7495 20.7529 21.0148 21.1077 k = 0.1429 0.0825-0.0000 ( 4407 PWs) bands (ev): 3.4347 3.4348 5.7059 5.7070 6.5225 6.5242 8.2496 8.2499 8.4001 8.4049 8.8864 8.9034 9.0869 9.1169 9.2291 9.2505 9.5167 9.5181 10.0808 10.0989 10.1312 10.1462 10.3026 10.3038 10.6973 10.6982 10.8236 10.8300 11.0134 11.0277 11.1046 11.1139 11.2718 11.3021 11.4192 11.4282 11.5247 11.5577 11.7682 11.8027 11.8940 11.8980 12.4950 12.5415 12.7329 12.7535 12.8430 12.8641 12.9715 13.0159 13.0918 13.1117 13.4178 13.4346 13.7811 13.8082 13.8887 13.8892 14.1027 14.1172 14.1819 14.2249 14.2364 14.2432 14.3241 14.3838 14.4842 14.5718 14.6455 14.6530 14.9321 14.9909 15.4878 15.4950 16.1185 16.1204 18.8947 18.9235 19.6573 19.7865 20.0411 20.0788 20.7373 20.7426 20.9693 21.0767 k = 0.1607 0.0928-0.0000 ( 4399 PWs) bands (ev): 3.4618 3.4619 5.6873 5.6888 6.4782 6.4804 8.2046 8.2066 8.3686 8.3769 8.8906 8.9133 9.1103 9.1570 9.2382 9.2754 9.5270 9.5305 10.0838 10.1079 10.1374 10.1565 10.3087 10.3113 10.6824 10.6834 10.8192 10.8277 11.0220 11.0403 11.1189 11.1292 11.2724 11.3100 11.4227 11.4353 11.5375 11.5831 11.7834 11.8298 11.9177 11.9266 12.4832 12.5435 12.7443 12.7757 12.8217 12.8499 12.9363 12.9973 13.0952 13.1208 13.4072 13.4283 13.7950 13.8325 13.8665 13.8689 14.0837 14.1015 14.1656 14.2087 14.2182 14.2361 14.2862 14.3509 14.4989 14.5796 14.6701 14.6768 14.9407 15.0044 15.5512 15.5576 16.2284 16.2308 18.8482 18.8891 19.5359 19.6999 19.9897 20.0441 20.7198 20.7274 20.9263 21.0452 k = 0.1786 0.1031-0.0000 ( 4407 PWs) bands (ev): 3.4919 3.4920 5.6656 5.6677 6.4316 6.4345 8.1596 8.1630 8.3404 8.3518 8.8913 8.9185 9.1304 9.1967 9.2480 9.3060 9.5375 9.5441 10.0866 10.1168 10.1435 10.1657 10.3149 10.3202 10.6661 10.6671 10.8155 10.8260 11.0295 11.0541 11.1319 11.1450 11.2741 11.3174 11.4269 11.4447 11.5521 11.6126 11.8006 11.8591 11.9416 11.9570 12.4718 12.5468 12.7436 12.7920 12.8092 12.8363 12.9032 12.9761 13.0996 13.1330 13.3960 13.4212 13.8039 13.8341 13.8487 13.8612 14.0654 14.0795 14.1518 14.1941 14.2024 14.2318 14.2586 14.3192 14.5141 14.5857 14.6979 14.7023 14.9546 15.0204 15.6167 15.6223 16.3422 16.3450 18.7889 18.8431 19.4092 19.5982 19.9606 20.0222 20.6938 20.7035 20.8846 21.0107 k = 0.1964 0.1134-0.0000 ( 4407 PWs) bands (ev): 3.5249 3.5251 5.6406 5.6433 6.3835 6.3872 8.1153 8.1197 8.3154 8.3295 8.8884 8.9188 9.1481 9.2338 9.2601 9.3413 9.5485 9.5594 10.0894 10.1247 10.1501 10.1732 10.3210 10.3303 10.6481 10.6491 10.8134 10.8255 11.0358 11.0698 11.1424 11.1613 11.2769 11.3235 11.4320 11.4566 11.5685 11.6456 11.8197 11.8897 11.9655 11.9888 12.4610 12.5512 12.7226 12.7874 12.8138 12.8224 12.8897 12.9541 13.1040 13.1469 13.3842 13.4127 13.7985 13.8043 13.8376 13.8799 14.0474 14.0541 14.1431 14.1792 14.1938 14.2152 14.2538 14.2897 14.5281 14.5912 14.7259 14.7280 14.9755 15.0392 15.6841 15.6889 16.4590 16.4623 18.7180 18.7854 19.2794 19.4834 19.9543 20.0147 20.6551 20.6656 20.8441 20.9733 k = 0.2143 0.1237-0.0000 ( 4405 PWs) bands (ev): 3.5608 3.5611 5.6119 5.6153 6.3351 6.3395 8.0723 8.0774 8.2939 8.3101 8.8819 8.9143 9.1645 9.2596 9.2822 9.3791 9.5606 9.5771 10.0922 10.1305 10.1581 10.1786 10.3263 10.3414 10.6283 10.6294 10.8135 10.8266 11.0407 11.0878 11.1499 11.1783 11.2808 11.3282 11.4378 11.4704 11.5862 11.6813 11.8408 11.9203 11.9894 12.0218 12.4517 12.5562 12.6896 12.7563 12.8061 12.8277 12.9048 12.9323 13.1081 13.1614 13.3714 13.4023 13.7710 13.7763 13.8389 13.8896 14.0275 14.0342 14.1385 14.1624 14.1908 14.2041 14.2587 14.2626 14.5407 14.5959 14.7456 14.7595 15.0042 15.0610 15.7530 15.7570 16.5786 16.5824 18.6372 18.7169 19.1480 19.3599 19.9675 20.0214 20.6001 20.6092 20.8035 20.9382 k = 0.2321 0.1340-0.0000 ( 4407 PWs) bands (ev): 3.5995 3.5998 5.5792 5.5832 6.2872 6.2924 8.0308 8.0363 8.2759 8.2937 8.8721 8.9052 9.1803 9.2735 9.3142 9.4171 9.5749 9.5976 10.0952 10.1334 10.1681 10.1821 10.3308 10.3533 10.6067 10.6082 10.8161 10.8296 11.0441 11.1078 11.1543 11.1962 11.2855 11.3316 11.4444 11.4855 11.6046 11.7185 11.8638 11.9495 12.0136 12.0557 12.4444 12.5608 12.6514 12.7129 12.7908 12.8440 12.9120 12.9327 13.1116 13.1757 13.3574 13.3898 13.7366 13.7487 13.8429 13.8822 14.0035 14.0286 14.1365 14.1462 14.1931 14.2043 14.2373 14.2666 14.5521 14.5997 14.7608 14.7914 15.0402 15.0857 15.8233 15.8267 16.7003 16.7046 18.5488 18.6392 19.0169 19.2321 19.9962 20.0414 20.5283 20.5346 20.7570 20.9081 k = 0.2500 0.1443-0.0000 ( 4413 PWs) bands (ev): 3.6408 3.6412 5.5422 5.5468 6.2408 6.2467 7.9913 7.9969 8.2614 8.2803 8.8591 8.8921 9.1960 9.2854 9.3452 9.4523 9.5929 9.6214 10.0983 10.1337 10.1796 10.1840 10.3346 10.3656 10.5834 10.5859 10.8213 10.8349 11.0457 11.1284 11.1567 11.2149 11.2909 11.3343 11.4520 11.5010 11.6230 11.7558 11.8886 11.9753 12.0389 12.0901 12.4401 12.5621 12.6107 12.6686 12.7768 12.8581 12.8958 12.9648 13.1146 13.1885 13.3421 13.3754 13.7019 13.7202 13.8467 13.8593 13.9753 14.0361 14.1332 14.1364 14.2006 14.2127 14.2138 14.2773 14.5625 14.6024 14.7725 14.8232 15.0821 15.1127 15.8948 15.8977 16.8240 16.8288 18.4551 18.5545 18.8877 19.1032 20.0370 20.0730 20.4419 20.4455 20.6977 20.8601 k = 0.2679 0.1546-0.0000 ( 4411 PWs) bands (ev): 3.6847 3.6852 5.5006 5.5059 6.1968 6.2034 7.9539 7.9594 8.2503 8.2699 8.8434 8.8755 9.2118 9.2972 9.3728 9.4820 9.6164 9.6484 10.1014 10.1319 10.1853 10.1922 10.3378 10.3779 10.5588 10.5630 10.8291 10.8423 11.0455 11.1419 11.1645 11.2339 11.2970 11.3368 11.4604 11.5162 11.6407 11.7916 11.9146 11.9960 12.0663 12.1249 12.4398 12.5524 12.5692 12.6343 12.7640 12.8589 12.8946 12.9983 13.1171 13.1985 13.3256 13.3602 13.6676 13.6927 13.8290 13.8500 13.9441 14.0486 14.1235 14.1378 14.1912 14.2142 14.2254 14.2920 14.5722 14.6038 14.7820 14.8547 15.1279 15.1412 15.9674 15.9701 16.9491 16.9546 18.3580 18.4649 18.7618 18.9756 20.0866 20.1138 20.3444 20.3458 20.6241 20.7854 k = 0.2857 0.1650-0.0000 ( 4408 PWs) bands (ev): 3.7310 3.7316 5.4546 5.4603 6.1560 6.1630 7.9187 7.9240 8.2425 8.2625 8.8252 8.8562 9.2277 9.3091 9.3967 9.5047 9.6454 9.6780 10.1040 10.1283 10.1871 10.2053 10.3412 10.3900 10.5336 10.5402 10.8391 10.8520 11.0433 11.1400 11.1851 11.2525 11.3039 11.3394 11.4699 11.5306 11.6573 11.8239 11.9411 12.0111 12.0956 12.1594 12.4447 12.5225 12.5280 12.6202 12.7531 12.8464 12.9077 13.0315 13.1194 13.2035 13.3081 13.3457 13.6341 13.6678 13.7971 13.8526 13.9115 14.0604 14.1170 14.1390 14.1721 14.2326 14.2388 14.3118 14.5816 14.6039 14.7904 14.8860 15.1701 15.1755 16.0409 16.0435 17.0754 17.0817 18.2592 18.3729 18.6406 18.8514 20.1400 20.1602 20.2390 20.2395 20.5407 20.6959 k = 0.3036 0.1753-0.0000 ( 4412 PWs) bands (ev): 3.7794 3.7801 5.4043 5.4103 6.1189 6.1261 7.8860 7.8909 8.2380 8.2581 8.8051 8.8346 9.2437 9.3210 9.4171 9.5212 9.6783 9.7091 10.1055 10.1231 10.1907 10.2184 10.3449 10.4012 10.5087 10.5185 10.8510 10.8639 11.0390 11.1319 11.2090 11.2696 11.3120 11.3427 11.4804 11.5437 11.6726 11.8508 11.9671 12.0211 12.1260 12.1930 12.4554 12.4814 12.4888 12.6187 12.7446 12.8325 12.9228 13.0626 13.1215 13.2010 13.2906 13.3339 13.6016 13.6470 13.7668 13.8537 13.8786 14.0694 14.1132 14.1320 14.1635 14.2510 14.2555 14.3369 14.5907 14.6027 14.7991 14.9174 15.1978 15.2229 16.1150 16.1178 17.2024 17.2099 18.1605 18.2804 18.5253 18.7321 20.1212 20.1232 20.1936 20.2131 20.4592 20.5987 k = 0.3214 0.1856-0.0000 ( 4412 PWs) bands (ev): 3.8298 3.8306 5.3501 5.3562 6.0856 6.0929 7.8558 7.8602 8.2365 8.2564 8.7835 8.8113 9.2596 9.3326 9.4347 9.5332 9.7123 9.7405 10.1051 10.1165 10.1975 10.2310 10.3491 10.4101 10.4860 10.4992 10.8642 10.8777 11.0325 11.1204 11.2325 11.2837 11.3222 11.3471 11.4920 11.5556 11.6866 11.8701 11.9912 12.0269 12.1567 12.2237 12.4409 12.4498 12.4755 12.6197 12.7394 12.8199 12.9366 13.0895 13.1235 13.1899 13.2743 13.3259 13.5708 13.6321 13.7395 13.8426 13.8562 14.0755 14.1117 14.1137 14.1682 14.2617 14.2815 14.3662 14.5997 14.6004 14.8087 14.9494 15.2228 15.2685 16.1893 16.1927 17.3297 17.3389 18.0635 18.1898 18.4171 18.6192 20.0044 20.0067 20.2042 20.2480 20.4144 20.5113 k = 0.3393 0.1959-0.0000 ( 4408 PWs) bands (ev): 3.8819 3.8828 5.2926 5.2988 6.0564 6.0635 7.8282 7.8322 8.2377 8.2572 8.7609 8.7870 9.2754 9.3438 9.4502 9.5421 9.7450 9.7708 10.1028 10.1090 10.2079 10.2428 10.3527 10.4126 10.4704 10.4847 10.8782 10.8932 11.0238 11.1064 11.2539 11.2941 11.3345 11.3530 11.5047 11.5661 11.6991 11.8806 12.0124 12.0293 12.1869 12.2469 12.4098 12.4176 12.4998 12.6194 12.7383 12.8093 12.9478 13.1093 13.1250 13.1712 13.2613 13.3203 13.5428 13.6243 13.7163 13.8107 13.8528 14.0783 14.0927 14.1118 14.1777 14.2713 14.3094 14.3979 14.5973 14.6083 14.8203 14.9825 15.2437 15.3104 16.2632 16.2675 17.4564 17.4684 17.9696 18.1030 18.3174 18.5139 19.8830 19.8856 20.1438 20.2302 20.4435 20.4777 k = 0.3571 0.2062-0.0000 ( 4414 PWs) bands (ev): 3.9352 3.9362 5.2328 5.2387 6.0311 6.0379 7.8033 7.8068 8.2414 8.2603 8.7379 8.7621 9.2908 9.3541 9.4643 9.5488 9.7748 9.7990 10.0988 10.1007 10.2214 10.2534 10.3535 10.4030 10.4685 10.4778 10.8922 10.9099 11.0129 11.0906 11.2722 11.3014 11.3481 11.3609 11.5186 11.5759 11.7096 11.8816 12.0292 12.0296 12.2153 12.2539 12.3901 12.3986 12.5311 12.6163 12.7415 12.8011 12.9553 13.1163 13.1285 13.1477 13.2533 13.3154 13.5191 13.6243 13.6975 13.7785 13.8479 14.0650 14.0850 14.1129 14.1891 14.2800 14.3380 14.4307 14.5935 14.6163 14.8346 15.0171 15.2589 15.3471 16.3359 16.3415 17.5804 17.5982 17.8804 18.0230 18.2276 18.4174 19.7588 19.7614 20.0484 20.1464 20.5118 20.5133 k = 0.3750 0.2165-0.0000 ( 4418 PWs) bands (ev): 3.9891 3.9903 5.1716 5.1773 6.0096 6.0158 7.7812 7.7842 8.2472 8.2651 8.7149 8.7372 9.3057 9.3633 9.4774 9.5539 9.8009 9.8241 10.0924 10.0938 10.2370 10.2627 10.3495 10.3850 10.4776 10.4809 10.9050 10.9273 11.0000 11.0740 11.2866 11.3066 11.3618 11.3708 11.5333 11.5854 11.7175 11.8737 12.0276 12.0421 12.2397 12.2423 12.3699 12.4109 12.5675 12.6107 12.7487 12.7953 12.9580 13.1090 13.1224 13.1340 13.2494 13.3098 13.5022 13.6313 13.6834 13.7475 13.8409 14.0407 14.0865 14.1141 14.2014 14.2875 14.3666 14.4632 14.5893 14.6234 14.8526 15.0536 15.2674 15.3772 16.4065 16.4136 17.6944 17.7274 17.7978 17.9575 18.1497 18.3305 19.6329 19.6351 19.9459 20.0389 20.5777 20.5930 k = 0.3929 0.2268-0.0000 ( 4422 PWs) bands (ev): 4.0430 4.0443 5.1103 5.1156 5.9916 5.9971 7.7619 7.7644 8.2547 8.2714 8.6927 8.7129 9.3198 9.3709 9.4897 9.5575 9.8232 9.8455 10.0844 10.0884 10.2529 10.2707 10.3411 10.3651 10.4921 10.4932 10.9154 10.9445 10.9855 11.0579 11.2971 11.3104 11.3748 11.3821 11.5489 11.5954 11.7217 11.8584 12.0252 12.0495 12.2231 12.2555 12.3610 12.4369 12.6033 12.6068 12.7589 12.7922 12.9552 13.0944 13.0981 13.1362 13.2464 13.3036 13.4936 13.6430 13.6742 13.7193 13.8319 14.0147 14.0885 14.1148 14.2140 14.2935 14.3945 14.4942 14.5846 14.6292 14.8751 15.0917 15.2684 15.3993 16.4736 16.4825 17.7219 17.7622 17.8568 17.9423 18.0855 18.2543 19.5061 19.5076 19.8459 19.9291 20.6498 20.6789 k = 0.4107 0.2371-0.0000 ( 4414 PWs) bands (ev): 4.0958 4.0971 5.0506 5.0553 5.9769 5.9816 7.7455 7.7476 8.2634 8.2785 8.6720 8.6899 9.3330 9.3769 9.5015 9.5597 9.8416 9.8627 10.0773 10.0830 10.2674 10.2773 10.3307 10.3465 10.5096 10.5116 10.9215 10.9586 10.9723 11.0439 11.3045 11.3134 11.3867 11.3935 11.5651 11.6068 11.7215 11.8372 12.0229 12.0520 12.2055 12.2585 12.3668 12.4665 12.5960 12.6458 12.7711 12.7924 12.9465 13.0757 13.0771 13.1328 13.2434 13.2972 13.4936 13.6514 13.6701 13.7000 13.8214 13.9875 14.0906 14.1148 14.2266 14.2975 14.4213 14.5229 14.5792 14.6332 14.9028 15.1309 15.2617 15.4125 16.5360 16.5464 17.6565 17.7401 17.9818 18.0157 18.0417 18.1913 19.3793 19.3797 19.7535 19.8251 20.7186 20.7622 k = 0.4286 0.2474-0.0000 ( 4410 PWs) bands (ev): 4.1460 4.1473 4.9943 4.9984 5.9652 5.9691 7.7321 7.7337 8.2725 8.2857 8.6536 8.6688 9.3450 9.3810 9.5128 9.5605 9.8566 9.8757 10.0715 10.0780 10.2789 10.2821 10.3212 10.3308 10.5289 10.5328 10.9220 10.9496 10.9802 11.0340 11.3097 11.3155 11.3973 11.4038 11.5819 11.6202 11.7164 11.8122 12.0214 12.0505 12.1934 12.2511 12.3840 12.4924 12.5927 12.6796 12.7842 12.7976 12.9332 13.0550 13.0610 13.1215 13.2423 13.2909 13.4999 13.6407 13.6712 13.7037 13.8107 13.9594 14.0929 14.1139 14.2389 14.2990 14.4466 14.5485 14.5727 14.6351 14.9358 15.1687 15.2492 15.4161 16.5919 16.6033 17.6020 17.6872 17.9994 18.0802 18.1376 18.1637 19.2529 19.2536 19.6725 19.7316 20.7714 20.8155 k = 0.4464 0.2577-0.0000 ( 4416 PWs) bands (ev): 4.1912 4.1924 4.9441 4.9475 5.9564 5.9594 7.7217 7.7229 8.2815 8.2921 8.6383 8.6504 9.3556 9.3832 9.5233 9.5598 9.8686 9.8844 10.0675 10.0737 10.2842 10.2856 10.3147 10.3197 10.5485 10.5535 10.9171 10.9337 10.9936 11.0285 11.3132 11.3170 11.4063 11.4121 11.5992 11.6359 11.7067 11.7850 12.0211 12.0463 12.1878 12.2392 12.4060 12.5059 12.6003 12.7007 12.7973 12.8106 12.9195 13.0330 13.0500 13.1031 13.2450 13.2848 13.5103 13.6187 13.6774 13.7192 13.8026 13.9305 14.0955 14.1123 14.2508 14.2980 14.4702 14.5647 14.5707 14.6346 14.9736 15.1913 15.2444 15.4101 16.6397 16.6508 17.5604 17.6334 17.9796 18.0689 18.2524 18.2559 19.1293 19.1309 19.6067 19.6523 20.8014 20.8275 k = 0.4643 0.2681-0.0000 ( 4424 PWs) bands (ev): 4.2282 4.2292 4.9036 4.9060 5.9504 5.9524 7.7142 7.7150 8.2894 8.2969 8.6272 8.6357 9.3647 9.3833 9.5328 9.5575 9.8778 9.8893 10.0652 10.0700 10.2835 10.2864 10.3124 10.3146 10.5661 10.5708 10.9098 10.9191 11.0052 11.0259 11.3157 11.3179 11.4135 11.4179 11.6170 11.6534 11.6939 11.7572 12.0224 12.0408 12.1881 12.2260 12.4292 12.5033 12.6212 12.7047 12.8098 12.8273 12.9135 13.0091 13.0442 13.0816 13.2508 13.2787 13.5232 13.5956 13.6878 13.7292 13.8036 13.9011 14.0983 14.1100 14.2619 14.2945 14.4917 14.5548 14.5893 14.6315 15.0149 15.1749 15.2708 15.3950 16.6772 16.6863 17.5334 17.5865 17.9723 18.0360 18.3646 18.3695 19.0131 19.0155 19.5593 19.5903 20.8159 20.8297 k = 0.4821 0.2784-0.0000 ( 4416 PWs) bands (ev): 4.2532 4.2538 4.8769 4.8782 5.9471 5.9481 7.7098 7.7102 8.2955 8.2994 8.6211 8.6255 9.3721 9.3815 9.5412 9.5536 9.8846 9.8906 10.0645 10.0672 10.2821 10.2840 10.3125 10.3135 10.5791 10.5819 10.9041 10.9084 11.0140 11.0237 11.3172 11.3183 11.4185 11.4209 11.6352 11.6650 11.6870 11.7300 12.0253 12.0350 12.1932 12.2133 12.4518 12.4905 12.6480 12.6942 12.8211 12.8346 12.9255 12.9820 13.0438 13.0624 13.2580 13.2723 13.5379 13.5741 13.7009 13.7262 13.8190 13.8717 14.1013 14.1073 14.2722 14.2888 14.5111 14.5427 14.6046 14.6255 15.0580 15.1410 15.3070 15.3717 16.7022 16.7074 17.5225 17.5505 17.9757 18.0084 18.4607 18.4641 18.9170 18.9191 19.5329 19.5487 20.8233 20.8293 k = 0.5000 0.2887-0.0000 ( 4416 PWs) bands (ev): 4.2623 4.2623 4.8679 4.8679 5.9463 5.9463 7.7085 7.7085 8.2989 8.2989 8.6205 8.6205 9.3778 9.3778 9.5482 9.5482 9.8889 9.8889 10.0653 10.0653 10.2821 10.2821 10.3132 10.3132 10.5848 10.5848 10.9031 10.9031 11.0200 11.0200 11.3181 11.3181 11.4211 11.4211 11.6530 11.6530 11.7048 11.7048 12.0296 12.0296 12.2020 12.2020 12.4726 12.4726 12.6739 12.6739 12.8303 12.8303 12.9522 12.9522 13.0496 13.0496 13.2653 13.2653 13.5549 13.5549 13.7148 13.7148 13.8436 13.8436 14.1044 14.1044 14.2812 14.2812 14.5281 14.5281 14.6166 14.6166 15.1008 15.1009 15.3417 15.3417 16.7127 16.7127 17.5285 17.5285 17.9881 17.9881 18.5051 18.5051 18.8752 18.8752 19.5292 19.5292 20.8273 20.8273 k = 0.5000 0.2887-0.0000 ( 4416 PWs) bands (ev): 4.2623 4.2623 4.8679 4.8679 5.9463 5.9463 7.7085 7.7085 8.2989 8.2989 8.6205 8.6205 9.3778 9.3778 9.5482 9.5482 9.8889 9.8889 10.0653 10.0653 10.2821 10.2821 10.3132 10.3132 10.5848 10.5848 10.9031 10.9031 11.0200 11.0200 11.3181 11.3181 11.4211 11.4211 11.6530 11.6530 11.7048 11.7048 12.0296 12.0296 12.2020 12.2020 12.4726 12.4726 12.6739 12.6739 12.8303 12.8303 12.9522 12.9522 13.0496 13.0496 13.2653 13.2653 13.5549 13.5549 13.7148 13.7148 13.8436 13.8436 14.1044 14.1044 14.2812 14.2812 14.5281 14.5281 14.6166 14.6166 15.1008 15.1009 15.3417 15.3417 16.7127 16.7127 17.5285 17.5285 17.9881 17.9881 18.5051 18.5051 18.8752 18.8752 19.5292 19.5292 20.8273 20.8273 k = 0.4902 0.3057-0.0000 ( 4415 PWs) bands (ev): 4.2633 4.2633 4.8691 4.8691 5.9419 5.9419 7.7110 7.7110 8.2985 8.2985 8.6177 8.6177 9.3787 9.3787 9.5497 9.5497 9.8883 9.8883 10.0654 10.0654 10.2822 10.2822 10.3135 10.3135 10.5862 10.5862 10.9036 10.9036 11.0212 11.0212 11.3171 11.3171 11.4207 11.4207 11.6526 11.6526 11.7041 11.7041 12.0308 12.0308 12.2033 12.2033 12.4705 12.4705 12.6740 12.6740 12.8306 12.8306 12.9514 12.9514 13.0503 13.0503 13.2662 13.2662 13.5544 13.5544 13.7145 13.7145 13.8433 13.8433 14.1043 14.1043 14.2819 14.2819 14.5288 14.5288 14.6171 14.6171 15.0981 15.0981 15.3377 15.3377 16.7197 16.7197 17.5308 17.5308 17.9892 17.9892 18.5069 18.5069 18.8768 18.8768 19.5307 19.5307 20.8175 20.8175 k = 0.4804 0.3226-0.0000 ( 4415 PWs) bands (ev): 4.2663 4.2663 4.8728 4.8728 5.9290 5.9290 7.7183 7.7183 8.2972 8.2972 8.6094 8.6094 9.3813 9.3813 9.5545 9.5545 9.8865 9.8865 10.0658 10.0658 10.2823 10.2823 10.3146 10.3146 10.5902 10.5902 10.9050 10.9050 11.0244 11.0244 11.3142 11.3142 11.4194 11.4194 11.6514 11.6514 11.7019 11.7019 12.0342 12.0342 12.2071 12.2071 12.4646 12.4646 12.6742 12.6742 12.8314 12.8314 12.9492 12.9492 13.0523 13.0523 13.2687 13.2687 13.5529 13.5529 13.7136 13.7136 13.8425 13.8425 14.1043 14.1043 14.2838 14.2838 14.5308 14.5308 14.6184 14.6184 15.0901 15.0901 15.3261 15.3261 16.7401 16.7401 17.5378 17.5378 17.9923 17.9923 18.5123 18.5123 18.8817 18.8817 19.5351 19.5351 20.7883 20.7883 k = 0.4706 0.3396-0.0000 ( 4417 PWs) bands (ev): 4.2712 4.2712 4.8789 4.8789 5.9079 5.9079 7.7302 7.7302 8.2951 8.2951 8.5959 8.5959 9.3854 9.3854 9.5623 9.5623 9.8836 9.8836 10.0662 10.0662 10.2823 10.2823 10.3164 10.3164 10.5969 10.5969 10.9078 10.9078 11.0298 11.0298 11.3096 11.3096 11.4175 11.4175 11.6491 11.6491 11.6981 11.6981 12.0400 12.0400 12.2132 12.2132 12.4556 12.4556 12.6744 12.6744 12.8327 12.8327 12.9456 12.9456 13.0557 13.0557 13.2724 13.2724 13.5506 13.5506 13.7124 13.7124 13.8410 13.8410 14.1044 14.1044 14.2868 14.2868 14.5339 14.5339 14.6207 14.6207 15.0771 15.0771 15.3077 15.3077 16.7731 16.7731 17.5493 17.5493 17.9973 17.9973 18.5213 18.5213 18.8899 18.8899 19.5424 19.5424 20.7402 20.7402 k = 0.4608 0.3566-0.0000 ( 4411 PWs) bands (ev): 4.2780 4.2780 4.8874 4.8874 5.8791 5.8791 7.7464 7.7464 8.2922 8.2922 8.5777 8.5777 9.3906 9.3906 9.5733 9.5733 9.8797 9.8797 10.0664 10.0664 10.2819 10.2819 10.3187 10.3187 10.6060 10.6060 10.9124 10.9124 11.0371 11.0371 11.3036 11.3036 11.4151 11.4151 11.6454 11.6454 11.6923 11.6923 12.0481 12.0481 12.2211 12.2211 12.4444 12.4444 12.6743 12.6743 12.8341 12.8341 12.9411 12.9411 13.0603 13.0603 13.2766 13.2766 13.5476 13.5476 13.7112 13.7112 13.8384 13.8384 14.1050 14.1050 14.2905 14.2905 14.5379 14.5379 14.6240 14.6240 15.0599 15.0599 15.2837 15.2837 16.8171 16.8171 17.5648 17.5648 18.0042 18.0042 18.5340 18.5340 18.9012 18.9012 19.5524 19.5524 20.6697 20.6697 k = 0.4510 0.3736-0.0000 ( 4411 PWs) bands (ev): 4.2867 4.2867 4.8983 4.8983 5.8433 5.8433 7.7663 7.7663 8.2886 8.2886 8.5554 8.5554 9.3966 9.3966 9.5872 9.5872 9.8751 9.8751 10.0659 10.0659 10.2810 10.2810 10.3212 10.3212 10.6174 10.6174 10.9194 10.9194 11.0461 11.0461 11.2968 11.2968 11.4124 11.4124 11.6399 11.6399 11.6843 11.6843 12.0585 12.0585 12.2301 12.2301 12.4322 12.4322 12.6740 12.6740 12.8352 12.8352 12.9361 12.9361 13.0660 13.0660 13.2807 13.2807 13.5444 13.5444 13.7105 13.7105 13.8346 13.8346 14.1065 14.1065 14.2948 14.2948 14.5424 14.5424 14.6280 14.6280 15.0392 15.0392 15.2554 15.2554 16.8704 16.8704 17.5842 17.5842 18.0125 18.0125 18.5502 18.5502 18.9157 18.9157 19.5648 19.5648 20.5660 20.5660 k = 0.4412 0.3906-0.0000 ( 4417 PWs) bands (ev): 4.2971 4.2971 4.9117 4.9117 5.8014 5.8014 7.7895 7.7895 8.2843 8.2843 8.5297 8.5297 9.4030 9.4030 9.6039 9.6039 9.8699 9.8699 10.0646 10.0646 10.2796 10.2796 10.3232 10.3232 10.6308 10.6308 10.9291 10.9291 11.0566 11.0566 11.2895 11.2895 11.4096 11.4096 11.6323 11.6323 11.6740 11.6740 12.0707 12.0707 12.2396 12.2396 12.4203 12.4203 12.6736 12.6736 12.8353 12.8353 12.9320 12.9320 13.0725 13.0725 13.2837 13.2837 13.5415 13.5415 13.7105 13.7105 13.8293 13.8293 14.1093 14.1093 14.2991 14.2991 14.5472 14.5472 14.6329 14.6329 15.0160 15.0160 15.2240 15.2240 16.9313 16.9313 17.6068 17.6068 18.0220 18.0220 18.5702 18.5702 18.9332 18.9332 19.5793 19.5793 20.4412 20.4412 k = 0.4314 0.4075-0.0000 ( 4421 PWs) bands (ev): 4.3091 4.3091 4.9274 4.9274 5.7542 5.7542 7.8155 7.8155 8.2793 8.2793 8.5011 8.5011 9.4096 9.4096 9.6230 9.6230 9.8644 9.8644 10.0620 10.0620 10.2780 10.2780 10.3244 10.3244 10.6461 10.6461 10.9416 10.9416 11.0686 11.0686 11.2824 11.2824 11.4068 11.4068 11.6225 11.6225 11.6612 11.6612 12.0842 12.0842 12.2487 12.2487 12.4099 12.4099 12.6730 12.6730 12.8336 12.8336 12.9299 12.9299 13.0792 13.0792 13.2846 13.2846 13.5396 13.5396 13.7113 13.7113 13.8222 13.8222 14.1136 14.1136 14.3032 14.3032 14.5519 14.5519 14.6384 14.6384 14.9914 14.9914 15.1908 15.1908 16.9981 16.9981 17.6321 17.6321 18.0319 18.0319 18.5939 18.5939 18.9535 18.9535 19.5955 19.5955 20.3133 20.3133 k = 0.4216 0.4245-0.0000 ( 4419 PWs) bands (ev): 4.3225 4.3225 4.9455 4.9455 5.7026 5.7026 7.8437 7.8437 8.2739 8.2739 8.4704 8.4704 9.4162 9.4162 9.6440 9.6440 9.8587 9.8587 10.0581 10.0581 10.2761 10.2761 10.3242 10.3242 10.6631 10.6631 10.9565 10.9565 11.0818 11.0818 11.2759 11.2759 11.4042 11.4042 11.6101 11.6101 11.6463 11.6463 12.0981 12.0981 12.2567 12.2567 12.4022 12.4023 12.6721 12.6721 12.8296 12.8296 12.9313 12.9313 13.0860 13.0860 13.2827 13.2827 13.5397 13.5397 13.7127 13.7127 13.8133 13.8133 14.1197 14.1197 14.3068 14.3068 14.5563 14.5563 14.6445 14.6445 14.9662 14.9662 15.1569 15.1569 17.0693 17.0693 17.6594 17.6594 18.0415 18.0415 18.6213 18.6213 18.9763 18.9763 19.6127 19.6127 20.1887 20.1887 k = 0.4118 0.4415-0.0000 ( 4419 PWs) bands (ev): 4.3371 4.3371 4.9659 4.9659 5.6476 5.6476 7.8738 7.8738 8.2679 8.2679 8.4380 8.4380 9.4226 9.4226 9.6665 9.6665 9.8529 9.8529 10.0528 10.0528 10.2742 10.2742 10.3225 10.3225 10.6813 10.6813 10.9732 10.9732 11.0962 11.0962 11.2709 11.2709 11.4019 11.4019 11.5954 11.5954 11.6295 11.6295 12.1115 12.1115 12.2629 12.2629 12.3985 12.3985 12.6705 12.6705 12.8234 12.8234 12.9370 12.9370 13.0924 13.0924 13.2772 13.2772 13.5424 13.5424 13.7146 13.7146 13.8025 13.8025 14.1277 14.1277 14.3096 14.3096 14.5602 14.5602 14.6510 14.6510 14.9412 14.9412 15.1232 15.1232 17.1436 17.1436 17.6879 17.6879 18.0497 18.0497 18.6525 18.6525 19.0011 19.0011 19.6301 19.6301 20.0704 20.0704 k = 0.4020 0.4585-0.0000 ( 4423 PWs) bands (ev): 4.3526 4.3526 4.9887 4.9887 5.5902 5.5902 7.9053 7.9053 8.2616 8.2616 8.4047 8.4047 9.4287 9.4287 9.6899 9.6899 9.8474 9.8474 10.0459 10.0459 10.2723 10.2723 10.3193 10.3193 10.7005 10.7005 10.9901 10.9901 11.1118 11.1118 11.2678 11.2678 11.4001 11.4001 11.5782 11.5782 11.6114 11.6114 12.1235 12.1235 12.2670 12.2670 12.3992 12.3992 12.6677 12.6677 12.8160 12.8160 12.9471 12.9471 13.0983 13.0983 13.2678 13.2678 13.5481 13.5481 13.7166 13.7166 13.7899 13.7899 14.1375 14.1375 14.3116 14.3116 14.5633 14.5633 14.6579 14.6579 14.9171 14.9171 15.0909 15.0909 17.2197 17.2197 17.7167 17.7167 18.0550 18.0550 18.6875 18.6875 19.0273 19.0273 19.6462 19.6462 19.9613 19.9613 k = 0.3922 0.4755-0.0000 ( 4439 PWs) bands (ev): 4.3686 4.3686 5.0137 5.0137 5.5312 5.5312 7.9377 7.9377 8.2551 8.2551 8.3709 8.3709 9.4344 9.4344 9.7135 9.7135 9.8422 9.8422 10.0378 10.0378 10.2706 10.2706 10.3150 10.3150 10.7202 10.7202 11.0058 11.0058 11.1284 11.1284 11.2676 11.2676 11.3987 11.3987 11.5589 11.5589 11.5926 11.5926 12.1334 12.1334 12.2690 12.2690 12.4046 12.4046 12.6632 12.6632 12.8084 12.8084 12.9617 12.9617 13.1033 13.1033 13.2544 13.2544 13.5567 13.5567 13.7184 13.7184 13.7758 13.7758 14.1487 14.1487 14.3127 14.3127 14.5656 14.5656 14.6654 14.6654 14.8942 14.8942 15.0607 15.0607 17.2967 17.2967 17.7447 17.7447 18.0556 18.0556 18.7264 18.7264 19.0539 19.0539 19.6588 19.6588 19.8649 19.8649 k = 0.3824 0.4924-0.0000 ( 4443 PWs) bands (ev): 4.3847 4.3847 5.0410 5.0410 5.4717 5.4717 7.9709 7.9709 8.2483 8.2483 8.3372 8.3372 9.4397 9.4397 9.7366 9.7366 9.8374 9.8374 10.0286 10.0286 10.2691 10.2691 10.3100 10.3100 10.7399 10.7399 11.0184 11.0184 11.1458 11.1458 11.2709 11.2709 11.3975 11.3975 11.5383 11.5383 11.5738 11.5738 12.1410 12.1410 12.2694 12.2694 12.4137 12.4137 12.6570 12.6570 12.8012 12.8012 12.9804 12.9804 13.1074 13.1074 13.2374 13.2374 13.5681 13.5681 13.7198 13.7198 13.7605 13.7605 14.1607 14.1607 14.3131 14.3131 14.5669 14.5669 14.6736 14.6736 14.8728 14.8728 15.0336 15.0336 17.3737 17.3737 17.7707 17.7707 18.0497 18.0497 18.7693 18.7693 19.0790 19.0790 19.6632 19.6632 19.7854 19.7854 k = 0.3725 0.5094-0.0000 ( 4447 PWs) bands (ev): 4.4002 4.4002 5.0705 5.0705 5.4129 5.4129 8.0041 8.0041 8.2413 8.2413 8.3043 8.3043 9.4443 9.4443 9.7582 9.7582 9.8334 9.8334 10.0190 10.0190 10.2678 10.2678 10.3048 10.3048 10.7589 10.7589 11.0268 11.0268 11.1632 11.1632 11.2783 11.2783 11.3960 11.3960 11.5174 11.5174 11.5557 11.5557 12.1464 12.1464 12.2686 12.2686 12.4252 12.4252 12.6498 12.6498 12.7948 12.7948 13.0028 13.0028 13.1105 13.1105 13.2171 13.2171 13.5815 13.5815 13.7203 13.7203 13.7449 13.7449 14.1727 14.1727 14.3130 14.3130 14.5673 14.5673 14.6828 14.6828 14.8529 14.8529 15.0102 15.0102 17.4499 17.4499 17.7929 17.7929 18.0359 18.0359 18.8160 18.8160 19.1004 19.1004 19.6503 19.6503 19.7297 19.7297 k = 0.3627 0.5264-0.0000 ( 4447 PWs) bands (ev): 4.4144 4.4144 5.1022 5.1022 5.3559 5.3559 8.0366 8.0366 8.2340 8.2340 8.2736 8.2736 9.4481 9.4481 9.7771 9.7771 9.8303 9.8303 10.0095 10.0095 10.2668 10.2668 10.3001 10.3001 10.7761 10.7761 11.0309 11.0309 11.1793 11.1793 11.2899 11.2899 11.3929 11.3929 11.4981 11.4981 11.5393 11.5393 12.1501 12.1501 12.2671 12.2671 12.4370 12.4370 12.6429 12.6429 12.7893 12.7893 13.0280 13.0280 13.1126 13.1126 13.1941 13.1941 13.5960 13.5960 13.7193 13.7193 13.7301 13.7301 14.1835 14.1835 14.3128 14.3128 14.5669 14.5669 14.6925 14.6925 14.8351 14.8351 14.9910 14.9910 17.5242 17.5242 17.8087 17.8087 18.0141 18.0141 18.8667 18.8667 19.1138 19.1138 19.6154 19.6154 19.6993 19.6993 k = 0.3529 0.5434-0.0000 ( 4449 PWs) bands (ev): 4.4261 4.4261 5.1359 5.1359 5.3021 5.3021 8.0668 8.0668 8.2252 8.2252 8.2478 8.2478 9.4511 9.4511 9.7915 9.7915 9.8289 9.8289 10.0013 10.0013 10.2658 10.2658 10.2963 10.2963 10.7904 10.7904 11.0315 11.0315 11.1926 11.1926 11.3045 11.3045 11.3868 11.3868 11.4829 11.4829 11.5258 11.5258 12.1525 12.1525 12.2655 12.2655 12.4471 12.4471 12.6375 12.6375 12.7847 12.7847 13.0553 13.0553 13.1139 13.1139 13.1689 13.1689 13.6102 13.6102 13.7127 13.7127 13.7216 13.7216 14.1921 14.1921 14.3127 14.3127 14.5663 14.5663 14.7021 14.7021 14.8204 14.8204 14.9765 14.9765 17.5951 17.5951 17.8135 17.8135 17.9878 17.9878 18.9211 18.9211 19.1132 19.1132 19.5739 19.5739 19.6837 19.6837 k = 0.3431 0.5604-0.0000 ( 4457 PWs) bands (ev): 4.4342 4.4342 5.1716 5.1716 5.2532 5.2532 8.0908 8.0908 8.2139 8.2139 8.2324 8.2324 9.4529 9.4529 9.7996 9.7996 9.8294 9.8294 9.9955 9.9955 10.2651 10.2651 10.2940 10.2940 10.8002 10.8002 11.0303 11.0303 11.2015 11.2015 11.3193 11.3193 11.3777 11.3777 11.4739 11.4739 11.5168 11.5168 12.1539 12.1539 12.2641 12.2641 12.4536 12.4536 12.6347 12.6347 12.7815 12.7815 13.0835 13.0835 13.1145 13.1145 13.1421 13.1421 13.6214 13.6214 13.7035 13.7035 13.7190 13.7190 14.1975 14.1975 14.3130 14.3130 14.5658 14.5658 14.7096 14.7096 14.8104 14.8104 14.9671 14.9671 17.6583 17.6583 17.8015 17.8015 17.9660 17.9660 18.9788 18.9788 19.0907 19.0907 19.5419 19.5419 19.6818 19.6818 k = 0.3333 0.5774-0.0000 ( 4461 PWs) bands (ev): 4.4373 4.4373 5.2040 5.2040 5.2160 5.2160 8.1005 8.1005 8.2083 8.2083 8.2273 8.2273 9.4536 9.4536 9.8018 9.8018 9.8304 9.8304 9.9934 9.9934 10.2647 10.2647 10.2932 10.2932 10.8038 10.8038 11.0295 11.0295 11.2048 11.2048 11.3267 11.3267 11.3720 11.3720 11.4711 11.4711 11.5136 11.5136 12.1544 12.1544 12.2635 12.2635 12.4558 12.4558 12.6341 12.6341 12.7803 12.7803 13.1058 13.1058 13.1172 13.1172 13.1177 13.1177 13.6258 13.6258 13.7001 13.7001 13.7177 13.7177 14.1992 14.1992 14.3132 14.3132 14.5656 14.5656 14.7124 14.7124 14.8070 14.8070 14.9637 14.9637 17.6927 17.6927 17.7849 17.7849 17.9577 17.9577 19.0325 19.0325 19.0487 19.0487 19.5304 19.5304 19.6862 19.6862 k = 0.3333 0.5774-0.0000 ( 4461 PWs) bands (ev): 4.4373 4.4373 5.2040 5.2040 5.2160 5.2160 8.1005 8.1005 8.2083 8.2083 8.2273 8.2273 9.4536 9.4536 9.8018 9.8018 9.8304 9.8304 9.9934 9.9934 10.2647 10.2647 10.2932 10.2932 10.8038 10.8038 11.0295 11.0295 11.2048 11.2048 11.3267 11.3267 11.3720 11.3720 11.4711 11.4711 11.5136 11.5136 12.1544 12.1544 12.2635 12.2635 12.4558 12.4558 12.6341 12.6341 12.7803 12.7803 13.1058 13.1058 13.1172 13.1172 13.1177 13.1177 13.6258 13.6258 13.7001 13.7001 13.7177 13.7177 14.1992 14.1992 14.3132 14.3132 14.5656 14.5656 14.7124 14.7124 14.8070 14.8070 14.9637 14.9637 17.6927 17.6927 17.7849 17.7849 17.9577 17.9577 19.0325 19.0325 19.0487 19.0487 19.5304 19.5304 19.6862 19.6862 k = 0.3232 0.5599-0.0000 ( 4459 PWs) bands (ev): 4.4335 4.4335 5.1740 5.1740 5.2516 5.2516 8.0913 8.0913 8.2089 8.2089 8.2369 8.2369 9.4528 9.4528 9.8003 9.8003 9.8285 9.8285 9.9956 9.9956 10.2653 10.2653 10.2939 10.2939 10.7996 10.7996 11.0309 11.0309 11.2010 11.2010 11.3189 11.3189 11.3783 11.3783 11.4740 11.4740 11.5168 11.5168 12.1539 12.1539 12.2643 12.2643 12.4538 12.4538 12.6339 12.6339 12.7818 12.7818 13.0825 13.0825 13.1153 13.1153 13.1424 13.1424 13.6215 13.6215 13.7012 13.7012 13.7212 13.7212 14.1975 14.1975 14.3127 14.3127 14.5657 14.5657 14.7096 14.7096 14.8098 14.8098 14.9680 14.9680 17.6519 17.6519 17.8066 17.8066 17.9674 17.9674 18.9639 18.9639 19.1071 19.1071 19.5403 19.5403 19.6774 19.6774 k = 0.3131 0.5424-0.0000 ( 4455 PWs) bands (ev): 4.4215 4.4215 5.1488 5.1488 5.2946 5.2946 8.0712 8.0712 8.2063 8.2063 8.2633 8.2633 9.4506 9.4506 9.7964 9.7964 9.8229 9.8229 10.0019 10.0019 10.2672 10.2672 10.2959 10.2959 10.7868 10.7868 11.0351 11.0351 11.1897 11.1897 11.3035 11.3035 11.3896 11.3896 11.4827 11.4827 11.5252 11.5252 12.1523 12.1523 12.2668 12.2668 12.4490 12.4490 12.6314 12.6314 12.7862 12.7862 13.0542 13.0542 13.1163 13.1163 13.1691 13.1691 13.6116 13.6116 13.6999 13.6999 13.7335 13.7335 14.1929 14.1929 14.3109 14.3109 14.5657 14.5657 14.7025 14.7025 14.8148 14.8148 14.9819 14.9819 17.5706 17.5706 17.8296 17.8296 17.9993 17.9993 18.8706 18.8706 19.1754 19.1754 19.5589 19.5589 19.6697 19.6697 k = 0.3030 0.5249-0.0000 ( 4441 PWs) bands (ev): 4.4004 4.4004 5.1344 5.1344 5.3396 5.3396 8.0476 8.0476 8.2029 8.2029 8.2964 8.2964 9.4467 9.4467 9.7901 9.7901 9.8149 9.8149 10.0107 10.0107 10.2709 10.2709 10.2986 10.2986 10.7662 10.7662 11.0413 11.0413 11.1722 11.1722 11.2875 11.2875 11.3998 11.3998 11.4962 11.4962 11.5375 11.5375 12.1498 12.1498 12.2713 12.2713 12.4426 12.4426 12.6250 12.6250 12.7917 12.7917 13.0288 13.0288 13.1185 13.1185 13.1935 13.1935 13.5994 13.5994 13.6965 13.6965 13.7511 13.7511 14.1861 14.1861 14.3074 14.3074 14.5647 14.5647 14.6937 14.6937 14.8184 14.8184 15.0061 15.0061 17.4744 17.4744 17.8334 17.8334 18.0512 18.0512 18.7670 18.7670 19.2458 19.2458 19.5649 19.5649 19.6915 19.6915 k = 0.2929 0.5074-0.0000 ( 4437 PWs) bands (ev): 4.3706 4.3706 5.1309 5.1309 5.3866 5.3866 8.0238 8.0238 8.1999 8.1999 8.3322 8.3322 9.4411 9.4411 9.7806 9.7806 9.8065 9.8065 10.0210 10.0210 10.2768 10.2768 10.3019 10.3019 10.7394 10.7394 11.0471 11.0471 11.1516 11.1516 11.2727 11.2727 11.4083 11.4083 11.5116 11.5116 11.5531 11.5531 12.1467 12.1467 12.2775 12.2775 12.4358 12.4358 12.6143 12.6143 12.7947 12.7947 13.0099 13.0099 13.1222 13.1222 13.2148 13.2148 13.5866 13.5866 13.6930 13.6930 13.7708 13.7708 14.1778 14.1778 14.3024 14.3024 14.5620 14.5620 14.6845 14.6845 14.8193 14.8193 15.0390 15.0390 17.3704 17.3704 17.8237 17.8237 18.1136 18.1136 18.6584 18.6584 19.3168 19.3168 19.5597 19.5597 19.7425 19.7425 k = 0.2828 0.4899-0.0000 ( 4437 PWs) bands (ev): 4.3329 4.3329 5.1371 5.1371 5.4353 5.4353 8.0011 8.0011 8.1978 8.1978 8.3691 8.3691 9.4339 9.4339 9.7676 9.7676 9.7988 9.7988 10.0315 10.0315 10.2847 10.2847 10.3054 10.3054 10.7081 10.7081 11.0482 11.0482 11.1325 11.1325 11.2593 11.2593 11.4155 11.4155 11.5250 11.5250 11.5723 11.5723 12.1433 12.1433 12.2851 12.2851 12.4289 12.4289 12.6003 12.6003 12.7912 12.7912 13.0006 13.0006 13.1276 13.1276 13.2325 13.2325 13.5742 13.5742 13.6903 13.6903 13.7911 13.7911 14.1685 14.1685 14.2961 14.2961 14.5568 14.5568 14.6755 14.6755 14.8182 14.8182 15.0773 15.0773 17.2621 17.2621 17.8074 17.8074 18.1781 18.1781 18.5494 18.5494 19.3854 19.3854 19.5592 19.5592 19.8078 19.8078 k = 0.2727 0.4724-0.0000 ( 4443 PWs) bands (ev): 4.2889 4.2889 5.1518 5.1518 5.4856 5.4856 7.9804 7.9804 8.1966 8.1966 8.4065 8.4065 9.4251 9.4251 9.7524 9.7524 9.7913 9.7913 10.0419 10.0419 10.2942 10.2942 10.3092 10.3092 10.6741 10.6741 11.0397 11.0397 11.1201 11.1201 11.2483 11.2483 11.4218 11.4218 11.5341 11.5341 11.5949 11.5949 12.1399 12.1399 12.2933 12.2933 12.4220 12.4220 12.5842 12.5842 12.7796 12.7796 13.0019 13.0019 13.1350 13.1350 13.2462 13.2462 13.5626 13.5626 13.6890 13.6890 13.8118 13.8118 14.1586 14.1586 14.2891 14.2891 14.5483 14.5483 14.6672 14.6672 14.8162 14.8162 15.1179 15.1179 17.1517 17.1517 17.7894 17.7894 18.2326 18.2326 18.4513 18.4513 19.4435 19.4435 19.5766 19.5766 19.8795 19.8795 k = 0.2626 0.4549-0.0000 ( 4443 PWs) bands (ev): 4.2402 4.2402 5.1733 5.1733 5.5376 5.5376 7.9620 7.9620 8.1964 8.1964 8.4439 8.4439 9.4148 9.4148 9.7360 9.7360 9.7832 9.7832 10.0517 10.0517 10.3027 10.3027 10.3152 10.3152 10.6390 10.6390 11.0208 11.0208 11.1146 11.1146 11.2403 11.2403 11.4271 11.4271 11.5388 11.5388 11.6191 11.6191 12.1365 12.1365 12.3010 12.3010 12.4150 12.4150 12.5678 12.5678 12.7618 12.7618 13.0112 13.0112 13.1444 13.1444 13.2558 13.2558 13.5524 13.5524 13.6895 13.6895 13.8323 13.8323 14.1484 14.1484 14.2815 14.2815 14.5362 14.5362 14.6598 14.6598 14.8138 14.8138 15.1575 15.1575 17.0408 17.0408 17.7735 17.7735 18.2289 18.2289 18.4121 18.4121 19.4805 19.4805 19.6234 19.6234 19.9539 19.9539 k = 0.2525 0.4374-0.0000 ( 4427 PWs) bands (ev): 4.1883 4.1883 5.1999 5.1999 5.5909 5.5909 7.9464 7.9464 8.1974 8.1974 8.4811 8.4811 9.4030 9.4030 9.7191 9.7191 9.7738 9.7738 10.0608 10.0608 10.3062 10.3062 10.3268 10.3268 10.6044 10.6044 10.9961 10.9961 11.1109 11.1109 11.2365 11.2365 11.4312 11.4312 11.5394 11.5394 11.6435 11.6435 12.1332 12.1332 12.3057 12.3057 12.4087 12.4087 12.5531 12.5531 12.7416 12.7416 13.0242 13.0242 13.1560 13.1560 13.2616 13.2616 13.5442 13.5442 13.6920 13.6920 13.8528 13.8528 14.1383 14.1383 14.2739 14.2739 14.5201 14.5201 14.6534 14.6534 14.8116 14.8116 15.1931 15.1931 16.9306 16.9306 17.7633 17.7633 18.1421 18.1421 18.4570 18.4570 19.5019 19.5019 19.6937 19.6937 20.0287 20.0287 k = 0.2424 0.4199-0.0000 ( 4433 PWs) bands (ev): 4.1343 4.1343 5.2304 5.2304 5.6456 5.6456 7.9337 7.9337 8.1995 8.1995 8.5180 8.5180 9.3901 9.3901 9.7019 9.7019 9.7625 9.7625 10.0692 10.0692 10.3057 10.3057 10.3415 10.3415 10.5720 10.5720 10.9696 10.9696 11.1053 11.1053 11.2368 11.2368 11.4337 11.4337 11.5365 11.5365 11.6665 11.6665 12.1297 12.1297 12.3030 12.3030 12.4063 12.4063 12.5414 12.5414 12.7221 12.7221 13.0368 13.0368 13.1699 13.1699 13.2639 13.2639 13.5388 13.5388 13.6967 13.6967 13.8730 13.8730 14.1285 14.1285 14.2663 14.2663 14.5002 14.5002 14.6480 14.6480 14.8096 14.8096 15.2224 15.2224 16.8220 16.8220 17.7609 17.7609 18.0314 18.0314 18.5281 18.5281 19.5188 19.5188 19.7751 19.7751 20.1026 20.1026 k = 0.2323 0.4024-0.0000 ( 4433 PWs) bands (ev): 4.0794 4.0794 5.2638 5.2638 5.7014 5.7014 7.9243 7.9243 8.2029 8.2029 8.5542 8.5542 9.3761 9.3761 9.6848 9.6848 9.7491 9.7491 10.0769 10.0769 10.3023 10.3023 10.3570 10.3570 10.5438 10.5438 10.9431 10.9431 11.0972 11.0972 11.2405 11.2405 11.4343 11.4343 11.5308 11.5308 11.6870 11.6870 12.1255 12.1255 12.2888 12.2888 12.4119 12.4119 12.5333 12.5333 12.7059 12.7059 13.0459 13.0459 13.1861 13.1861 13.2633 13.2633 13.5373 13.5373 13.7035 13.7035 13.8929 13.8929 14.1192 14.1192 14.2589 14.2589 14.4768 14.4768 14.6435 14.6435 14.8078 14.8078 15.2433 15.2433 16.7155 16.7155 17.7648 17.7648 17.9198 17.9198 18.6065 18.6065 19.5353 19.5353 19.8619 19.8619 20.1745 20.1745 k = 0.2222 0.3849-0.0000 ( 4427 PWs) bands (ev): 4.0243 4.0243 5.2989 5.2989 5.7583 5.7583 7.9184 7.9184 8.2076 8.2076 8.5896 8.5896 9.3613 9.3613 9.6675 9.6675 9.7333 9.7333 10.0838 10.0838 10.2959 10.2959 10.3713 10.3713 10.5222 10.5222 10.9179 10.9179 11.0870 11.0870 11.2462 11.2462 11.4326 11.4326 11.5228 11.5228 11.7041 11.7041 12.1199 12.1199 12.2641 12.2641 12.4257 12.4257 12.5283 12.5283 12.6944 12.6944 13.0495 13.0495 13.2038 13.2038 13.2609 13.2609 13.5405 13.5405 13.7123 13.7123 13.9124 13.9124 14.1110 14.1110 14.2518 14.2518 14.4504 14.4504 14.6398 14.6398 14.8060 14.8060 15.2546 15.2546 16.6118 16.6118 17.7424 17.7424 17.8459 17.8459 18.6885 18.6885 19.5522 19.5522 19.9519 19.9519 20.2436 20.2436 k = 0.2121 0.3674-0.0000 ( 4423 PWs) bands (ev): 3.9696 3.9696 5.3352 5.3352 5.8159 5.8159 7.9163 7.9163 8.2137 8.2137 8.6241 8.6241 9.3458 9.3458 9.6499 9.6499 9.7149 9.7149 10.0900 10.0900 10.2864 10.2864 10.3823 10.3823 10.5096 10.5096 10.8944 10.8944 11.0757 11.0757 11.2527 11.2527 11.4283 11.4283 11.5133 11.5133 11.7169 11.7169 12.1120 12.1120 12.2331 12.2331 12.4450 12.4450 12.5255 12.5255 12.6886 12.6886 13.0470 13.0470 13.2205 13.2205 13.2591 13.2591 13.5488 13.5488 13.7230 13.7230 13.9315 13.9315 14.1041 14.1041 14.2450 14.2450 14.4218 14.4218 14.6365 14.6365 14.8041 14.8041 15.2559 15.2559 16.5111 16.5111 17.6434 17.6434 17.8617 17.8617 18.7729 18.7729 19.5693 19.5693 20.0441 20.0441 20.3094 20.3094 k = 0.2020 0.3499-0.0000 ( 4427 PWs) bands (ev): 3.9158 3.9158 5.3719 5.3719 5.8742 5.8742 7.9181 7.9181 8.2211 8.2211 8.6574 8.6574 9.3298 9.3298 9.6313 9.6313 9.6943 9.6943 10.0955 10.0955 10.2744 10.2744 10.3877 10.3877 10.5078 10.5078 10.8732 10.8732 11.0642 11.0642 11.2589 11.2589 11.4212 11.4212 11.5028 11.5028 11.7248 11.7248 12.1005 12.1005 12.2000 12.2000 12.4662 12.4662 12.5260 12.5260 12.6889 12.6889 13.0384 13.0384 13.2283 13.2283 13.2651 13.2651 13.5624 13.5624 13.7357 13.7357 13.9497 13.9497 14.0992 14.0992 14.2384 14.2384 14.3916 14.3916 14.6334 14.6334 14.8017 14.8017 15.2474 15.2474 16.4136 16.4136 17.5244 17.5244 17.9116 17.9116 18.8590 18.8590 19.5860 19.5860 20.1376 20.1376 20.3712 20.3712 k = 0.1919 0.3324-0.0000 ( 4419 PWs) bands (ev): 3.8633 3.8633 5.4084 5.4084 5.9329 5.9329 7.9240 7.9240 8.2298 8.2298 8.6892 8.6892 9.3135 9.3135 9.6109 9.6109 9.6724 9.6724 10.1001 10.1001 10.2607 10.2607 10.3873 10.3873 10.5161 10.5161 10.8547 10.8547 11.0530 11.0530 11.2641 11.2641 11.4112 11.4112 11.4921 11.4921 11.7273 11.7273 12.0840 12.0840 12.1682 12.1682 12.4834 12.4834 12.5344 12.5344 12.6949 12.6949 13.0247 13.0247 13.2241 13.2241 13.2817 13.2817 13.5809 13.5809 13.7500 13.7500 13.9670 13.9670 14.0966 14.0966 14.2320 14.2320 14.3609 14.3609 14.6303 14.6303 14.7987 14.7987 15.2301 15.2301 16.3195 16.3195 17.4018 17.4018 17.9783 17.9783 18.9466 18.9466 19.6018 19.6018 20.2319 20.2319 20.4285 20.4285 k = 0.1818 0.3149-0.0000 ( 4405 PWs) bands (ev): 3.8124 3.8124 5.4444 5.4444 5.9919 5.9919 7.9341 7.9341 8.2400 8.2400 8.7195 8.7195 9.2971 9.2971 9.5870 9.5870 9.6508 9.6508 10.1039 10.1039 10.2465 10.2465 10.3830 10.3830 10.5312 10.5312 10.8390 10.8390 11.0427 11.0427 11.2679 11.2679 11.3983 11.3983 11.4816 11.4816 11.7243 11.7243 12.0615 12.0615 12.1397 12.1397 12.4911 12.4911 12.5555 12.5555 12.7060 12.7060 13.0070 13.0070 13.2147 13.2147 13.3016 13.3016 13.6035 13.6035 13.7660 13.7660 13.9832 13.9832 14.0966 14.0966 14.2257 14.2257 14.3307 14.3307 14.6268 14.6268 14.7947 14.7947 15.2056 15.2056 16.2288 16.2288 17.2783 17.2783 18.0580 18.0580 19.0351 19.0351 19.6166 19.6166 20.3264 20.3264 20.4811 20.4811 k = 0.1717 0.2974-0.0000 ( 4399 PWs) bands (ev): 3.7633 3.7633 5.4794 5.4794 6.0508 6.0508 7.9485 7.9485 8.2517 8.2517 8.7479 8.7479 9.2807 9.2807 9.5585 9.5585 9.6311 9.6311 10.1066 10.1066 10.2327 10.2327 10.3766 10.3766 10.5499 10.5499 10.8263 10.8263 11.0334 11.0334 11.2697 11.2697 11.3829 11.3829 11.4716 11.4716 11.7158 11.7158 12.0339 12.0339 12.1146 12.1146 12.4929 12.4929 12.5853 12.5853 12.7215 12.7215 12.9864 12.9864 13.2032 13.2032 13.3214 13.3214 13.6293 13.6293 13.7832 13.7832 13.9984 13.9984 14.0994 14.0994 14.2193 14.2193 14.3026 14.3026 14.6229 14.6229 14.7894 14.7894 15.1758 15.1758 16.1415 16.1415 17.1547 17.1547 18.1478 18.1478 19.1240 19.1240 19.6307 19.6307 20.4204 20.4204 20.5286 20.5286 k = 0.1616 0.2799-0.0000 ( 4405 PWs) bands (ev): 3.7163 3.7163 5.5130 5.5130 6.1094 6.1094 7.9673 7.9673 8.2647 8.2647 8.7742 8.7742 9.2644 9.2644 9.5252 9.5252 9.6137 9.6137 10.1084 10.1084 10.2198 10.2198 10.3689 10.3689 10.5701 10.5701 10.8167 10.8167 11.0256 11.0256 11.2692 11.2692 11.3657 11.3657 11.4623 11.4623 11.7024 11.7024 12.0038 12.0038 12.0910 12.0910 12.4931 12.4931 12.6187 12.6187 12.7406 12.7406 12.9641 12.9641 13.1908 13.1908 13.3398 13.3398 13.6575 13.6575 13.8008 13.8008 14.0130 14.0130 14.1041 14.1041 14.2128 14.2128 14.2785 14.2785 14.6182 14.6182 14.7823 14.7823 15.1427 15.1427 16.0573 16.0573 17.0315 17.0315 18.2451 18.2451 19.2125 19.2125 19.6449 19.6449 20.5131 20.5131 20.5711 20.5711 k = 0.1515 0.2624-0.0000 ( 4407 PWs) bands (ev): 3.6715 3.6715 5.5450 5.5450 6.1675 6.1675 7.9903 7.9903 8.2792 8.2792 8.7981 8.7981 9.2482 9.2482 9.4880 9.4880 9.5985 9.5985 10.1090 10.1090 10.2080 10.2080 10.3605 10.3605 10.5905 10.5905 10.8102 10.8102 11.0192 11.0192 11.2655 11.2655 11.3477 11.3477 11.4539 11.4539 11.6849 11.6849 11.9729 11.9729 12.0674 12.0674 12.4934 12.4934 12.6531 12.6531 12.7626 12.7626 12.9411 12.9411 13.1780 13.1780 13.3565 13.3565 13.6875 13.6875 13.8173 13.8173 14.0281 14.0281 14.1093 14.1093 14.2069 14.2069 14.2601 14.2601 14.6127 14.6127 14.7728 14.7728 15.1085 15.1085 15.9763 15.9763 16.9090 16.9090 18.3470 18.3470 19.2993 19.2993 19.6610 19.6610 20.5991 20.5991 20.6134 20.6134 k = 0.1414 0.2449-0.0000 ( 4411 PWs) bands (ev): 3.6291 3.6291 5.5752 5.5752 6.2247 6.2247 8.0176 8.0176 8.2951 8.2951 8.8193 8.8193 9.2320 9.2320 9.4484 9.4484 9.5847 9.5847 10.1086 10.1086 10.1971 10.1971 10.3516 10.3516 10.6102 10.6102 10.8067 10.8067 11.0143 11.0143 11.2575 11.2575 11.3308 11.3308 11.4464 11.4464 11.6642 11.6642 11.9425 11.9425 12.0431 12.0431 12.4945 12.4945 12.6868 12.6868 12.7863 12.7863 12.9192 12.9192 13.1651 13.1651 13.3712 13.3712 13.7187 13.7187 13.8309 13.8309 14.0441 14.0441 14.1133 14.1133 14.2041 14.2041 14.2484 14.2484 14.6064 14.6064 14.7604 14.7604 15.0753 15.0753 15.8982 15.8982 16.7876 16.7876 18.4502 18.4502 19.3827 19.3827 19.6819 19.6819 20.6381 20.6381 20.6949 20.6949 k = 0.1313 0.2274-0.0000 ( 4415 PWs) bands (ev): 3.5893 3.5893 5.6032 5.6032 6.2807 6.2807 8.0489 8.0489 8.3125 8.3125 8.8375 8.8375 9.2157 9.2157 9.4076 9.4076 9.5720 9.5720 10.1071 10.1071 10.1869 10.1869 10.3425 10.3425 10.6288 10.6288 10.8059 10.8059 11.0109 11.0109 11.2439 11.2439 11.3167 11.3167 11.4399 11.4399 11.6417 11.6417 11.9128 11.9128 12.0180 12.0180 12.4965 12.4965 12.7181 12.7181 12.8090 12.8090 12.9018 12.9018 13.1525 13.1525 13.3839 13.3839 13.7505 13.7505 13.8395 13.8395 14.0605 14.0605 14.1172 14.1172 14.2067 14.2067 14.2432 14.2432 14.5990 14.5990 14.7445 14.7445 15.0450 15.0450 15.8228 15.8228 16.6676 16.6676 18.5515 18.5515 19.4598 19.4598 19.7119 19.7119 20.6655 20.6655 20.7786 20.7786 k = 0.1212 0.2099-0.0000 ( 4417 PWs) bands (ev): 3.5520 3.5520 5.6291 5.6291 6.3351 6.3351 8.0839 8.0839 8.3313 8.3313 8.8523 8.8523 9.1987 9.1987 9.3672 9.3672 9.5600 9.5600 10.1047 10.1047 10.1771 10.1771 10.3334 10.3334 10.6460 10.6460 10.8075 10.8075 11.0087 11.0087 11.2246 11.2246 11.3063 11.3063 11.4344 11.4344 11.6186 11.6186 11.8841 11.8841 11.9923 11.9923 12.4994 12.4994 12.7455 12.7455 12.8230 12.8230 12.8973 12.8973 13.1403 13.1403 13.3948 13.3948 13.7822 13.7822 13.8416 13.8416 14.0744 14.0744 14.1258 14.1258 14.2134 14.2134 14.2451 14.2451 14.5908 14.5908 14.7251 14.7251 15.0189 15.0189 15.7500 15.7500 16.5493 16.5493 18.6471 18.6471 19.5281 19.5281 19.7556 19.7556 20.6883 20.6883 20.8539 20.8539 k = 0.1111 0.1925-0.0000 ( 4401 PWs) bands (ev): 3.5174 3.5174 5.6528 5.6528 6.3875 6.3875 8.1222 8.1222 8.3517 8.3517 8.8635 8.8635 9.1801 9.1801 9.3289 9.3289 9.5484 9.5484 10.1014 10.1014 10.1674 10.1674 10.3246 10.3246 10.6617 10.6617 10.8110 10.8110 11.0074 11.0074 11.2011 11.2011 11.2988 11.2988 11.4298 11.4298 11.5958 11.5958 11.8567 11.8567 11.9663 11.9663 12.5031 12.5031 12.7653 12.7653 12.8237 12.8237 12.9129 12.9129 13.1287 13.1287 13.4043 13.4043 13.8124 13.8124 13.8372 13.8372 14.0843 14.0843 14.1426 14.1426 14.2207 14.2207 14.2565 14.2565 14.5817 14.5817 14.7028 14.7028 14.9976 14.9976 15.6797 15.6797 16.4331 16.4331 18.7332 18.7332 19.5886 19.5886 19.8141 19.8141 20.7071 20.7071 20.9121 20.9121 k = 0.1010 0.1750-0.0000 ( 4403 PWs) bands (ev): 3.4856 3.4856 5.6741 5.6741 6.4376 6.4376 8.1631 8.1631 8.3736 8.3736 8.8709 8.8709 9.1587 9.1587 9.2945 9.2945 9.5372 9.5372 10.0974 10.0974 10.1578 10.1578 10.3163 10.3163 10.6761 10.6761 10.8156 10.8156 11.0065 11.0065 11.1755 11.1755 11.2932 11.2932 11.4260 11.4260 11.5742 11.5742 11.8308 11.8308 11.9403 11.9403 12.5075 12.5075 12.7693 12.7693 12.8272 12.8272 12.9397 12.9397 13.1181 13.1181 13.4128 13.4128 13.8228 13.8228 13.8445 13.8445 14.0934 14.0934 14.1632 14.1632 14.2286 14.2286 14.2773 14.2773 14.5718 14.5718 14.6788 14.6788 14.9810 14.9810 15.6118 15.6118 16.3194 16.3194 18.8066 18.8066 19.6464 19.6464 19.8839 19.8839 20.7225 20.7225 20.9520 20.9520 k = 0.0909 0.1575-0.0000 ( 4407 PWs) bands (ev): 3.4567 3.4567 5.6931 5.6931 6.4848 6.4848 8.2061 8.2061 8.3973 8.3973 8.8741 8.8741 9.1331 9.1331 9.2659 9.2659 9.5262 9.5262 10.0928 10.0928 10.1481 10.1481 10.3088 10.3088 10.6896 10.6896 10.8207 10.8207 11.0054 11.0054 11.1495 11.1495 11.2888 11.2888 11.4228 11.4228 11.5546 11.5546 11.8067 11.8067 11.9149 11.9149 12.5125 12.5125 12.7577 12.7577 12.8410 12.8410 12.9688 12.9688 13.1089 13.1089 13.4207 13.4207 13.8081 13.8081 13.8693 13.8693 14.1041 14.1041 14.1823 14.1823 14.2401 14.2401 14.3050 14.3050 14.5614 14.5614 14.6552 14.6552 14.9685 14.9685 15.5464 15.5464 16.2087 16.2087 18.8653 18.8653 19.7073 19.7073 19.9593 19.9593 20.7350 20.7350 20.9861 20.9861 k = 0.0808 0.1400-0.0000 ( 4407 PWs) bands (ev): 3.4307 3.4307 5.7099 5.7099 6.5288 6.5288 8.2499 8.2499 8.4230 8.4230 8.8733 8.8733 9.1031 9.1031 9.2437 9.2437 9.5155 9.5155 10.0878 10.0878 10.1386 10.1386 10.3022 10.3022 10.7023 10.7023 10.8257 10.8257 11.0031 11.0031 11.1249 11.1249 11.2851 11.2851 11.4200 11.4200 11.5374 11.5374 11.7850 11.7850 11.8903 11.8903 12.5181 12.5181 12.7403 12.7403 12.8580 12.8580 12.9957 12.9957 13.1024 13.1024 13.4283 13.4283 13.7902 13.7902 13.8909 13.8909 14.1164 14.1164 14.1976 14.1976 14.2569 14.2569 14.3372 14.3372 14.5508 14.5508 14.6344 14.6344 14.9592 14.9592 15.4837 15.4837 16.1017 16.1017 18.9089 18.9089 19.7742 19.7742 20.0353 20.0353 20.7453 20.7453 21.0214 21.0214 k = 0.0707 0.1225-0.0000 ( 4405 PWs) bands (ev): 3.4076 3.4076 5.7245 5.7245 6.5691 6.5691 8.2934 8.2934 8.4512 8.4512 8.8685 8.8685 9.0694 9.0694 9.2274 9.2274 9.5052 9.5052 10.0826 10.0826 10.1294 10.1294 10.2966 10.2966 10.7144 10.7144 10.8299 10.8299 10.9987 10.9987 11.1033 11.1033 11.2820 11.2820 11.4175 11.4175 11.5229 11.5229 11.7661 11.7661 11.8668 11.8668 12.5241 12.5241 12.7219 12.7219 12.8745 12.8745 13.0165 13.0165 13.1007 13.1007 13.4360 13.4360 13.7713 13.7713 13.9080 13.9080 14.1289 14.1289 14.2100 14.2100 14.2776 14.2776 14.3710 14.3710 14.5412 14.5412 14.6189 14.6189 14.9520 14.9520 15.4242 15.4242 15.9992 15.9992 18.9390 18.9390 19.8466 19.8466 20.1082 20.1082 20.7537 20.7537 21.0602 21.0602 k = 0.0606 0.1050-0.0000 ( 4401 PWs) bands (ev): 3.3875 3.3875 5.7369 5.7369 6.6052 6.6052 8.3349 8.3349 8.4824 8.4824 8.8602 8.8602 9.0335 9.0335 9.2153 9.2153 9.4953 9.4953 10.0775 10.0775 10.1208 10.1208 10.2920 10.2920 10.7261 10.7261 10.8330 10.8330 10.9913 10.9913 11.0861 11.0861 11.2795 11.2795 11.4151 11.4151 11.5112 11.5112 11.7502 11.7502 11.8450 11.8450 12.5304 12.5304 12.7039 12.7039 12.8895 12.8895 13.0280 13.0280 13.1063 13.1063 13.4438 13.4438 13.7530 13.7530 13.9203 13.9203 14.1408 14.1408 14.2205 14.2205 14.2996 14.2996 14.4024 14.4024 14.5351 14.5351 14.6107 14.6107 14.9461 14.9461 15.3687 15.3687 15.9022 15.9022 18.9584 18.9584 19.9221 19.9221 20.1747 20.1747 20.7606 20.7606 21.1031 21.1031 k = 0.0505 0.0875-0.0000 ( 4401 PWs) bands (ev): 3.3704 3.3704 5.7472 5.7472 6.6367 6.6367 8.3726 8.3726 8.5170 8.5170 8.8491 8.8491 8.9965 8.9965 9.2064 9.2064 9.4862 9.4862 10.0726 10.0726 10.1130 10.1130 10.2885 10.2885 10.7373 10.7373 10.8348 10.8348 10.9808 10.9808 11.0741 11.0741 11.2776 11.2776 11.4125 11.4125 11.5023 11.5023 11.7376 11.7376 11.8250 11.8250 12.5370 12.5370 12.6869 12.6869 12.9027 12.9027 13.0305 13.0305 13.1183 13.1183 13.4517 13.4517 13.7363 13.7363 13.9282 13.9282 14.1519 14.1519 14.2291 14.2291 14.3200 14.3200 14.4262 14.4262 14.5372 14.5372 14.6111 14.6111 14.9402 14.9402 15.3184 15.3184 15.8121 15.8121 18.9700 18.9700 19.9970 19.9970 20.2322 20.2322 20.7664 20.7664 21.1502 21.1502 k = 0.0404 0.0700-0.0000 ( 4395 PWs) bands (ev): 3.3565 3.3565 5.7556 5.7556 6.6631 6.6631 8.4051 8.4051 8.5546 8.5546 8.8365 8.8365 8.9592 8.9592 9.1997 9.1997 9.4781 9.4781 10.0683 10.0683 10.1063 10.1063 10.2859 10.2859 10.7477 10.7477 10.8353 10.8353 10.9686 10.9686 11.0666 11.0666 11.2762 11.2762 11.4098 11.4098 11.4960 11.4960 11.7283 11.7283 11.8073 11.8073 12.5438 12.5438 12.6715 12.6715 12.9139 12.9139 13.0281 13.0281 13.1321 13.1321 13.4594 13.4594 13.7218 13.7218 13.9326 13.9326 14.1623 14.1623 14.2352 14.2352 14.3362 14.3362 14.4385 14.4385 14.5511 14.5511 14.6201 14.6201 14.9334 14.9334 15.2752 15.2752 15.7308 15.7308 18.9762 18.9762 20.0677 20.0677 20.2784 20.2784 20.7711 20.7711 21.2006 21.2006 k = 0.0303 0.0525-0.0000 ( 4391 PWs) bands (ev): 3.3456 3.3456 5.7620 5.7620 6.6841 6.6841 8.4314 8.4314 8.5936 8.5936 8.8240 8.8240 8.9225 8.9225 9.1948 9.1948 9.4714 9.4714 10.0647 10.0647 10.1008 10.1008 10.2842 10.2842 10.7570 10.7570 10.8348 10.8348 10.9566 10.9566 11.0622 11.0622 11.2752 11.2752 11.4071 11.4071 11.4918 11.4918 11.7221 11.7221 11.7925 11.7925 12.5503 12.5503 12.6580 12.6580 12.9230 12.9230 13.0241 13.0241 13.1445 13.1445 13.4664 13.4664 13.7101 13.7101 13.9343 13.9343 14.1720 14.1720 14.2383 14.2383 14.3472 14.3472 14.4417 14.4417 14.5735 14.5735 14.6353 14.6353 14.9244 14.9244 15.2412 15.2412 15.6610 15.6610 18.9792 18.9792 20.1304 20.1304 20.3120 20.3120 20.7750 20.7750 21.2520 21.2520 k = 0.0202 0.0350-0.0000 ( 4395 PWs) bands (ev): 3.3378 3.3378 5.7665 5.7665 6.6993 6.6993 8.4510 8.4510 8.6306 8.6306 8.8140 8.8140 8.8877 8.8877 9.1914 9.1914 9.4664 9.4664 10.0620 10.0620 10.0968 10.0968 10.2831 10.2831 10.7646 10.7646 10.8337 10.8337 10.9467 10.9467 11.0597 11.0597 11.2747 11.2747 11.4048 11.4048 11.4893 11.4893 11.7184 11.7184 11.7810 11.7810 12.5562 12.5562 12.6471 12.6471 12.9298 12.9298 13.0203 13.0203 13.1540 13.1540 13.4721 13.4721 13.7014 13.7014 13.9345 13.9345 14.1806 14.1806 14.2389 14.2389 14.3538 14.3538 14.4408 14.4408 14.5965 14.5965 14.6527 14.6527 14.9134 14.9134 15.2180 15.2180 15.6061 15.6061 18.9804 18.9804 20.1812 20.1812 20.3329 20.3329 20.7779 20.7779 21.3002 21.3002 k = 0.0101 0.0175-0.0000 ( 4399 PWs) bands (ev): 3.3331 3.3331 5.7692 5.7692 6.7086 6.7086 8.4632 8.4632 8.6596 8.6596 8.8087 8.8087 8.8588 8.8588 9.1894 9.1894 9.4633 9.4633 10.0604 10.0604 10.0943 10.0943 10.2825 10.2825 10.7697 10.7697 10.8326 10.8326 10.9402 10.9402 11.0585 11.0585 11.2744 11.2744 11.4033 11.4033 11.4880 11.4880 11.7167 11.7167 11.7736 11.7736 12.5605 12.5605 12.6398 12.6398 12.9341 12.9341 13.0176 13.0176 13.1598 13.1598 13.4758 13.4758 13.6962 13.6962 13.9341 13.9341 14.1869 14.1869 14.2380 14.2380 14.3571 14.3571 14.4393 14.4393 14.6132 14.6132 14.6673 14.6673 14.9032 14.9032 15.2053 15.2053 15.5705 15.5705 18.9808 18.9808 20.2154 20.2154 20.3428 20.3428 20.7798 20.7798 21.3373 21.3373 k = 0.0000 0.0000 0.0000 ( 4413 PWs) bands (ev): 3.3315 3.3315 5.7701 5.7701 6.7117 6.7117 8.4674 8.4674 8.6713 8.6713 8.8080 8.8080 8.8460 8.8460 9.1887 9.1887 9.4622 9.4622 10.0598 10.0598 10.0935 10.0935 10.2823 10.2823 10.7715 10.7715 10.8322 10.8322 10.9379 10.9379 11.0582 11.0582 11.2744 11.2744 11.4028 11.4028 11.4876 11.4876 11.7162 11.7162 11.7710 11.7710 12.5621 12.5621 12.6371 12.6371 12.9355 12.9355 13.0166 13.0166 13.1618 13.1618 13.4771 13.4771 13.6944 13.6944 13.9339 13.9339 14.1893 14.1893 14.2374 14.2374 14.3582 14.3582 14.4386 14.4386 14.6192 14.6192 14.6732 14.6732 14.8988 14.8988 15.2014 15.2014 15.5580 15.5580 18.9808 18.9808 20.2278 20.2278 20.3454 20.3454 20.7804 20.7804 21.3519 21.3519 k = 0.0000 0.0000 0.0000 ( 4413 PWs) bands (ev): 3.3315 3.3315 5.7701 5.7701 6.7117 6.7117 8.4674 8.4674 8.6713 8.6713 8.8080 8.8080 8.8460 8.8460 9.1887 9.1887 9.4622 9.4622 10.0598 10.0598 10.0935 10.0935 10.2823 10.2823 10.7715 10.7715 10.8322 10.8322 10.9379 10.9379 11.0582 11.0582 11.2744 11.2744 11.4028 11.4028 11.4876 11.4876 11.7162 11.7162 11.7710 11.7710 12.5621 12.5621 12.6371 12.6371 12.9355 12.9355 13.0166 13.0166 13.1618 13.1618 13.4771 13.4771 13.6944 13.6944 13.9339 13.9339 14.1893 14.1893 14.2374 14.2374 14.3582 14.3582 14.4386 14.4386 14.6192 14.6192 14.6732 14.6732 14.8988 14.8988 15.2014 15.2014 15.5580 15.5580 18.9808 18.9808 20.2278 20.2278 20.3454 20.3454 20.7804 20.7804 21.3519 21.3519 k = 0.0000 0.0000 0.0206 ( 4413 PWs) bands (ev): 3.3331 3.3331 5.7708 5.7708 6.7115 6.7115 8.4685 8.4686 8.6724 8.6724 8.8081 8.8103 8.8470 8.8470 9.1885 9.1885 9.4620 9.4620 10.0604 10.0604 10.0903 10.0971 10.2828 10.2828 10.7544 10.7852 10.8305 10.8305 10.9376 10.9376 11.0356 11.0781 11.2733 11.2733 11.3900 11.4087 11.4752 11.4752 11.7283 11.7283 11.7741 11.7768 12.5621 12.5621 12.6331 12.6456 12.9356 12.9380 13.0057 13.0057 13.1712 13.1712 13.4724 13.4724 13.6987 13.6987 13.9341 13.9341 14.1834 14.1834 14.2448 14.2448 14.3525 14.3637 14.4402 14.4402 14.6139 14.6238 14.6740 14.6740 14.9006 14.9006 15.1961 15.2065 15.5518 15.5518 18.9785 18.9785 20.2240 20.2328 20.3468 20.3468 20.7780 20.7780 21.2986 21.2986 k = 0.0000 0.0000 0.0412 ( 4437 PWs) bands (ev): 3.3380 3.3380 5.7729 5.7729 6.7109 6.7109 8.4721 8.4722 8.6756 8.6756 8.8104 8.8147 8.8501 8.8501 9.1880 9.1880 9.4615 9.4615 10.0623 10.0623 10.0876 10.1012 10.2843 10.2843 10.7344 10.7949 10.8257 10.8257 10.9366 10.9366 11.0109 11.0949 11.2700 11.2700 11.3708 11.4091 11.4439 11.4439 11.7584 11.7584 11.7849 11.7911 12.5618 12.5618 12.6336 12.6582 12.9383 12.9431 12.9791 12.9791 13.1935 13.1935 13.4594 13.4594 13.7107 13.7107 13.9347 13.9347 14.1717 14.1717 14.2612 14.2612 14.3465 14.3691 14.4449 14.4449 14.6079 14.6278 14.6763 14.6763 14.9059 14.9059 15.1907 15.2116 15.5333 15.5333 18.9715 18.9715 20.2217 20.2392 20.3509 20.3509 20.7721 20.7721 21.1649 21.1649 k = 0.0000 0.0000 0.0617 ( 4425 PWs) bands (ev): 3.3461 3.3461 5.7764 5.7764 6.7099 6.7099 8.4781 8.4783 8.6810 8.6810 8.8150 8.8214 8.8551 8.8551 9.1872 9.1872 9.4607 9.4607 10.0654 10.0654 10.0852 10.1056 10.2868 10.2868 10.7121 10.8003 10.8176 10.8176 10.9350 10.9350 10.9842 11.1082 11.2646 11.2646 11.3471 11.4030 11.4030 11.4059 11.7973 11.7973 11.8011 11.8124 12.5608 12.5608 12.6390 12.6747 12.9435 12.9459 12.9459 12.9508 13.2205 13.2205 13.4398 13.4398 13.7281 13.7281 13.9356 13.9356 14.1599 14.1599 14.2804 14.2804 14.3403 14.3742 14.4530 14.4530 14.6011 14.6312 14.6802 14.6802 14.9150 14.9150 15.1849 15.2167 15.5033 15.5033 18.9594 18.9594 20.2206 20.2466 20.3574 20.3574 20.7661 20.7661 21.0191 21.0191 k = 0.0000 0.0000 0.0823 ( 4425 PWs) bands (ev): 3.3574 3.3574 5.7813 5.7813 6.7084 6.7084 8.4864 8.4867 8.6883 8.6883 8.8217 8.8303 8.8620 8.8620 9.1861 9.1861 9.4595 9.4595 10.0698 10.0698 10.0833 10.1102 10.2903 10.2903 10.6882 10.8012 10.8064 10.8064 10.9327 10.9327 10.9560 11.1168 11.2571 11.2571 11.3213 11.3583 11.3583 11.4015 11.8203 11.8389 11.8391 11.8391 12.5580 12.5580 12.6493 12.6950 12.9115 12.9115 12.9513 12.9612 13.2484 13.2484 13.4155 13.4155 13.7484 13.7484 13.9366 13.9366 14.1499 14.1499 14.3004 14.3004 14.3337 14.3792 14.4644 14.4644 14.5933 14.6343 14.6856 14.6856 14.9276 14.9276 15.1789 15.2219 15.4631 15.4631 18.9416 18.9416 20.2208 20.2550 20.3657 20.3657 20.7637 20.7637 20.8730 20.8730 k = 0.0000 0.0000 0.1029 ( 4413 PWs) bands (ev): 3.3719 3.3719 5.7876 5.7876 6.7066 6.7066 8.4969 8.4973 8.6976 8.6976 8.8305 8.8412 8.8707 8.8707 9.1849 9.1849 9.4579 9.4579 10.0755 10.0755 10.0816 10.1149 10.2947 10.2947 10.6635 10.7921 10.7921 10.7977 10.9267 10.9298 10.9298 11.1196 11.2468 11.2468 11.2963 11.3137 11.3137 11.3976 11.8402 11.8687 11.8808 11.8808 12.5522 12.5522 12.6647 12.7187 12.8793 12.8793 12.9614 12.9743 13.2756 13.2756 13.3880 13.3880 13.7695 13.7695 13.9378 13.9378 14.1425 14.1425 14.3201 14.3201 14.3268 14.3840 14.4793 14.4793 14.5848 14.6371 14.6922 14.6922 14.9440 14.9440 15.1725 15.2274 15.4145 15.4145 18.9177 18.9177 20.2221 20.2640 20.3752 20.3752 20.7285 20.7285 20.7677 20.7677 k = 0.0000 0.0000 0.1235 ( 4419 PWs) bands (ev): 3.3897 3.3897 5.7952 5.7952 6.7045 6.7045 8.5097 8.5103 8.7086 8.7086 8.8413 8.8541 8.8810 8.8810 9.1837 9.1837 9.4558 9.4558 10.0800 10.0824 10.0824 10.1193 10.3000 10.3000 10.6385 10.7750 10.7750 10.7902 10.8967 10.9260 10.9260 11.1146 11.2300 11.2300 11.2746 11.2746 11.2753 11.3954 11.8592 11.9002 11.9203 11.9203 12.5416 12.5416 12.6851 12.7458 12.8524 12.8524 12.9740 12.9900 13.3015 13.3015 13.3584 13.3584 13.7897 13.7897 13.9387 13.9387 14.1379 14.1379 14.3196 14.3388 14.3388 14.3886 14.4976 14.4976 14.5754 14.6396 14.6999 14.6999 14.9639 14.9639 15.1658 15.2333 15.3598 15.3598 18.8874 18.8874 20.2242 20.2733 20.3845 20.3845 20.5871 20.5871 20.7794 20.7794 k = 0.0000 0.0000 0.1441 ( 4419 PWs) bands (ev): 3.4106 3.4106 5.8040 5.8040 6.7019 6.7019 8.5246 8.5253 8.7213 8.7213 8.8539 8.8689 8.8927 8.8927 9.1827 9.1827 9.4533 9.4533 10.0784 10.0906 10.0906 10.1232 10.3060 10.3060 10.6141 10.7554 10.7554 10.7792 10.8666 10.9213 10.9213 11.1011 11.1986 11.1986 11.2503 11.2503 11.2604 11.3952 11.8762 11.9323 11.9563 11.9563 12.5245 12.5245 12.7105 12.7759 12.8333 12.8333 12.9888 13.0082 13.3180 13.3180 13.3355 13.3355 13.8077 13.8077 13.9391 13.9391 14.1361 14.1361 14.3120 14.3563 14.3563 14.3928 14.5189 14.5189 14.5653 14.6422 14.7082 14.7082 14.9872 14.9872 15.1588 15.2397 15.3018 15.3018 18.8509 18.8509 20.2267 20.2825 20.3870 20.3870 20.4552 20.4552 20.7992 20.7992 k = 0.0000 0.0000 0.1646 ( 4413 PWs) bands (ev): 3.4347 3.4347 5.8141 5.8141 6.6990 6.6990 8.5416 8.5425 8.7354 8.7354 8.8683 8.8853 8.9056 8.9056 9.1821 9.1821 9.4501 9.4501 10.0766 10.1000 10.1000 10.1262 10.3127 10.3127 10.5910 10.7339 10.7339 10.7653 10.8373 10.9154 10.9154 11.0798 11.1577 11.1577 11.2369 11.2369 11.2514 11.3972 11.8904 11.9642 11.9878 11.9878 12.4998 12.4998 12.7407 12.8089 12.8235 12.8235 13.0058 13.0289 13.2906 13.2906 13.3543 13.3543 13.8228 13.8228 13.9387 13.9387 14.1366 14.1366 14.3040 14.3727 14.3727 14.3965 14.5425 14.5425 14.5547 14.6448 14.7162 14.7162 15.0133 15.0133 15.1514 15.2443 15.2443 15.2466 18.8087 18.8087 20.2291 20.2911 20.2990 20.2990 20.4162 20.4162 20.8263 20.8263 k = 0.0000 0.0000 0.1852 ( 4413 PWs) bands (ev): 3.4619 3.4619 5.8254 5.8254 6.6957 6.6957 8.5605 8.5616 8.7505 8.7505 8.8841 8.9032 8.9193 8.9193 9.1821 9.1821 9.4463 9.4463 10.0744 10.1107 10.1107 10.1277 10.3198 10.3198 10.5703 10.7110 10.7110 10.7490 10.8095 10.9079 10.9079 11.0535 11.1153 11.1153 11.2272 11.2272 11.2465 11.4009 11.9015 11.9950 12.0140 12.0140 12.4680 12.4680 12.7751 12.8231 12.8231 12.8445 13.0248 13.0519 13.2571 13.2571 13.3776 13.3776 13.8347 13.8347 13.9372 13.9372 14.1387 14.1387 14.2956 14.3880 14.3880 14.3993 14.5439 14.5670 14.5670 14.6477 14.7225 14.7225 15.0406 15.0406 15.1437 15.1931 15.1931 15.2543 18.7617 18.7617 20.1669 20.1669 20.2310 20.2985 20.4229 20.4229 20.8593 20.8593 k = 0.0000 0.0000 0.2058 ( 4395 PWs) bands (ev): 3.4923 3.4923 5.8378 5.8378 6.6922 6.6922 8.5811 8.5825 8.7664 8.7664 8.9013 8.9224 8.9334 8.9334 9.1833 9.1833 9.4417 9.4417 10.0716 10.1227 10.1227 10.1272 10.3271 10.3271 10.5526 10.6876 10.6876 10.7306 10.7848 10.8987 10.8987 11.0248 11.0738 11.0738 11.2194 11.2194 11.2438 11.4061 11.9096 12.0244 12.0344 12.0344 12.4304 12.4304 12.8134 12.8308 12.8308 12.8825 13.0455 13.0767 13.2231 13.2231 13.4004 13.4004 13.8434 13.8434 13.9345 13.9345 14.1413 14.1413 14.2868 14.4009 14.4023 14.4023 14.5333 14.5900 14.5900 14.6509 14.7259 14.7259 15.0640 15.0640 15.1357 15.1585 15.1585 15.2628 18.7107 18.7107 20.0351 20.0351 20.2315 20.3037 20.4307 20.4307 20.8963 20.8963 k = 0.0000 0.0000 0.2264 ( 4383 PWs) bands (ev): 3.5257 3.5257 5.8512 5.8512 6.6883 6.6883 8.6034 8.6051 8.7825 8.7825 8.9195 8.9425 8.9476 8.9476 9.1859 9.1859 9.4362 9.4362 10.0678 10.1241 10.1358 10.1358 10.3342 10.3342 10.5390 10.6645 10.6645 10.7104 10.7642 10.8874 10.8874 10.9958 11.0344 11.0344 11.2132 11.2132 11.2420 11.4121 11.9147 12.0489 12.0489 12.0521 12.3883 12.3883 12.8447 12.8447 12.8550 12.9226 13.0678 13.1032 13.1896 13.1896 13.4220 13.4220 13.8493 13.8493 13.9305 13.9305 14.1434 14.1434 14.2777 14.4006 14.4153 14.4153 14.5236 14.6072 14.6072 14.6547 14.7268 14.7268 15.0730 15.0730 15.1275 15.1566 15.1566 15.2723 18.6569 18.6569 19.9055 19.9055 20.2297 20.3060 20.4366 20.4366 20.9358 20.9358 k = 0.0000 0.0000 0.2470 ( 4371 PWs) bands (ev): 3.5622 3.5622 5.8655 5.8655 6.6841 6.6841 8.6272 8.6292 8.7984 8.7984 8.9386 8.9617 8.9617 8.9632 9.1903 9.1903 9.4297 9.4297 10.0629 10.1180 10.1502 10.1502 10.3407 10.3407 10.5300 10.6429 10.6429 10.6891 10.7486 10.8736 10.8736 10.9678 10.9976 10.9976 11.2086 11.2086 11.2401 11.4186 11.9174 12.0574 12.0574 12.0779 12.3431 12.3431 12.8626 12.8626 12.8993 12.9646 13.0913 13.1308 13.1576 13.1576 13.4420 13.4420 13.8529 13.8529 13.9250 13.9250 14.1439 14.1439 14.2683 14.3975 14.4263 14.4263 14.5158 14.6110 14.6110 14.6591 14.7306 14.7306 15.0754 15.0754 15.1191 15.1835 15.1835 15.2828 18.6013 18.6013 19.7785 19.7785 20.2241 20.3038 20.4389 20.4389 20.9763 20.9763 k = 0.0000 0.0000 0.2675 ( 4371 PWs) bands (ev): 3.6016 3.6016 5.8808 5.8808 6.6797 6.6797 8.6523 8.6547 8.8134 8.8134 8.9581 8.9754 8.9754 8.9843 9.1969 9.1969 9.4221 9.4221 10.0566 10.1087 10.1655 10.1655 10.3458 10.3458 10.5261 10.6238 10.6238 10.6678 10.7381 10.8571 10.8571 10.9418 10.9641 10.9641 11.2056 11.2056 11.2380 11.4250 11.9180 12.0605 12.0605 12.1019 12.2958 12.2958 12.8815 12.8815 12.9455 13.0081 13.1159 13.1289 13.1289 13.1591 13.4597 13.4597 13.8547 13.8547 13.9181 13.9181 14.1422 14.1422 14.2586 14.3908 14.4332 14.4332 14.5107 14.5984 14.5984 14.6644 14.7439 14.7439 15.0882 15.0882 15.1107 15.2216 15.2216 15.2944 18.5450 18.5450 19.6542 19.6542 20.2133 20.2956 20.4362 20.4362 21.0163 21.0163 k = 0.0000 0.0000 0.2881 ( 4383 PWs) bands (ev): 3.6440 3.6440 5.8967 5.8967 6.6750 6.6750 8.6784 8.6813 8.8267 8.8267 8.9778 8.9887 8.9887 9.0054 9.2058 9.2058 9.4132 9.4132 10.0488 10.0964 10.1818 10.1818 10.3491 10.3491 10.5273 10.6085 10.6085 10.6480 10.7326 10.8380 10.8380 10.9187 10.9341 10.9341 11.2042 11.2042 11.2354 11.4308 11.9172 12.0586 12.0586 12.1242 12.2472 12.2472 12.8973 12.8973 12.9932 13.0526 13.1064 13.1064 13.1411 13.1875 13.4746 13.4746 13.8552 13.8552 13.9097 13.9097 14.1378 14.1378 14.2487 14.3801 14.4318 14.4318 14.5087 14.5795 14.5795 14.6707 14.7655 14.7655 15.1022 15.1141 15.1141 15.2644 15.2644 15.3072 18.4887 18.4887 19.5327 19.5327 20.1953 20.2792 20.4266 20.4266 21.0549 21.0549 k = 0.0000 0.0000 0.3087 ( 4407 PWs) bands (ev): 3.6894 3.6894 5.9133 5.9133 6.6701 6.6701 8.7055 8.7089 8.8374 8.8374 8.9973 9.0020 9.0020 9.0260 9.2170 9.2170 9.4029 9.4029 10.0394 10.0813 10.1988 10.1988 10.3500 10.3500 10.5334 10.5981 10.5981 10.6306 10.7322 10.8167 10.8167 10.8991 10.9080 10.9080 11.2042 11.2042 11.2322 11.4355 11.9158 12.0525 12.0525 12.1448 12.1977 12.1977 12.9047 12.9047 13.0416 13.0947 13.0947 13.0978 13.1667 13.2156 13.4857 13.4857 13.8548 13.8548 13.8995 13.8995 14.1303 14.1303 14.2386 14.3656 14.4175 14.4175 14.5098 14.5680 14.5680 14.6780 14.7915 14.7915 15.0939 15.1506 15.1506 15.3099 15.3099 15.3213 18.4333 18.4333 19.4141 19.4141 20.1675 20.2520 20.4081 20.4081 20.9726 21.0373 k = 0.0000 0.0000 0.3293 ( 4407 PWs) bands (ev): 3.7375 3.7375 5.9305 5.9305 6.6650 6.6650 8.7333 8.7372 8.8448 8.8448 9.0157 9.0157 9.0163 9.0457 9.2302 9.2302 9.3911 9.3911 10.0284 10.0642 10.2161 10.2161 10.3486 10.3486 10.5439 10.5928 10.5928 10.6164 10.7370 10.7940 10.7940 10.8837 10.8855 10.8855 11.2056 11.2056 11.2288 11.4387 11.9142 12.0427 12.0427 12.1479 12.1479 12.1642 12.8992 12.8992 13.0901 13.0972 13.0972 13.1432 13.1925 13.2429 13.4925 13.4925 13.8540 13.8540 13.8874 13.8874 14.1199 14.1199 14.2285 14.3478 14.3913 14.3913 14.5133 14.5690 14.5690 14.6865 14.8198 14.8198 15.0859 15.1946 15.1946 15.3366 15.3575 15.3575 18.3796 18.3796 19.2985 19.2985 20.1274 20.2106 20.3786 20.3786 20.7911 20.8564 k = 0.0000 0.0000 0.3499 ( 4382 PWs) bands (ev): 3.7885 3.7885 5.9480 5.9480 6.6597 6.6597 8.7615 8.7660 8.8484 8.8484 9.0301 9.0301 9.0344 9.0643 9.2447 9.2447 9.3774 9.3774 10.0159 10.0457 10.2330 10.2330 10.3459 10.3459 10.5581 10.5926 10.5926 10.6062 10.7471 10.7709 10.7709 10.8668 10.8668 10.8729 11.2081 11.2081 11.2252 11.4400 11.9134 12.0301 12.0301 12.0983 12.0983 12.1825 12.8816 12.8816 13.1123 13.1123 13.1381 13.1883 13.2181 13.2687 13.4944 13.4944 13.8525 13.8525 13.8735 13.8735 14.1069 14.1069 14.2184 14.3275 14.3601 14.3601 14.5189 14.5793 14.5793 14.6962 14.8498 14.8498 15.0784 15.2438 15.2438 15.3534 15.4066 15.4066 18.3280 18.3280 19.1858 19.1858 20.0724 20.1515 20.3361 20.3361 20.6139 20.6756 k = 0.0000 0.0000 0.3704 ( 4382 PWs) bands (ev): 3.8422 3.8422 5.9658 5.9658 6.6543 6.6543 8.7899 8.7951 8.8480 8.8480 9.0453 9.0453 9.0512 9.0812 9.2599 9.2599 9.3619 9.3619 10.0021 10.0263 10.2483 10.2483 10.3437 10.3437 10.5754 10.5961 10.5961 10.6005 10.7483 10.7483 10.7624 10.8524 10.8524 10.8669 11.2115 11.2115 11.2218 11.4391 11.9137 12.0147 12.0147 12.0497 12.0497 12.1999 12.8563 12.8563 13.1350 13.1350 13.1850 13.2325 13.2433 13.2926 13.4911 13.4911 13.8469 13.8469 13.8609 13.8609 14.0922 14.0922 14.2085 14.3051 14.3295 14.3295 14.5260 14.5950 14.5950 14.7071 14.8813 14.8813 15.0716 15.2962 15.2962 15.3715 15.4568 15.4568 18.2791 18.2791 19.0762 19.0762 20.0007 20.0714 20.2791 20.2791 20.4429 20.4955 k = 0.0000 0.0000 0.3910 ( 4388 PWs) bands (ev): 3.8986 3.8986 5.9837 5.9837 6.6488 6.6488 8.8182 8.8241 8.8439 8.8439 9.0611 9.0611 9.0665 9.0961 9.2750 9.2750 9.3442 9.3442 9.9872 10.0067 10.2604 10.2604 10.3446 10.3446 10.5954 10.5996 10.6018 10.6018 10.7264 10.7264 10.7829 10.8436 10.8436 10.8661 11.2155 11.2155 11.2191 11.4356 11.9159 11.9929 11.9929 12.0069 12.0069 12.2168 12.8269 12.8269 13.1612 13.1612 13.2301 13.2681 13.2751 13.3142 13.4829 13.4829 13.8304 13.8304 13.8562 13.8562 14.0768 14.0768 14.1988 14.2811 14.3021 14.3021 14.5343 14.6141 14.6141 14.7191 14.9141 14.9141 15.0660 15.3506 15.3506 15.3910 15.5081 15.5081 18.2332 18.2332 18.9696 18.9696 19.9116 19.9682 20.2068 20.2068 20.2794 20.3170 k = 0.0000 0.0000 0.4116 ( 4388 PWs) bands (ev): 3.9575 3.9575 6.0015 6.0015 6.6432 6.6432 8.8363 8.8363 8.8462 8.8529 9.0773 9.0773 9.0799 9.1088 9.2892 9.2892 9.3242 9.3242 9.9717 9.9874 10.2676 10.2676 10.3511 10.3511 10.6040 10.6080 10.6080 10.6175 10.7053 10.7053 10.8085 10.8419 10.8419 10.8701 11.2178 11.2196 11.2196 11.4295 11.9203 11.9515 11.9515 11.9841 11.9841 12.2334 12.7956 12.7956 13.1883 13.1883 13.2715 13.2934 13.3146 13.3343 13.4700 13.4700 13.8080 13.8080 13.8542 13.8542 14.0616 14.0616 14.1893 14.2558 14.2786 14.2786 14.5437 14.6353 14.6353 14.7320 14.9482 14.9482 15.0619 15.4059 15.4059 15.4119 15.5602 15.5602 18.1905 18.1905 18.8661 18.8661 19.8061 19.8431 20.1190 20.1190 20.1232 20.1407 k = 0.0000 0.0000 0.4322 ( 4388 PWs) bands (ev): 4.0190 4.0190 6.0191 6.0191 6.6376 6.6376 8.8256 8.8256 8.8736 8.8811 9.0912 9.0935 9.0935 9.1191 9.3013 9.3013 9.3024 9.3024 9.9557 9.9687 10.2701 10.2701 10.3634 10.3634 10.6134 10.6134 10.6138 10.6416 10.6850 10.6850 10.8390 10.8490 10.8490 10.8783 11.2188 11.2236 11.2236 11.4210 11.9076 11.9076 11.9272 11.9654 11.9654 12.2498 12.7638 12.7638 13.2145 13.2145 13.3042 13.3236 13.3422 13.3607 13.4531 13.4531 13.7828 13.7828 13.8519 13.8519 14.0475 14.0475 14.1802 14.2294 14.2587 14.2587 14.5539 14.6583 14.6583 14.7453 14.9836 14.9836 15.0600 15.4342 15.4611 15.4611 15.6129 15.6129 18.1513 18.1513 18.7658 18.7658 19.6865 19.7010 19.9668 19.9716 20.0127 20.0127 k = 0.0000 0.0000 0.4527 ( 4388 PWs) bands (ev): 4.0828 4.0828 6.0362 6.0362 6.6319 6.6319 8.8123 8.8123 8.9003 8.9085 9.1003 9.1091 9.1091 9.1268 9.2768 9.2768 9.3128 9.3128 9.9396 9.9510 10.2700 10.2700 10.3796 10.3796 10.6170 10.6170 10.6289 10.6664 10.6664 10.6675 10.8653 10.8653 10.8741 10.8897 11.2233 11.2269 11.2269 11.4103 11.8662 11.8662 11.9366 11.9469 11.9469 12.2663 12.7321 12.7321 13.2389 13.2389 13.3272 13.3557 13.3589 13.3948 13.4328 13.4328 13.7558 13.7558 13.8485 13.8485 14.0344 14.0344 14.1713 14.2022 14.2419 14.2419 14.5650 14.6827 14.6827 14.7584 15.0202 15.0202 15.0611 15.4578 15.5158 15.5158 15.6661 15.6661 18.1156 18.1156 18.6688 18.6688 19.5483 19.5560 19.7957 19.8212 19.8658 19.8658 k = 0.0000 0.0000 0.4733 ( 4376 PWs) bands (ev): 4.1490 4.1490 6.0527 6.0527 6.6262 6.6262 8.7967 8.7967 8.9259 8.9348 9.1071 9.1240 9.1240 9.1320 9.2493 9.2493 9.3212 9.3212 9.9237 9.9344 10.2692 10.2692 10.3977 10.3977 10.6160 10.6160 10.6494 10.6533 10.6533 10.6954 10.8903 10.8903 10.9028 10.9135 11.2291 11.2291 11.2326 11.3978 11.8282 11.8282 11.9288 11.9288 11.9486 12.2829 12.7013 12.7013 13.2608 13.2608 13.3460 13.3637 13.3931 13.4097 13.4097 13.4274 13.7279 13.7279 13.8436 13.8436 14.0221 14.0221 14.1627 14.1744 14.2278 14.2278 14.5767 14.7081 14.7081 14.7707 15.0580 15.0580 15.0661 15.4828 15.5694 15.5694 15.7195 15.7195 18.0832 18.0832 18.5750 18.5750 19.3905 19.4179 19.6274 19.6699 19.7039 19.7039 k = 0.0000 0.0000 0.4939 ( 4376 PWs) bands (ev): 4.2173 4.2173 6.0682 6.0682 6.6206 6.6206 8.7789 8.7789 8.9501 8.9599 9.1116 9.1347 9.1376 9.1376 9.2195 9.2195 9.3271 9.3271 9.9084 9.9193 10.2684 10.2684 10.4164 10.4164 10.6057 10.6057 10.6520 10.6520 10.6747 10.7250 10.9162 10.9227 10.9227 10.9567 11.2294 11.2294 11.2484 11.3845 11.7944 11.7944 11.9115 11.9115 11.9631 12.2999 12.6716 12.6716 13.2797 13.2797 13.3621 13.3675 13.3843 13.3843 13.4243 13.4567 13.6999 13.6999 13.8373 13.8373 14.0100 14.0100 14.1462 14.1541 14.2159 14.2159 14.5890 14.7343 14.7343 14.7813 15.0757 15.0968 15.0968 15.5090 15.6216 15.6216 15.7730 15.7730 18.0542 18.0542 18.4848 18.4848 19.2313 19.2753 19.4618 19.5173 19.5439 19.5439 k = 0.0000 0.0000 0.5145 ( 4394 PWs) bands (ev): 4.2877 4.2877 6.0826 6.0826 6.6150 6.6150 8.7593 8.7593 8.9728 8.9833 9.1140 9.1353 9.1491 9.1491 9.1880 9.1880 9.3302 9.3302 9.8938 9.9056 10.2682 10.2682 10.4344 10.4344 10.5901 10.5901 10.6605 10.6605 10.7044 10.7559 10.9288 10.9613 10.9613 11.0030 11.2276 11.2276 11.2716 11.3713 11.7657 11.7657 11.8952 11.8952 11.9799 12.3172 12.6435 12.6435 13.2951 13.2951 13.3572 13.3572 13.3672 13.3754 13.4516 13.4822 13.6723 13.6723 13.8296 13.8296 13.9977 13.9977 14.1177 14.1455 14.2059 14.2059 14.6019 14.7612 14.7612 14.7895 15.0908 15.1364 15.1364 15.5363 15.6723 15.6723 15.8263 15.8263 18.0282 18.0282 18.3982 18.3982 19.0730 19.1311 19.2991 19.3638 19.3875 19.3875 k = 0.0000 0.0000 0.5351 ( 4406 PWs) bands (ev): 4.3601 4.3601 6.0956 6.0956 6.6095 6.6095 8.7378 8.7378 8.9938 9.0049 9.1145 9.1339 9.1456 9.1456 9.1680 9.1680 9.3309 9.3309 9.8803 9.8935 10.2684 10.2684 10.4502 10.4502 10.5752 10.5752 10.6749 10.6749 10.7377 10.7870 10.9411 11.0049 11.0049 11.0514 11.2230 11.2230 11.3030 11.3597 11.7423 11.7423 11.8806 11.8806 11.9987 12.3349 12.6172 12.6172 13.3057 13.3057 13.3297 13.3297 13.3631 13.3858 13.4749 13.5033 13.6457 13.6457 13.8207 13.8207 13.9846 13.9846 14.0892 14.1365 14.1975 14.1975 14.6152 14.7884 14.7884 14.7951 15.1116 15.1768 15.1768 15.5648 15.7212 15.7212 15.8790 15.8790 18.0047 18.0047 18.3156 18.3156 18.9173 18.9873 19.1396 19.2106 19.2355 19.2355 k = 0.0000 0.0000 0.5556 ( 4406 PWs) bands (ev): 4.4342 4.4342 6.1070 6.1070 6.6041 6.6041 8.7146 8.7146 9.0128 9.0244 9.1123 9.1123 9.1134 9.1311 9.1744 9.1744 9.3291 9.3291 9.8680 9.8830 10.2691 10.2691 10.4616 10.4616 10.5649 10.5649 10.6938 10.6938 10.7735 10.8158 10.9550 11.0523 11.0523 11.1000 11.2156 11.2156 11.3424 11.3524 11.7245 11.7245 11.8682 11.8682 12.0195 12.3529 12.5930 12.5930 13.2935 13.2935 13.3196 13.3196 13.3552 13.3931 13.4939 13.5200 13.6203 13.6203 13.8108 13.8108 13.9706 13.9706 14.0608 14.1269 14.1903 14.1903 14.6288 14.7980 14.8157 14.8157 15.1382 15.2177 15.2177 15.5941 15.7684 15.7684 15.9308 15.9308 17.9830 17.9830 18.2377 18.2377 18.7653 18.8458 18.9835 19.0586 19.0885 19.0885 k = 0.0000 0.0000 0.5762 ( 4418 PWs) bands (ev): 4.5100 4.5100 6.1163 6.1163 6.5989 6.5989 8.6898 8.6898 9.0294 9.0413 9.0746 9.0746 9.1112 9.1273 9.1824 9.1824 9.3254 9.3254 9.8572 9.8742 10.2700 10.2700 10.4657 10.4657 10.5627 10.5627 10.7166 10.7166 10.8104 10.8385 10.9747 11.1020 11.1020 11.1455 11.2061 11.2061 11.3536 11.3891 11.7121 11.7121 11.8587 11.8587 12.0419 12.3714 12.5711 12.5711 13.2625 13.2625 13.3233 13.3233 13.3438 13.3971 13.5086 13.5320 13.5962 13.5962 13.8002 13.8002 13.9554 13.9554 14.0327 14.1163 14.1840 14.1840 14.6426 14.7986 14.8428 14.8428 15.1701 15.2589 15.2589 15.6243 15.8139 15.8139 15.9815 15.9815 17.9617 17.9617 18.1654 18.1654 18.6176 18.7080 18.8312 18.9090 18.9469 18.9469 k = 0.0000 0.0000 0.5968 ( 4406 PWs) bands (ev): 4.5873 4.5873 6.1233 6.1233 6.5938 6.5938 8.6631 8.6631 9.0357 9.0357 9.0433 9.0552 9.1085 9.1234 9.1895 9.1895 9.3199 9.3199 9.8479 9.8669 10.2712 10.2712 10.4621 10.4621 10.5694 10.5694 10.7427 10.7427 10.8465 10.8521 11.0035 11.1487 11.1487 11.1830 11.1991 11.1991 11.3694 11.4419 11.7044 11.7044 11.8528 11.8528 12.0658 12.3901 12.5516 12.5516 13.2289 13.2289 13.3246 13.3246 13.3292 13.3974 13.5189 13.5393 13.5736 13.5736 13.7891 13.7891 13.9392 13.9392 14.0052 14.1045 14.1782 14.1782 14.6564 14.7975 14.8695 14.8695 15.2066 15.3002 15.3002 15.6551 15.8576 15.8576 16.0307 16.0307 17.9382 17.9382 18.1012 18.1012 18.4750 18.5748 18.6833 18.7629 18.8112 18.8112 k = 0.0000 0.0000 0.6174 ( 4400 PWs) bands (ev): 4.6658 4.6658 6.1277 6.1277 6.5890 6.5890 8.6348 8.6348 8.9966 8.9966 9.0538 9.0652 9.1064 9.1205 9.1953 9.1953 9.3130 9.3130 9.8403 9.8612 10.2727 10.2727 10.4535 10.4535 10.5820 10.5820 10.7712 10.7712 10.8570 10.8796 11.0414 11.1620 11.1620 11.2101 11.2245 11.2245 11.4038 11.4998 11.7004 11.7004 11.8515 11.8515 12.0910 12.4089 12.5348 12.5348 13.1939 13.1939 13.3116 13.3225 13.3225 13.3938 13.5251 13.5418 13.5522 13.5522 13.7779 13.7779 13.9220 13.9220 13.9782 14.0912 14.1726 14.1726 14.6699 14.7952 14.8954 14.8954 15.2470 15.3415 15.3415 15.6863 15.8996 15.8996 16.0782 16.0782 17.9084 17.9084 18.0487 18.0487 18.3379 18.4473 18.5402 18.6213 18.6817 18.6817 k = 0.0000 0.0000 0.6380 ( 4388 PWs) bands (ev): 4.7454 4.7454 6.1291 6.1291 6.5843 6.5843 8.6047 8.6047 8.9581 8.9581 9.0598 9.0702 9.1061 9.1199 9.2000 9.2000 9.3051 9.3051 9.8344 9.8569 10.2745 10.2745 10.4433 10.4433 10.5976 10.5976 10.8016 10.8016 10.8559 10.9066 11.0858 11.1482 11.1482 11.2313 11.2756 11.2756 11.4544 11.5618 11.6994 11.6994 11.8553 11.8553 12.1174 12.4277 12.5207 12.5207 13.1580 13.1580 13.2915 13.3171 13.3171 13.3861 13.5273 13.5320 13.5320 13.5398 13.7667 13.7667 13.9040 13.9040 13.9521 14.0761 14.1671 14.1671 14.6831 14.7923 14.9204 14.9204 15.2907 15.3823 15.3823 15.7177 15.9397 15.9397 16.1237 16.1237 17.8688 17.8688 18.0111 18.0111 18.2068 18.3261 18.4024 18.4852 18.5590 18.5590 k = 0.0000 0.0000 0.6585 ( 4388 PWs) bands (ev): 4.8258 4.8258 6.1271 6.1271 6.5799 6.5799 8.5731 8.5731 8.9209 8.9209 9.0610 9.0700 9.1084 9.1222 9.2036 9.2036 9.2965 9.2965 9.8301 9.8538 10.2766 10.2766 10.4331 10.4331 10.6142 10.6142 10.8328 10.8328 10.8513 10.9254 11.1298 11.1298 11.1344 11.2536 11.3293 11.3293 11.5154 11.6269 11.7008 11.7008 11.8648 11.8648 12.1449 12.4463 12.5093 12.5093 13.1214 13.1214 13.2691 13.3086 13.3086 13.3742 13.5126 13.5126 13.5259 13.5336 13.7557 13.7557 13.8856 13.8856 13.9270 14.0589 14.1614 14.1614 14.6956 14.7890 14.9442 14.9442 15.3371 15.4227 15.4227 15.7489 15.9780 15.9780 16.1669 16.1669 17.8209 17.8209 17.9862 17.9862 18.0822 18.2118 18.2705 18.3555 18.4435 18.4435 k = 0.0000 0.0000 0.6791 ( 4418 PWs) bands (ev): 4.9068 4.9068 6.1214 6.1214 6.5757 6.5757 8.5400 8.5400 8.8859 8.8859 9.0584 9.0661 9.1126 9.1262 9.2062 9.2062 9.2876 9.2876 9.8273 9.8520 10.2791 10.2791 10.4238 10.4238 10.6308 10.6308 10.8449 10.8642 10.8642 10.9348 11.1099 11.1099 11.1851 11.2816 11.3814 11.3814 11.5824 11.6941 11.7048 11.7048 11.8797 11.8797 12.1732 12.4643 12.5008 12.5008 13.0847 13.0847 13.2447 13.2971 13.2971 13.3580 13.4938 13.4938 13.5211 13.5234 13.7451 13.7451 13.8669 13.8669 13.9030 14.0398 14.1555 14.1555 14.7074 14.7858 14.9666 14.9666 15.3855 15.4621 15.4621 15.7797 16.0144 16.0144 16.2077 16.2077 17.7695 17.7695 17.9643 17.9683 17.9683 18.1046 18.1452 18.2332 18.3361 18.3361 k = 0.0000 0.0000 0.6997 ( 4412 PWs) bands (ev): 4.9882 4.9882 6.1116 6.1116 6.5719 6.5719 8.5061 8.5061 8.8535 8.8535 9.0537 9.0603 9.1174 9.1306 9.2080 9.2080 9.2785 9.2785 9.8261 9.8510 10.2818 10.2818 10.4158 10.4158 10.6470 10.6470 10.8378 10.8950 10.8950 10.9357 11.0897 11.0897 11.2367 11.3156 11.4292 11.4292 11.6527 11.7127 11.7127 11.7625 11.8995 11.8995 12.2023 12.4815 12.4951 12.4951 13.0482 13.0482 13.2188 13.2828 13.2828 13.3377 13.4753 13.4753 13.5099 13.5133 13.7351 13.7351 13.8484 13.8484 13.8804 14.0186 14.1495 14.1495 14.7182 14.7828 14.9875 14.9875 15.4355 15.5004 15.5004 15.8094 16.0488 16.0488 16.2458 16.2458 17.7184 17.7184 17.8536 17.9523 17.9523 18.0036 18.0285 18.1191 18.2384 18.2384 k = 0.0000 0.0000 0.7203 ( 4412 PWs) bands (ev): 5.0695 5.0695 6.0973 6.0973 6.5683 6.5683 8.4718 8.4718 8.8241 8.8241 9.0480 9.0536 9.1220 9.1345 9.2091 9.2091 9.2697 9.2697 9.8260 9.8508 10.2848 10.2848 10.4091 10.4091 10.6623 10.6623 10.8307 10.9244 10.9244 10.9301 11.0698 11.0698 11.2881 11.3540 11.4703 11.4703 11.7247 11.7260 11.7260 11.8311 11.9231 11.9231 12.2321 12.4922 12.4922 12.4974 13.0125 13.0125 13.1917 13.2663 13.2663 13.3133 13.4570 13.4570 13.4938 13.5031 13.7257 13.7257 13.8303 13.8303 13.8594 13.9956 14.1433 14.1433 14.7280 14.7801 15.0066 15.0066 15.4865 15.5372 15.5372 15.8377 16.0812 16.0812 16.2810 16.2810 17.6694 17.6694 17.7505 17.9034 17.9267 17.9330 17.9330 18.0141 18.1530 18.1530 k = 0.0000 0.0000 0.7409 ( 4418 PWs) bands (ev): 5.1505 5.1505 6.0784 6.0784 6.5651 6.5651 8.4379 8.4379 8.7979 8.7979 9.0421 9.0468 9.1261 9.1377 9.2097 9.2097 9.2612 9.2612 9.8271 9.8511 10.2880 10.2880 10.4037 10.4037 10.6766 10.6766 10.8240 10.9203 10.9518 10.9518 11.0507 11.0507 11.3382 11.3945 11.5024 11.5024 11.7462 11.7462 11.7969 11.8989 11.9495 11.9495 12.2625 12.4920 12.4920 12.5114 12.9780 12.9780 13.1639 13.2479 13.2479 13.2854 13.4387 13.4387 13.4758 13.4906 13.7169 13.7169 13.8133 13.8133 13.8404 13.9711 14.1371 14.1371 14.7366 14.7779 15.0239 15.0239 15.5379 15.5722 15.5722 15.8638 16.1113 16.1113 16.3131 16.3131 17.6238 17.6238 17.6557 17.8020 17.8424 17.9045 17.9045 17.9189 18.0848 18.0848 k = 0.0000 0.0000 0.7614 ( 4418 PWs) bands (ev): 5.2308 5.2308 6.0545 6.0545 6.5622 6.5622 8.4054 8.4054 8.7750 8.7750 9.0363 9.0402 9.1296 9.1401 9.2099 9.2099 9.2533 9.2533 9.8291 9.8517 10.2913 10.2913 10.3995 10.3995 10.6898 10.6898 10.8184 10.9078 10.9766 10.9766 11.0331 11.0331 11.3861 11.4348 11.5250 11.5250 11.7730 11.7730 11.8682 11.9646 11.9774 11.9774 12.2932 12.4943 12.4943 12.5231 12.9452 12.9452 13.1362 13.2283 13.2283 13.2543 13.4206 13.4206 13.4569 13.4765 13.7088 13.7088 13.7975 13.7975 13.8235 13.9457 14.1311 14.1311 14.7441 14.7761 15.0392 15.0392 15.5894 15.6048 15.6048 15.8868 16.1389 16.1389 16.3417 16.3417 17.5700 17.5822 17.5822 17.7061 17.7700 17.8340 17.8622 17.8622 18.0365 18.0365 k = 0.0000 0.0000 0.7820 ( 4412 PWs) bands (ev): 5.3100 5.3100 6.0254 6.0254 6.5597 6.5597 8.3751 8.3751 8.7554 8.7554 9.0309 9.0341 9.1325 9.1418 9.2098 9.2098 9.2461 9.2461 9.8317 9.8524 10.2945 10.2945 10.3963 10.3963 10.7016 10.7016 10.8139 10.8941 10.9968 10.9968 11.0188 11.0188 11.4308 11.4729 11.5395 11.5395 11.8042 11.8042 11.9374 12.0055 12.0055 12.0268 12.3242 12.4989 12.4989 12.5317 12.9146 12.9146 13.1092 13.2081 13.2081 13.2209 13.4028 13.4028 13.4382 13.4613 13.7014 13.7014 13.7836 13.7836 13.8093 13.9200 14.1254 14.1254 14.7504 14.7746 15.0526 15.0526 15.6346 15.6346 15.6403 15.9060 16.1640 16.1640 16.3669 16.3669 17.4942 17.5453 17.5453 17.6181 17.7076 17.7598 17.8103 17.8103 18.0013 18.0013 k = 0.0000 0.0000 0.8026 ( 4442 PWs) bands (ev): 5.3877 5.3877 5.9911 5.9911 6.5575 6.5575 8.3479 8.3479 8.7389 8.7389 9.0261 9.0287 9.1348 9.1428 9.2095 9.2095 9.2398 9.2398 9.8347 9.8529 10.2976 10.2976 10.3939 10.3939 10.7119 10.7119 10.8110 10.8801 10.9976 10.9976 11.0226 11.0226 11.4713 11.5072 11.5482 11.5482 11.8365 11.8365 12.0029 12.0325 12.0325 12.0837 12.3550 12.5053 12.5053 12.5366 12.8869 12.8869 13.0841 13.1860 13.1884 13.1884 13.3857 13.3857 13.4209 13.4455 13.6947 13.6947 13.7717 13.7717 13.7981 13.8946 14.1202 14.1202 14.7556 14.7735 15.0640 15.0640 15.6611 15.6611 15.6899 15.9202 16.1861 16.1861 16.3882 16.3882 17.4296 17.5135 17.5135 17.5391 17.6552 17.6965 17.7571 17.7571 17.9687 17.9687 k = 0.0000 0.0000 0.8232 ( 4442 PWs) bands (ev): 5.4634 5.4634 5.9515 5.9515 6.5557 6.5557 8.3245 8.3245 8.7256 8.7256 9.0220 9.0241 9.1367 9.1432 9.2092 9.2092 9.2345 9.2345 9.8380 9.8531 10.3003 10.3003 10.3922 10.3922 10.7207 10.7207 10.8098 10.8665 10.9865 10.9865 11.0372 11.0372 11.5068 11.5363 11.5531 11.5531 11.8667 11.8667 12.0571 12.0571 12.0633 12.1333 12.3854 12.5129 12.5129 12.5372 12.8625 12.8625 13.0623 13.1509 13.1701 13.1701 13.3701 13.3701 13.4060 13.4300 13.6888 13.6888 13.7621 13.7621 13.7903 13.8704 14.1157 14.1157 14.7599 14.7726 15.0733 15.0733 15.6838 15.6838 15.7374 15.9284 16.2049 16.2049 16.4057 16.4057 17.3774 17.4700 17.4872 17.4872 17.6127 17.6443 17.7087 17.7087 17.9358 17.9358 k = 0.0000 0.0000 0.8438 ( 4442 PWs) bands (ev): 5.5366 5.5366 5.9068 5.9068 6.5543 6.5543 8.3056 8.3056 8.7153 8.7153 9.0189 9.0204 9.1383 9.1432 9.2088 9.2088 9.2303 9.2303 9.8412 9.8530 10.3027 10.3027 10.3911 10.3911 10.7277 10.7277 10.8104 10.8537 10.9767 10.9767 11.0494 11.0494 11.5363 11.5558 11.5558 11.5591 11.8926 11.8926 12.0778 12.0778 12.1165 12.1730 12.4148 12.5208 12.5208 12.5329 12.8422 12.8422 13.0458 13.1171 13.1543 13.1543 13.3567 13.3567 13.3946 13.4154 13.6838 13.6838 13.7548 13.7548 13.7863 13.8480 14.1120 14.1120 14.7632 14.7718 15.0805 15.0805 15.7021 15.7021 15.7819 15.9296 16.2202 16.2202 16.4192 16.4192 17.3387 17.4116 17.4665 17.4665 17.5803 17.6031 17.6686 17.6686 17.9064 17.9064 k = 0.0000 0.0000 0.8643 ( 4442 PWs) bands (ev): 5.6067 5.6067 5.8574 5.8574 6.5533 6.5533 8.2917 8.2917 8.7080 8.7080 9.0166 9.0176 9.1396 9.1429 9.2085 9.2085 9.2272 9.2272 9.8443 9.8523 10.3045 10.3045 10.3904 10.3904 10.7329 10.7329 10.8129 10.8422 10.9693 10.9693 11.0584 11.0584 11.5572 11.5572 11.5593 11.5748 11.9122 11.9122 12.0937 12.0937 12.1604 12.2004 12.4427 12.5236 12.5277 12.5277 12.8268 12.8268 13.0362 13.0866 13.1420 13.1420 13.3463 13.3463 13.3873 13.4028 13.6801 13.6801 13.7497 13.7497 13.7864 13.8284 14.1092 14.1092 14.7657 14.7711 15.0857 15.0857 15.7156 15.7156 15.8224 15.9233 16.2315 16.2315 16.4288 16.4288 17.3144 17.3649 17.4518 17.4518 17.5580 17.5728 17.6386 17.6386 17.8840 17.8840 k = 0.0000 0.0000 0.8849 ( 4442 PWs) bands (ev): 5.6719 5.6719 5.8045 5.8045 6.5527 6.5527 8.2833 8.2833 8.7036 8.7036 9.0153 9.0158 9.1407 9.1424 9.2083 9.2083 9.2253 9.2253 9.8470 9.8511 10.3056 10.3056 10.3900 10.3900 10.7361 10.7361 10.8174 10.8321 10.9647 10.9647 11.0638 11.0638 11.5579 11.5579 11.5749 11.5828 11.9245 11.9245 12.1036 12.1036 12.1925 12.2133 12.4682 12.5094 12.5326 12.5326 12.8172 12.8172 13.0354 13.0615 13.1342 13.1342 13.3397 13.3397 13.3847 13.3929 13.6777 13.6777 13.7467 13.7467 13.7907 13.8120 14.1075 14.1075 14.7677 14.7702 15.0888 15.0888 15.7239 15.7239 15.8578 15.9090 16.2384 16.2384 16.4345 16.4345 17.3051 17.3310 17.4430 17.4430 17.5460 17.5533 17.6201 17.6201 17.8702 17.8702 k = 0.0000 0.0000 0.9055 ( 4430 PWs) bands (ev): 5.7160 5.7160 5.7646 5.7646 6.5525 6.5525 8.2804 8.2804 8.7021 8.7021 9.0151 9.0151 9.1417 9.1417 9.2083 9.2083 9.2247 9.2247 9.8493 9.8493 10.3059 10.3059 10.3898 10.3898 10.7371 10.7371 10.8239 10.8239 10.9632 10.9632 11.0656 11.0656 11.5581 11.5581 11.5828 11.5828 11.9286 11.9286 12.1070 12.1070 12.2106 12.2106 12.4907 12.4907 12.5343 12.5343 12.8138 12.8138 13.0439 13.0439 13.1316 13.1316 13.3374 13.3374 13.3867 13.3867 13.6769 13.6769 13.7457 13.7457 13.7993 13.7993 14.1069 14.1069 14.7691 14.7691 15.0898 15.0898 15.7267 15.7267 15.8869 15.8869 16.2408 16.2408 16.4364 16.4364 17.3108 17.3108 17.4401 17.4401 17.5444 17.5444 17.6138 17.6138 17.8655 17.8655 k = 0.0000 0.0000 0.9055 ( 4430 PWs) bands (ev): 5.7160 5.7160 5.7646 5.7646 6.5525 6.5525 8.2804 8.2804 8.7021 8.7021 9.0151 9.0151 9.1417 9.1417 9.2083 9.2083 9.2247 9.2247 9.8493 9.8493 10.3059 10.3059 10.3898 10.3898 10.7371 10.7371 10.8239 10.8239 10.9632 10.9632 11.0656 11.0656 11.5581 11.5581 11.5828 11.5828 11.9286 11.9286 12.1070 12.1070 12.2106 12.2106 12.4907 12.4907 12.5343 12.5343 12.8138 12.8138 13.0439 13.0439 13.1316 13.1316 13.3374 13.3374 13.3867 13.3867 13.6769 13.6769 13.7457 13.7457 13.7993 13.7993 14.1069 14.1069 14.7691 14.7691 15.0898 15.0898 15.7267 15.7267 15.8869 15.8869 16.2408 16.2408 16.4364 16.4364 17.3108 17.3108 17.4401 17.4401 17.5444 17.5444 17.6138 17.6138 17.8655 17.8655 k = 0.0179 0.0103 0.9055 ( 4450 PWs) bands (ev): 5.7160 5.7160 5.7657 5.7657 6.5519 6.5519 8.2800 8.2800 8.6936 8.6936 9.0163 9.0164 9.1436 9.1441 9.2011 9.2019 9.2386 9.2389 9.8492 9.8492 10.3005 10.3010 10.3962 10.3966 10.7365 10.7366 10.8236 10.8236 10.9629 10.9629 11.0661 11.0661 11.5519 11.5520 11.5876 11.5877 11.9282 11.9283 12.1052 12.1052 12.2093 12.2094 12.4910 12.4910 12.5346 12.5346 12.8150 12.8151 13.0431 13.0431 13.1315 13.1315 13.3355 13.3356 13.3881 13.3882 13.6747 13.6751 13.7448 13.7454 13.8020 13.8021 14.1036 14.1037 14.7703 14.7706 15.0881 15.0883 15.7212 15.7213 15.8759 15.8760 16.2435 16.2435 16.4487 16.4488 17.3142 17.3145 17.4438 17.4443 17.5479 17.5483 17.6172 17.6178 17.8683 17.8685 k = 0.0357 0.0206 0.9055 ( 4452 PWs) bands (ev): 5.7158 5.7158 5.7690 5.7690 6.5500 6.5500 8.2789 8.2789 8.6692 8.6695 9.0197 9.0200 9.1480 9.1515 9.1945 9.1989 9.2646 9.2652 9.8486 9.8490 10.2871 10.2905 10.4112 10.4139 10.7348 10.7350 10.8229 10.8231 10.9620 10.9621 11.0673 11.0675 11.5392 11.5398 11.5959 11.5963 11.9268 11.9274 12.0998 12.0999 12.2051 12.2058 12.4920 12.4920 12.5355 12.5356 12.8184 12.8187 13.0408 13.0408 13.1314 13.1315 13.3303 13.3310 13.3917 13.3921 13.6676 13.6705 13.7419 13.7456 13.8094 13.8100 14.0939 14.0943 14.7731 14.7754 15.0829 15.0845 15.7041 15.7050 15.8460 15.8470 16.2520 16.2520 16.4823 16.4827 17.3230 17.3257 17.4542 17.4579 17.5575 17.5603 17.6268 17.6312 17.8764 17.8779 k = 0.0536 0.0309 0.9055 ( 4444 PWs) bands (ev): 5.7155 5.7155 5.7744 5.7744 6.5469 6.5469 8.2771 8.2772 8.6320 8.6327 9.0241 9.0244 9.1538 9.1636 9.1929 9.2042 9.2971 9.2974 9.8475 9.8487 10.2705 10.2795 10.4301 10.4368 10.7317 10.7324 10.8218 10.8222 10.9605 10.9609 11.0693 11.0699 11.5242 11.5254 11.6038 11.6047 11.9243 11.9263 12.0908 12.0913 12.1978 12.2000 12.4935 12.4937 12.5371 12.5371 12.8235 12.8243 13.0372 13.0373 13.1311 13.1315 13.3231 13.3248 13.3964 13.3975 13.6559 13.6642 13.7374 13.7474 13.8200 13.8211 14.0790 14.0800 14.7758 14.7835 15.0743 15.0793 15.6742 15.6768 15.8052 15.8077 16.2662 16.2670 16.5301 16.5309 17.3348 17.3432 17.4700 17.4823 17.5727 17.5800 17.6422 17.6553 17.8890 17.8941 k = 0.0714 0.0412 0.9055 ( 4436 PWs) bands (ev): 5.7150 5.7150 5.7819 5.7820 6.5426 6.5426 8.2749 8.2752 8.5853 8.5866 9.0278 9.0284 9.1623 9.1795 9.1968 9.2167 9.3332 9.3341 9.8458 9.8486 10.2532 10.2706 10.4503 10.4625 10.7274 10.7290 10.8200 10.8211 10.9584 10.9592 11.0721 11.0735 11.5079 11.5100 11.6103 11.6115 11.9203 11.9250 12.0782 12.0793 12.1871 12.1922 12.4953 12.4960 12.5393 12.5396 12.8296 12.8311 13.0327 13.0331 13.1304 13.1314 13.3147 13.3182 13.4017 13.4035 13.6404 13.6569 13.7312 13.7508 13.8329 13.8342 14.0604 14.0622 14.7768 14.7941 15.0626 15.0742 15.6316 15.6363 15.7606 15.7645 16.2858 16.2890 16.5855 16.5866 17.3477 17.3649 17.4898 17.5170 17.5958 17.6064 17.6645 17.6893 17.9055 17.9174 k = 0.0893 0.0515 0.9055 ( 4432 PWs) bands (ev): 5.7145 5.7145 5.7916 5.7917 6.5372 6.5373 8.2725 8.2730 8.5319 8.5339 9.0285 9.0312 9.1756 9.1982 9.2072 9.2347 9.3707 9.3738 9.8433 9.8487 10.2365 10.2653 10.4708 10.4894 10.7218 10.7247 10.8178 10.8197 10.9558 10.9572 11.0754 11.0784 11.4909 11.4940 11.6151 11.6165 11.9147 11.9238 12.0620 12.0642 12.1728 12.1826 12.4970 12.4989 12.5418 12.5432 12.8358 12.8380 13.0278 13.0291 13.1294 13.1313 13.3062 13.3116 13.4072 13.4095 13.6221 13.6492 13.7231 13.7551 13.8473 13.8486 14.0405 14.0426 14.7750 14.8066 15.0487 15.0703 15.5785 15.5849 15.7159 15.7203 16.3103 16.3176 16.6438 16.6448 17.3608 17.3880 17.5116 17.5590 17.6310 17.6385 17.6958 17.7313 17.9253 17.9478 k = 0.1071 0.0619 0.9055 ( 4432 PWs) bands (ev): 5.7138 5.7138 5.8033 5.8035 6.5308 6.5310 8.2701 8.2709 8.4737 8.4764 9.0257 9.0315 9.1945 9.2178 9.2260 9.2571 9.4086 9.4147 9.8400 9.8493 10.2211 10.2642 10.4909 10.5165 10.7150 10.7198 10.8149 10.8182 10.9528 10.9549 11.0791 11.0846 11.4736 11.4777 11.6181 11.6191 11.9074 11.9226 12.0424 12.0461 12.1547 12.1713 12.4982 12.5025 12.5446 12.5482 12.8413 12.8436 13.0229 13.0264 13.1279 13.1314 13.2982 13.3057 13.4130 13.4154 13.6017 13.6414 13.7123 13.7602 13.8626 13.8639 14.0214 14.0228 14.7696 14.8197 15.0333 15.0682 15.5187 15.5263 15.6712 15.6752 16.3388 16.3516 16.7019 16.7024 17.3742 17.4105 17.5349 17.6028 17.6760 17.6806 17.7394 17.7791 17.9485 17.9850 k = 0.1250 0.0722 0.9055 ( 4436 PWs) bands (ev): 5.7131 5.7131 5.8170 5.8173 6.5235 6.5239 8.2681 8.2692 8.4122 8.4156 9.0195 9.0289 9.2186 9.2393 9.2517 9.2833 9.4456 9.4557 9.8359 9.8504 10.2077 10.2679 10.5103 10.5431 10.7072 10.7144 10.8113 10.8165 10.9496 10.9523 11.0828 11.0921 11.4565 11.4613 11.6193 11.6193 11.8983 11.9216 12.0193 12.0251 12.1329 12.1582 12.4985 12.5064 12.5473 12.5544 12.8455 12.8462 13.0186 13.0263 13.1261 13.1318 13.2911 13.3008 13.4190 13.4210 13.5798 13.6339 13.6980 13.7657 13.8774 13.8801 14.0051 14.0052 14.7607 14.8323 15.0175 15.0682 15.4557 15.4642 15.6257 15.6289 16.3706 16.3897 16.7571 16.7574 17.3883 17.4313 17.5609 17.6432 17.7186 17.7431 17.7986 17.8316 17.9763 18.0289 k = 0.1429 0.0825 0.9055 ( 4440 PWs) bands (ev): 5.7122 5.7122 5.8326 5.8331 6.5154 6.5160 8.2666 8.2682 8.3485 8.3526 9.0104 9.0234 9.2467 9.2644 9.2818 9.3131 9.4811 9.4957 9.8311 9.8524 10.1967 10.2765 10.5287 10.5685 10.6986 10.7086 10.8071 10.8146 10.9465 10.9494 11.0862 11.1009 11.4400 11.4451 11.6168 11.6186 11.8874 11.9205 11.9929 12.0014 12.1072 12.1435 12.4978 12.5101 12.5497 12.5619 12.8446 12.8481 13.0148 13.0298 13.1241 13.1328 13.2853 13.2971 13.4255 13.4261 13.5569 13.6270 13.6801 13.7717 13.8893 13.8971 13.9924 13.9932 14.7490 14.8431 15.0026 15.0698 15.3922 15.4013 15.5790 15.5812 16.4046 16.4305 16.8076 16.8088 17.4035 17.4500 17.5919 17.6799 17.7650 17.8138 17.8734 17.8881 18.0119 18.0794 k = 0.1607 0.0928 0.9055 ( 4434 PWs) bands (ev): 5.7113 5.7113 5.8501 5.8508 6.5067 6.5075 8.2658 8.2681 8.2834 8.2881 8.9991 9.0152 9.2775 9.2925 9.3158 9.3463 9.5146 9.5343 9.8257 9.8553 10.1885 10.2900 10.5459 10.5924 10.6894 10.7026 10.8020 10.8123 10.9437 10.9464 11.0887 11.1107 11.4247 11.4294 11.6117 11.6159 11.8750 11.9189 11.9633 11.9757 12.0778 12.1270 12.4955 12.5131 12.5521 12.5702 12.8384 12.8492 13.0114 13.0372 13.1219 13.1347 13.2812 13.2948 13.4306 13.4324 13.5337 13.6206 13.6589 13.7783 13.8946 13.9151 13.9859 13.9890 14.7352 14.8505 14.9900 15.0724 15.3299 15.3395 15.5311 15.5324 16.4399 16.4722 16.8530 16.8550 17.4199 17.4672 17.6291 17.7153 17.8148 17.8847 17.9482 17.9606 18.0618 18.1367 k = 0.1786 0.1031 0.9055 ( 4430 PWs) bands (ev): 5.7103 5.7103 5.8693 5.8704 6.4975 6.4985 8.2173 8.2223 8.2665 8.2691 8.9858 9.0046 9.3100 9.3227 9.3534 9.3825 9.5463 9.5710 9.8200 9.8594 10.1836 10.3082 10.5619 10.6142 10.6800 10.6966 10.7961 10.8095 10.9414 10.9433 11.0896 11.1211 11.4112 11.4146 11.6040 11.6113 11.8613 11.9143 11.9308 11.9502 12.0447 12.1088 12.4913 12.5141 12.5544 12.5792 12.8284 12.8494 13.0083 13.0478 13.1200 13.1376 13.2790 13.2938 13.4338 13.4397 13.5114 13.6139 13.6366 13.7856 13.8913 13.9339 13.9834 13.9972 14.7204 14.8532 14.9810 15.0749 15.2703 15.2801 15.4823 15.4831 16.4756 16.5137 16.8929 16.8956 17.4378 17.4837 17.6732 17.7509 17.8687 17.9470 18.0113 18.0571 18.1343 18.2016 k = 0.1964 0.1134 0.9055 ( 4432 PWs) bands (ev): 5.7092 5.7092 5.8902 5.8916 6.4878 6.4893 8.1509 8.1563 8.2679 8.2712 8.9709 8.9920 9.3430 9.3539 9.3944 9.4214 9.5763 9.6055 9.8141 9.8651 10.1823 10.3308 10.5768 10.6335 10.6710 10.6908 10.7893 10.8062 10.9398 10.9402 11.0882 11.1312 11.4001 11.4012 11.5938 11.6047 11.8462 11.8959 11.8980 11.9338 12.0080 12.0888 12.4848 12.5125 12.5569 12.5885 12.8158 12.8495 13.0051 13.0603 13.1188 13.1413 13.2785 13.2941 13.4342 13.4473 13.4921 13.6008 13.6208 13.7938 13.8820 13.9530 13.9856 14.0142 14.7054 14.8502 14.9763 15.0759 15.2149 15.2240 15.4331 15.4336 16.5110 16.5536 16.9273 16.9302 17.4574 17.5005 17.7241 17.7874 17.9274 17.9973 18.0786 18.1598 18.2304 18.2749 k = 0.2143 0.1237 0.9055 ( 4430 PWs) bands (ev): 5.7081 5.7081 5.9127 5.9145 6.4780 6.4799 8.0846 8.0902 8.2708 8.2747 8.9547 8.9777 9.3757 9.3852 9.4381 9.4623 9.6053 9.6381 9.8084 9.8727 10.1849 10.3571 10.5904 10.6483 10.6643 10.6854 10.7818 10.8021 10.9372 10.9391 11.0837 11.1402 11.3897 11.3919 11.5815 11.5960 11.8296 11.8596 11.8677 11.9285 11.9681 12.0670 12.4754 12.5076 12.5595 12.5978 12.8023 12.8504 13.0020 13.0728 13.1191 13.1457 13.2797 13.2956 13.4288 13.4548 13.4794 13.5783 13.6159 13.8030 13.8703 13.9700 13.9942 14.0363 14.6909 14.8420 14.9749 15.0722 15.1668 15.1727 15.3837 15.3846 16.5453 16.5911 16.9564 16.9592 17.4788 17.5184 17.7810 17.8250 17.9914 18.0402 18.1508 18.2655 18.3438 18.3585 k = 0.2321 0.1340 0.9055 ( 4422 PWs) bands (ev): 5.7069 5.7069 5.9365 5.9388 6.4680 6.4704 8.0186 8.0244 8.2750 8.2796 8.9373 8.9617 9.4072 9.4156 9.4840 9.5039 9.6344 9.6692 9.8030 9.8826 10.1915 10.3863 10.6031 10.6487 10.6704 10.6807 10.7736 10.7973 10.9344 10.9393 11.0757 11.1468 11.3807 11.3869 11.5675 11.5851 11.8072 11.8269 11.8313 11.9251 11.9263 12.0434 12.4629 12.4993 12.5619 12.6066 12.7894 12.8524 12.9993 13.0831 13.1222 13.1503 13.2822 13.2979 13.4163 13.4616 13.4752 13.5550 13.6150 13.8133 13.8582 13.9816 14.0119 14.0616 14.6773 14.8299 14.9739 15.0567 15.1276 15.1328 15.3347 15.3366 16.5782 16.6255 16.9807 16.9831 17.5023 17.5382 17.8431 17.8638 18.0610 18.0811 18.2275 18.3694 18.4557 18.4692 k = 0.2500 0.1443 0.9055 ( 4412 PWs) bands (ev): 5.7056 5.7057 5.9616 5.9644 6.4581 6.4611 7.9534 7.9593 8.2806 8.2860 8.9189 8.9445 9.4368 9.4439 9.5316 9.5449 9.6644 9.6997 9.7983 9.8954 10.2019 10.4174 10.6150 10.6420 10.6771 10.6823 10.7650 10.7915 10.9320 10.9406 11.0639 11.1499 11.3746 11.3850 11.5521 11.5720 11.7721 11.7915 11.8057 11.8798 11.9243 12.0184 12.4471 12.4879 12.5639 12.6148 12.7781 12.8556 12.9974 13.0896 13.1293 13.1547 13.2853 13.3008 13.4009 13.4663 13.4764 13.5346 13.6163 13.8248 13.8467 13.9898 14.0359 14.0889 14.6648 14.8153 14.9693 15.0254 15.0917 15.1164 15.2863 15.2905 16.6090 16.6566 17.0007 17.0025 17.5280 17.5605 17.9037 17.9089 18.1231 18.1361 18.3077 18.4681 18.5682 18.6036 k = 0.2679 0.1546 0.9055 ( 4410 PWs) bands (ev): 5.7044 5.7044 5.9877 5.9911 6.4484 6.4521 7.8894 7.8951 8.2877 8.2938 8.8997 8.9260 9.4637 9.4692 9.5800 9.5834 9.6961 9.7312 9.7952 9.9118 10.2160 10.4493 10.6264 10.6355 10.6749 10.6932 10.7560 10.7849 10.9299 10.9428 11.0484 11.1487 11.3710 11.3859 11.5358 11.5566 11.7322 11.7489 11.7890 11.8323 11.9220 11.9924 12.4283 12.4738 12.5653 12.6220 12.7692 12.8595 12.9970 13.0926 13.1394 13.1587 13.2878 13.3040 13.3870 13.4668 13.4797 13.5204 13.6195 13.8324 13.8409 13.9973 14.0631 14.1176 14.6538 14.7991 14.9566 14.9872 15.0686 15.1073 15.2390 15.2478 16.6376 16.6841 17.0171 17.0180 17.5563 17.5858 17.9446 17.9767 18.1689 18.2166 18.3908 18.5629 18.6931 18.7449 k = 0.2857 0.1650 0.9055 ( 4410 PWs) bands (ev): 5.7031 5.7032 6.0146 6.0187 6.4391 6.4434 7.8267 7.8324 8.2962 8.3031 8.8797 8.9065 9.4873 9.4908 9.6173 9.6284 9.7288 9.7650 9.7955 9.9325 10.2329 10.4804 10.6301 10.6374 10.6753 10.7024 10.7470 10.7774 10.9284 10.9459 11.0296 11.1430 11.3691 11.3888 11.5193 11.5391 11.6921 11.7039 11.7733 11.7836 11.9189 11.9658 12.4072 12.4576 12.5662 12.6278 12.7629 12.8634 12.9987 13.0939 13.1506 13.1619 13.2878 13.3071 13.3778 13.4612 13.4838 13.5143 13.6243 13.8238 13.8535 14.0046 14.0926 14.1476 14.6441 14.7820 14.9351 14.9491 15.0582 15.0960 15.1933 15.2113 16.6638 16.7080 17.0302 17.0303 17.5874 17.6144 17.9864 18.0436 18.2207 18.3018 18.4759 18.6560 18.8262 18.8921 k = 0.3036 0.1753 0.9055 ( 4418 PWs) bands (ev): 5.7019 5.7020 6.0420 6.0468 6.4302 6.4354 7.7659 7.7713 8.3060 8.3137 8.8592 8.8862 9.5073 9.5085 9.6451 9.6750 9.7577 9.8021 9.8058 9.9579 10.2521 10.5085 10.6264 10.6468 10.6810 10.7100 10.7383 10.7693 10.9275 10.9500 11.0081 11.1332 11.3667 11.3925 11.5034 11.5196 11.6535 11.6567 11.7346 11.7577 11.9149 11.9396 12.3844 12.4398 12.5668 12.6323 12.7594 12.8663 13.0028 13.0944 13.1617 13.1643 13.2838 13.3097 13.3752 13.4521 13.4880 13.5141 13.6307 13.8142 13.8690 14.0115 14.1240 14.1786 14.6357 14.7642 14.9088 14.9134 15.0551 15.0765 15.1501 15.1847 16.6875 16.7287 17.0401 17.0408 17.6215 17.6469 18.0293 18.1069 18.2809 18.3909 18.5623 18.7483 18.9641 19.0441 k = 0.3214 0.1856 0.9055 ( 4426 PWs) bands (ev): 5.7007 5.7008 6.0695 6.0751 6.4220 6.4280 7.7073 7.7124 8.3171 8.3255 8.8384 8.8652 9.5226 9.5237 9.6664 9.7143 9.7785 9.8349 9.8424 9.9883 10.2727 10.5317 10.6245 10.6520 10.6957 10.7157 10.7299 10.7611 10.9272 10.9546 10.9847 11.1202 11.3613 11.3953 11.4888 11.4985 11.6076 11.6183 11.6864 11.7418 11.9099 11.9146 12.3611 12.4209 12.5674 12.6351 12.7584 12.8677 13.0093 13.0947 13.1657 13.1721 13.2763 13.3117 13.3788 13.4433 13.4918 13.5161 13.6384 13.8051 13.8856 14.0180 14.1570 14.2104 14.6282 14.7462 14.8812 14.8815 15.0471 15.0524 15.1124 15.1691 16.7086 16.7462 17.0477 17.0491 17.6588 17.6833 18.0729 18.1642 18.3508 18.4828 18.6488 18.8394 19.1026 19.1993 k = 0.3393 0.1959 0.9055 ( 4422 PWs) bands (ev): 5.6996 5.6996 6.0968 6.1032 6.4146 6.4215 7.6514 7.6561 8.3293 8.3383 8.8174 8.8437 9.5336 9.5367 9.6821 9.7358 9.8070 9.8764 9.8844 10.0234 10.2936 10.5489 10.6248 10.6533 10.7187 10.7198 10.7223 10.7539 10.9278 10.9530 10.9670 11.1051 11.3502 11.3945 11.4761 11.4771 11.5573 11.5884 11.6405 11.7250 11.8919 11.9040 12.3384 12.4016 12.5681 12.6363 12.7596 12.8675 13.0176 13.0948 13.1664 13.1815 13.2673 13.3129 13.3869 13.4368 13.4951 13.5184 13.6469 13.7965 13.9028 14.0239 14.1914 14.2430 14.6214 14.7283 14.8529 14.8549 15.0111 15.0384 15.0899 15.1608 16.7273 16.7609 17.0537 17.0556 17.6995 17.7240 18.1173 18.2155 18.4295 18.5761 18.7342 18.9287 19.2262 19.3298 k = 0.3571 0.2062 0.9055 ( 4414 PWs) bands (ev): 5.6985 5.6985 6.1233 6.1306 6.4082 6.4160 7.5986 7.6028 8.3425 8.3521 8.7965 8.8220 9.5421 9.5468 9.6934 9.7417 9.8474 9.9228 9.9266 10.0623 10.3138 10.5600 10.6273 10.6523 10.7154 10.7173 10.7498 10.7508 10.9293 10.9299 10.9713 11.0890 11.3317 11.3860 11.4521 11.4690 11.5079 11.5651 11.5992 11.7072 11.8723 11.8971 12.3172 12.3823 12.5691 12.6358 12.7627 12.8657 13.0268 13.0946 13.1666 13.1894 13.2589 13.3131 13.3976 13.4334 13.4974 13.5201 13.6562 13.7883 13.9204 14.0291 14.2268 14.2762 14.6148 14.7109 14.8288 14.8291 14.9724 15.0089 15.0862 15.1562 16.7435 16.7730 17.0584 17.0606 17.7436 17.7690 18.1621 18.2615 18.5144 18.6686 18.8160 19.0153 19.2357 19.2586 k = 0.3750 0.2165 0.9055 ( 4418 PWs) bands (ev): 5.6975 5.6975 6.1486 6.1566 6.4029 6.4115 7.5494 7.5532 8.3564 8.3664 8.7760 8.8004 9.5488 9.5543 9.7015 9.7419 9.8908 9.9670 9.9714 10.1043 10.3322 10.5661 10.6322 10.6497 10.7094 10.7110 10.7498 10.7859 10.9041 10.9319 10.9798 11.0735 11.3060 11.3658 11.4263 11.4534 11.4728 11.5482 11.5654 11.6884 11.8563 11.8896 12.2984 12.3633 12.5705 12.6339 12.7673 12.8627 13.0361 13.0938 13.1668 13.1952 13.2528 13.3123 13.4096 13.4328 13.4989 13.5208 13.6657 13.7805 13.9379 14.0333 14.2631 14.3099 14.6077 14.6947 14.8036 14.8090 14.9335 14.9758 15.0894 15.1529 16.7575 16.7829 17.0621 17.0645 17.7913 17.8182 18.2068 18.3031 18.6029 18.7567 18.8868 19.0970 19.1356 19.1831 k = 0.3929 0.2268 0.9055 ( 4418 PWs) bands (ev): 5.6966 5.6966 6.1721 6.1806 6.3990 6.4081 7.5046 7.5079 8.3707 8.3809 8.7564 8.7792 9.5539 9.5598 9.7073 9.7402 9.9332 10.0043 10.0211 10.1483 10.3477 10.5676 10.6389 10.6456 10.7018 10.7040 10.7525 10.8234 10.8794 10.9358 10.9901 11.0599 11.2747 11.3315 11.3989 11.4152 11.4670 11.5358 11.5430 11.6691 11.8441 11.8814 12.2827 12.3451 12.5725 12.6307 12.7732 12.8586 13.0445 13.0924 13.1674 13.1984 13.2503 13.3107 13.4220 13.4349 13.4992 13.5204 13.6753 13.7730 13.9548 14.0366 14.2998 14.3442 14.5998 14.6800 14.7776 14.7932 14.8960 14.9445 15.0945 15.1502 16.7694 16.7907 17.0650 17.0673 17.8423 17.8713 18.2509 18.3402 18.6917 18.8313 18.9135 19.0833 19.0872 19.1816 k = 0.4107 0.2371 0.9055 ( 4426 PWs) bands (ev): 5.6958 5.6958 6.1932 6.2019 6.3966 6.4058 7.4648 7.4675 8.3850 8.3950 8.7380 8.7588 9.5579 9.5637 9.7117 9.7378 9.9729 10.0367 10.0706 10.1931 10.3592 10.5640 10.6405 10.6466 10.6920 10.6993 10.7565 10.8560 10.8630 10.9415 11.0021 11.0499 11.2398 11.2856 11.3708 11.3792 11.4628 11.5256 11.5339 11.6499 11.8356 11.8729 12.2706 12.3278 12.5752 12.6265 12.7800 12.8538 13.0517 13.0901 13.1688 13.1989 13.2517 13.3081 13.4345 13.4390 13.4983 13.5188 13.6849 13.7656 13.9708 14.0386 14.3365 14.3788 14.5907 14.6671 14.7507 14.7802 14.8621 14.9164 15.1002 15.1474 16.7794 16.7968 17.0672 17.0694 17.8962 17.9277 18.2936 18.3723 18.7706 18.8592 18.8665 19.0366 19.1172 19.2545 k = 0.4286 0.2474 0.9055 ( 4422 PWs) bands (ev): 5.6951 5.6952 6.2113 6.2195 6.3957 6.4044 7.4308 7.4329 8.3988 8.4082 8.7217 8.7398 9.5611 9.5662 9.7151 9.7352 10.0086 10.0632 10.1193 10.2372 10.3662 10.5540 10.6355 10.6526 10.6842 10.6954 10.7616 10.8383 10.9005 10.9500 11.0154 11.0445 11.2031 11.2342 11.3429 11.3457 11.4592 11.5158 11.5349 11.6318 11.8303 11.8643 12.2624 12.3118 12.5785 12.6214 12.7876 12.8482 13.0574 13.0871 13.1712 13.1974 13.2561 13.3047 13.4446 13.4465 13.4964 13.5160 13.6942 13.7583 13.9855 14.0394 14.3728 14.4135 14.5802 14.6556 14.7238 14.7667 14.8352 14.8919 15.1061 15.1443 16.7875 16.8012 17.0689 17.0708 17.9524 17.9859 18.3341 18.3985 18.7527 18.8058 18.8868 19.0593 19.1820 19.3224 k = 0.4464 0.2577 0.9055 ( 4424 PWs) bands (ev): 5.6946 5.6946 6.2260 6.2331 6.3962 6.4038 7.4032 7.4048 8.4115 8.4195 8.7081 8.7228 9.5636 9.5678 9.7178 9.7325 10.0394 10.0826 10.1659 10.2770 10.3702 10.5362 10.6319 10.6528 10.6819 10.6925 10.7680 10.8235 10.9381 10.9627 11.0297 11.0438 11.1657 11.1816 11.3154 11.3166 11.4581 11.5053 11.5415 11.6151 11.8280 11.8559 12.2579 12.2973 12.5825 12.6157 12.7955 12.8420 13.0618 13.0836 13.1743 13.1950 13.2622 13.3004 13.4511 13.4577 13.4935 13.5120 13.7032 13.7510 13.9986 14.0388 14.4078 14.4477 14.5683 14.6432 14.6998 14.7488 14.8199 14.8711 15.1119 15.1409 16.7941 16.8042 17.0703 17.0717 18.0091 18.0433 18.3711 18.4180 18.6766 18.7233 18.9619 19.1021 19.2505 19.3819 k = 0.4643 0.2681 0.9055 ( 4428 PWs) bands (ev): 5.6942 5.6942 6.2370 6.2423 6.3978 6.4033 7.3830 7.3841 8.4221 8.4281 8.6983 8.7088 9.5656 9.5685 9.7203 9.7299 10.0645 10.0944 10.2093 10.3023 10.3798 10.5104 10.6307 10.6473 10.6844 10.6908 10.7757 10.8118 10.9746 10.9814 11.0434 11.0461 11.1289 11.1307 11.2907 11.2939 11.4603 11.4943 11.5508 11.6000 11.8282 11.8480 12.2571 12.2845 12.5871 12.6098 12.8038 12.8352 13.0656 13.0798 13.1779 13.1921 13.2690 13.2952 13.4580 13.4671 13.4905 13.5069 13.7119 13.7436 14.0099 14.0366 14.4408 14.4796 14.5563 14.6248 14.6851 14.7271 14.8159 14.8536 15.1175 15.1370 16.7991 16.8058 17.0712 17.0723 18.0633 18.0944 18.4033 18.4307 18.6083 18.6431 19.0321 19.1329 19.3167 19.4275 k = 0.4821 0.2784 0.9055 ( 4420 PWs) bands (ev): 5.6940 5.6940 6.2443 6.2471 6.3997 6.4027 7.3707 7.3712 8.4297 8.4330 8.6931 8.6986 9.5670 9.5685 9.7226 9.7274 10.0830 10.0984 10.2479 10.3007 10.4064 10.4782 10.6319 10.6408 10.6871 10.6897 10.7843 10.8021 11.0076 11.0093 11.0475 11.0551 11.0837 11.0941 11.2747 11.2773 11.4656 11.4835 11.5616 11.5862 11.8307 11.8409 12.2598 12.2738 12.5922 12.6037 12.8120 12.8279 13.0690 13.0760 13.1817 13.1889 13.2761 13.2894 13.4647 13.4722 13.4899 13.5008 13.7203 13.7361 14.0194 14.0327 14.4702 14.5003 14.5519 14.5987 14.6831 14.7066 14.8194 14.8391 15.1229 15.1327 16.8027 16.8060 17.0719 17.0724 18.1087 18.1289 18.4284 18.4387 18.5602 18.5784 19.0890 19.1422 19.3772 19.4464 k = 0.5000 0.2887 0.9055 ( 4416 PWs) bands (ev): 5.6939 5.6939 6.2477 6.2477 6.4015 6.4015 7.3667 7.3667 8.4335 8.4335 8.6932 8.6932 9.5680 9.5680 9.7250 9.7250 10.0945 10.0945 10.2797 10.2797 10.4423 10.4423 10.6354 10.6354 10.6887 10.6887 10.7931 10.7931 11.0365 11.0365 11.0433 11.0433 11.0679 11.0679 11.2701 11.2701 11.4736 11.4736 11.5735 11.5735 11.8350 11.8350 12.2654 12.2654 12.5978 12.5978 12.8201 12.8201 13.0724 13.0724 13.1854 13.1854 13.2829 13.2829 13.4703 13.4703 13.4943 13.4943 13.7283 13.7283 14.0270 14.0270 14.4933 14.4933 14.5703 14.5703 14.6911 14.6911 14.8275 14.8275 15.1280 15.1280 16.8050 16.8050 17.0723 17.0723 18.1342 18.1342 18.4411 18.4411 18.5463 18.5463 19.1271 19.1271 19.4256 19.4256 k = 0.5000 0.2887 0.9055 ( 4416 PWs) bands (ev): 5.6939 5.6939 6.2477 6.2477 6.4015 6.4015 7.3667 7.3667 8.4335 8.4335 8.6932 8.6932 9.5680 9.5680 9.7250 9.7250 10.0945 10.0945 10.2797 10.2797 10.4423 10.4423 10.6354 10.6354 10.6887 10.6887 10.7931 10.7931 11.0365 11.0365 11.0433 11.0433 11.0679 11.0679 11.2701 11.2701 11.4736 11.4736 11.5735 11.5735 11.8350 11.8350 12.2654 12.2654 12.5978 12.5978 12.8201 12.8201 13.0724 13.0724 13.1854 13.1854 13.2829 13.2829 13.4703 13.4703 13.4943 13.4943 13.7283 13.7283 14.0270 14.0270 14.4933 14.4933 14.5703 14.5703 14.6911 14.6911 14.8275 14.8275 15.1280 15.1280 16.8050 16.8050 17.0723 17.0723 18.1342 18.1342 18.4411 18.4411 18.5463 18.5463 19.1271 19.1271 19.4256 19.4256 k = 0.4902 0.3057 0.9055 ( 4418 PWs) bands (ev): 5.6939 5.6939 6.2484 6.2484 6.4013 6.4013 7.3657 7.3657 8.4340 8.4340 8.6928 8.6928 9.5694 9.5694 9.7254 9.7254 10.0953 10.0953 10.2786 10.2786 10.4427 10.4427 10.6343 10.6343 10.6882 10.6882 10.7900 10.7900 11.0377 11.0377 11.0441 11.0441 11.0690 11.0690 11.2693 11.2693 11.4737 11.4737 11.5741 11.5741 11.8344 11.8344 12.2643 12.2643 12.5984 12.5984 12.8213 12.8213 13.0725 13.0725 13.1857 13.1857 13.2832 13.2832 13.4700 13.4700 13.4943 13.4943 13.7282 13.7282 14.0265 14.0265 14.4921 14.4921 14.5712 14.5712 14.6906 14.6906 14.8279 14.8279 15.1279 15.1279 16.8070 16.8070 17.0766 17.0766 18.1304 18.1304 18.4359 18.4359 18.5333 18.5333 19.1423 19.1423 19.4208 19.4208 k = 0.4804 0.3226 0.9055 ( 4418 PWs) bands (ev): 5.6938 5.6938 6.2507 6.2507 6.4006 6.4006 7.3627 7.3627 8.4354 8.4354 8.6918 8.6918 9.5734 9.5734 9.7268 9.7268 10.0978 10.0978 10.2752 10.2752 10.4439 10.4439 10.6312 10.6312 10.6865 10.6865 10.7817 10.7817 11.0385 11.0385 11.0481 11.0481 11.0728 11.0728 11.2672 11.2672 11.4736 11.4736 11.5761 11.5761 11.8326 11.8326 12.2608 12.2608 12.6001 12.6001 12.8249 12.8249 13.0727 13.0727 13.1866 13.1866 13.2840 13.2840 13.4691 13.4691 13.4944 13.4944 13.7277 13.7277 14.0251 14.0251 14.4887 14.4887 14.5735 14.5735 14.6891 14.6891 14.8290 14.8290 15.1278 15.1278 16.8131 16.8131 17.0894 17.0894 18.1191 18.1191 18.4204 18.4204 18.4983 18.4983 19.1827 19.1827 19.4079 19.4079 k = 0.4706 0.3396 0.9055 ( 4414 PWs) bands (ev): 5.6937 5.6937 6.2544 6.2544 6.3995 6.3995 7.3578 7.3578 8.4377 8.4377 8.6900 8.6900 9.5800 9.5800 9.7292 9.7292 10.1019 10.1019 10.2697 10.2697 10.4458 10.4458 10.6262 10.6262 10.6836 10.6836 10.7702 10.7702 11.0375 11.0375 11.0523 11.0523 11.0805 11.0805 11.2655 11.2655 11.4727 11.4727 11.5793 11.5793 11.8299 11.8299 12.2551 12.2551 12.6028 12.6028 12.8307 12.8307 13.0730 13.0730 13.1878 13.1878 13.2853 13.2853 13.4675 13.4675 13.4945 13.4945 13.7268 13.7268 14.0229 14.0229 14.4835 14.4835 14.5770 14.5770 14.6866 14.6866 14.8308 14.8308 15.1275 15.1275 16.8232 16.8232 17.1106 17.1106 18.1004 18.1004 18.3954 18.3954 18.4502 18.4502 19.2321 19.2321 19.3956 19.3956 k = 0.4608 0.3566 0.9055 ( 4414 PWs) bands (ev): 5.6935 5.6935 6.2595 6.2595 6.3981 6.3981 7.3510 7.3510 8.4410 8.4410 8.6874 8.6874 9.5891 9.5891 9.7325 9.7325 10.1071 10.1071 10.2623 10.2623 10.4484 10.4484 10.6195 10.6195 10.6796 10.6796 10.7578 10.7578 11.0352 11.0352 11.0532 11.0532 11.0915 11.0915 11.2662 11.2662 11.4704 11.4704 11.5835 11.5835 11.8265 11.8265 12.2474 12.2474 12.6063 12.6063 12.8386 12.8386 13.0737 13.0737 13.1891 13.1891 13.2873 13.2873 13.4655 13.4655 13.4950 13.4950 13.7253 13.7253 14.0201 14.0201 14.4768 14.4768 14.5811 14.5811 14.6835 14.6835 14.8333 14.8333 15.1271 15.1271 16.8375 16.8375 17.1397 17.1397 18.0748 18.0748 18.3598 18.3598 18.3987 18.3987 19.2551 19.2551 19.4134 19.4134 k = 0.4510 0.3736 0.9055 ( 4410 PWs) bands (ev): 5.6932 5.6932 6.2659 6.2659 6.3963 6.3963 7.3425 7.3425 8.4452 8.4452 8.6840 8.6840 9.6004 9.6004 9.7367 9.7367 10.1130 10.1130 10.2534 10.2534 10.4517 10.4517 10.6114 10.6114 10.6746 10.6746 10.7462 10.7462 11.0304 11.0304 11.0516 11.0516 11.1037 11.1037 11.2710 11.2710 11.4660 11.4660 11.5882 11.5882 11.8229 11.8229 12.2378 12.2378 12.6104 12.6104 12.8481 12.8481 13.0746 13.0746 13.1901 13.1901 13.2899 13.2899 13.4630 13.4630 13.4958 13.4958 13.7230 13.7230 14.0172 14.0172 14.4693 14.4693 14.5853 14.5853 14.6799 14.6799 14.8364 14.8364 15.1264 15.1264 16.8561 16.8561 17.1765 17.1765 18.0428 18.0428 18.3109 18.3109 18.3532 18.3532 19.2298 19.2298 19.4801 19.4801 k = 0.4412 0.3906 0.9055 ( 4410 PWs) bands (ev): 5.6929 5.6929 6.2735 6.2735 6.3942 6.3942 7.3324 7.3324 8.4503 8.4503 8.6798 8.6798 9.6136 9.6136 9.7419 9.7419 10.1186 10.1186 10.2441 10.2441 10.4553 10.4553 10.6019 10.6019 10.6693 10.6693 10.7364 10.7364 11.0202 11.0202 11.0503 11.0503 11.1154 11.1154 11.2807 11.2807 11.4596 11.4596 11.5925 11.5925 11.8198 11.8198 12.2267 12.2267 12.6149 12.6149 12.8591 12.8591 13.0760 13.0760 13.1904 13.1904 13.2931 13.2931 13.4604 13.4604 13.4971 13.4971 13.7199 13.7199 14.0144 14.0144 14.4613 14.4613 14.5891 14.5891 14.6760 14.6760 14.8402 14.8402 15.1255 15.1255 16.8791 16.8791 17.2202 17.2202 18.0052 18.0052 18.2535 18.2535 18.3135 18.3135 19.1795 19.1795 19.5708 19.5708 k = 0.4314 0.4075 0.9055 ( 4402 PWs) bands (ev): 5.6926 5.6926 6.2822 6.2822 6.3918 6.3918 7.3210 7.3210 8.4563 8.4563 8.6748 8.6748 9.6285 9.6285 9.7481 9.7481 10.1224 10.1224 10.2362 10.2362 10.4593 10.4593 10.5914 10.5914 10.6643 10.6643 10.7287 10.7287 11.0037 11.0037 11.0509 11.0509 11.1263 11.1263 11.2943 11.2943 11.4514 11.4514 11.5956 11.5956 11.8178 11.8178 12.2141 12.2141 12.6194 12.6194 12.8710 12.8710 13.0778 13.0778 13.1898 13.1898 13.2970 13.2970 13.4578 13.4578 13.4991 13.4991 13.7159 13.7159 14.0119 14.0119 14.4531 14.4531 14.5923 14.5923 14.6721 14.6721 14.8445 14.8445 15.1243 15.1243 16.9065 16.9065 17.2701 17.2701 17.9627 17.9627 18.1943 18.1943 18.2761 18.2761 19.1177 19.1177 19.6719 19.6719 k = 0.4216 0.4245 0.9055 ( 4406 PWs) bands (ev): 5.6923 5.6923 6.2917 6.2917 6.3892 6.3892 7.3085 7.3085 8.4633 8.4633 8.6688 8.6688 9.6444 9.6444 9.7551 9.7551 10.1223 10.1223 10.2320 10.2320 10.4632 10.4632 10.5804 10.5804 10.6604 10.6604 10.7229 10.7229 10.9819 10.9819 11.0531 11.0531 11.1366 11.1366 11.3100 11.3100 11.4421 11.4421 11.5966 11.5966 11.8174 11.8174 12.2005 12.2005 12.6240 12.6240 12.8836 12.8836 13.0801 13.0801 13.1880 13.1880 13.3013 13.3013 13.4553 13.4553 13.5018 13.5018 13.7108 13.7108 14.0101 14.0101 14.4451 14.4451 14.5943 14.5943 14.6684 14.6684 14.8494 14.8494 15.1229 15.1229 16.9386 16.9386 17.3255 17.3255 17.9164 17.9164 18.1359 18.1359 18.2408 18.2408 19.0489 19.0489 19.7788 19.7788 k = 0.4118 0.4415 0.9055 ( 4410 PWs) bands (ev): 5.6919 5.6919 6.3020 6.3020 6.3866 6.3866 7.2952 7.2952 8.4711 8.4711 8.6619 8.6619 9.6611 9.6611 9.7629 9.7629 10.1167 10.1167 10.2336 10.2336 10.4667 10.4667 10.5696 10.5696 10.6576 10.6576 10.7188 10.7188 10.9563 10.9563 11.0565 11.0565 11.1466 11.1466 11.3254 11.3254 11.4327 11.4327 11.5950 11.5950 11.8191 11.8191 12.1860 12.1860 12.6282 12.6282 12.8963 12.8963 13.0830 13.0830 13.1850 13.1850 13.3057 13.3057 13.4531 13.4531 13.5053 13.5053 13.7047 13.7047 14.0091 14.0091 14.4376 14.4376 14.5949 14.5949 14.6651 14.6651 14.8547 14.8547 15.1210 15.1210 16.9754 16.9754 17.3850 17.3850 17.8672 17.8672 18.0795 18.0795 18.2083 18.2083 18.9754 18.9754 19.8892 19.8892 k = 0.4020 0.4585 0.9055 ( 4410 PWs) bands (ev): 5.6916 5.6916 6.3127 6.3127 6.3838 6.3838 7.2815 7.2815 8.4799 8.4799 8.6541 8.6541 9.6778 9.6778 9.7713 9.7713 10.1062 10.1062 10.2411 10.2411 10.4689 10.4689 10.5602 10.5602 10.6560 10.6560 10.7165 10.7165 10.9280 10.9280 11.0610 11.0610 11.1563 11.1563 11.3371 11.3371 11.4257 11.4257 11.5906 11.5906 11.8229 11.8229 12.1710 12.1710 12.6321 12.6321 12.9088 12.9088 13.0864 13.0864 13.1809 13.1809 13.3102 13.3102 13.4514 13.4514 13.5096 13.5096 13.6979 13.6979 14.0088 14.0088 14.4310 14.4310 14.5940 14.5940 14.6624 14.6624 14.8604 14.8604 15.1190 15.1190 17.0169 17.0169 17.4473 17.4473 17.8163 17.8163 18.0255 18.0255 18.1799 18.1799 18.8988 18.8988 20.0017 20.0017 k = 0.3922 0.4755 0.9055 ( 4406 PWs) bands (ev): 5.6912 5.6912 6.3234 6.3234 6.3811 6.3811 7.2678 7.2678 8.4895 8.4895 8.6452 8.6452 9.6941 9.6941 9.7797 9.7797 10.0930 10.0930 10.2530 10.2530 10.4690 10.4690 10.5536 10.5536 10.6551 10.6551 10.7159 10.7159 10.8982 10.8982 11.0663 11.0663 11.1660 11.1660 11.3409 11.3409 11.4249 11.4249 11.5836 11.5836 11.8286 11.8286 12.1558 12.1558 12.6355 12.6355 12.9206 12.9206 13.0903 13.0903 13.1757 13.1757 13.3143 13.3143 13.4502 13.4502 13.5145 13.5145 13.6906 13.6906 14.0093 14.0093 14.4255 14.4255 14.5917 14.5917 14.6603 14.6603 14.8661 14.8661 15.1166 15.1166 17.0628 17.0628 17.5102 17.5102 17.7649 17.7649 17.9741 17.9741 18.1575 18.1575 18.8201 18.8201 20.1148 20.1148 k = 0.3824 0.4924 0.9055 ( 4410 PWs) bands (ev): 5.6909 5.6909 6.3339 6.3339 6.3785 6.3785 7.2546 7.2546 8.5000 8.5000 8.6354 8.6354 9.7095 9.7095 9.7875 9.7875 10.0794 10.0794 10.2675 10.2675 10.4660 10.4660 10.5509 10.5509 10.6545 10.6545 10.7170 10.7170 10.8678 10.8678 11.0724 11.0724 11.1753 11.1753 11.3352 11.3352 11.4314 11.4314 11.5746 11.5746 11.8356 11.8356 12.1409 12.1409 12.6383 12.6383 12.9315 12.9315 13.0946 13.0946 13.1697 13.1697 13.3178 13.3178 13.4494 13.4494 13.5198 13.5198 13.6833 13.6833 14.0103 14.0103 14.4213 14.4213 14.5881 14.5881 14.6586 14.6586 14.8718 14.8718 15.1142 15.1142 17.1129 17.1129 17.5698 17.5698 17.7150 17.7150 17.9258 17.9258 18.1432 18.1432 18.7405 18.7405 20.2270 20.2270 k = 0.3725 0.5094 0.9055 ( 4418 PWs) bands (ev): 5.6906 5.6906 6.3437 6.3437 6.3762 6.3762 7.2424 7.2424 8.5112 8.5112 8.6247 8.6247 9.7239 9.7239 9.7936 9.7936 10.0674 10.0674 10.2833 10.2833 10.4597 10.4597 10.5524 10.5524 10.6538 10.6538 10.7198 10.7198 10.8379 10.8379 11.0791 11.0791 11.1842 11.1842 11.3230 11.3230 11.4425 11.4425 11.5645 11.5645 11.8431 11.8431 12.1269 12.1269 12.6406 12.6406 12.9410 12.9410 13.0992 13.0992 13.1633 13.1633 13.3207 13.3207 13.4490 13.4490 13.5253 13.5253 13.6762 13.6762 14.0116 14.0116 14.4185 14.4185 14.5837 14.5837 14.6574 14.6574 14.8771 14.8771 15.1117 15.1117 17.1661 17.1661 17.6143 17.6143 17.6761 17.6761 17.8810 17.8810 18.1402 18.1402 18.6609 18.6609 20.3363 20.3363 k = 0.3627 0.5264 0.9055 ( 4432 PWs) bands (ev): 5.6904 5.6904 6.3522 6.3522 6.3742 6.3742 7.2318 7.2318 8.5231 8.5231 8.6131 8.6131 9.7369 9.7369 9.7970 9.7970 10.0583 10.0583 10.2990 10.2990 10.4514 10.4514 10.5573 10.5573 10.6529 10.6529 10.7238 10.7238 10.8098 10.8098 11.0859 11.0859 11.1922 11.1922 11.3082 11.3082 11.4546 11.4546 11.5543 11.5543 11.8502 11.8502 12.1145 12.1145 12.6423 12.6423 12.9488 12.9488 13.1039 13.1039 13.1569 13.1569 13.3227 13.3227 13.4490 13.4490 13.5303 13.5303 13.6701 13.6701 14.0130 14.0130 14.4172 14.4172 14.5790 14.5790 14.6563 14.6563 14.8817 14.8817 15.1095 15.1095 17.2209 17.2209 17.5993 17.5993 17.6894 17.6894 17.8404 17.8404 18.1520 18.1520 18.5827 18.5827 20.4395 20.4395 k = 0.3529 0.5434 0.9055 ( 4432 PWs) bands (ev): 5.6902 5.6902 6.3586 6.3586 6.3729 6.3729 7.2234 7.2234 8.5353 8.5353 8.6011 8.6011 9.7482 9.7482 9.7971 9.7971 10.0529 10.0529 10.3131 10.3131 10.4428 10.4428 10.5638 10.5638 10.6516 10.6516 10.7283 10.7283 10.7857 10.7857 11.0925 11.0925 11.1984 11.1984 11.2943 11.2943 11.4651 11.4651 11.5453 11.5453 11.8562 11.8562 12.1046 12.1046 12.6434 12.6434 12.9546 12.9546 13.1084 13.1084 13.1511 13.1511 13.3241 13.3241 13.4492 13.4492 13.5344 13.5344 13.6652 13.6652 14.0142 14.0142 14.4172 14.4172 14.5745 14.5745 14.6555 14.6555 14.8852 14.8852 15.1077 15.1077 17.2734 17.2734 17.5604 17.5604 17.7191 17.7191 17.8051 17.8051 18.1798 18.1798 18.5081 18.5081 20.5306 20.5306 k = 0.3431 0.5604 0.9055 ( 4428 PWs) bands (ev): 5.6901 5.6901 6.3623 6.3623 6.3726 6.3726 7.2180 7.2180 8.5468 8.5468 8.5897 8.5897 9.7571 9.7571 9.7947 9.7947 10.0506 10.0506 10.3235 10.3235 10.4359 10.4359 10.5698 10.5698 10.6503 10.6503 10.7317 10.7317 10.7690 10.7690 11.0977 11.0977 11.2018 11.2018 11.2844 11.2844 11.4721 11.4721 11.5392 11.5392 11.8601 11.8601 12.0982 12.0982 12.6440 12.6440 12.9582 12.9582 13.1118 13.1118 13.1467 13.1467 13.3248 13.3248 13.4495 13.4495 13.5371 13.5371 13.6622 13.6622 14.0151 14.0151 14.4177 14.4177 14.5711 14.5711 14.6550 14.6550 14.8874 14.8874 15.1065 15.1065 17.3152 17.3152 17.5292 17.5292 17.7393 17.7393 17.7773 17.7773 18.2182 18.2182 18.4435 18.4435 20.5969 20.5969 k = 0.3333 0.5774 0.9055 ( 4440 PWs) bands (ev): 5.6900 5.6900 6.3633 6.3633 6.3729 6.3729 7.2160 7.2160 8.5529 8.5529 8.5837 8.5837 9.7609 9.7609 9.7928 9.7928 10.0502 10.0502 10.3275 10.3275 10.4331 10.4331 10.5724 10.5724 10.6496 10.6496 10.7323 10.7323 10.7634 10.7634 11.0999 11.0999 11.2024 11.2024 11.2809 11.2809 11.4744 11.4744 11.5371 11.5371 11.8614 11.8614 12.0960 12.0960 12.6442 12.6442 12.9594 12.9594 13.1132 13.1132 13.1450 13.1450 13.3251 13.3251 13.4497 13.4497 13.5380 13.5380 13.6612 13.6612 14.0154 14.0154 14.4182 14.4182 14.5698 14.5698 14.6547 14.6547 14.8882 14.8882 15.1061 15.1061 17.3318 17.3318 17.5178 17.5178 17.7485 17.7485 17.7632 17.7632 18.2417 18.2417 18.4119 18.4119 20.6205 20.6205 k = 0.3333 0.5774 0.9055 ( 4440 PWs) bands (ev): 5.6900 5.6900 6.3633 6.3633 6.3729 6.3729 7.2160 7.2160 8.5529 8.5529 8.5837 8.5837 9.7609 9.7609 9.7928 9.7928 10.0502 10.0502 10.3275 10.3275 10.4331 10.4331 10.5724 10.5724 10.6496 10.6496 10.7323 10.7323 10.7634 10.7634 11.0999 11.0999 11.2024 11.2024 11.2809 11.2809 11.4744 11.4744 11.5371 11.5371 11.8614 11.8614 12.0960 12.0960 12.6442 12.6442 12.9594 12.9594 13.1132 13.1132 13.1450 13.1450 13.3251 13.3251 13.4497 13.4497 13.5380 13.5380 13.6612 13.6612 14.0154 14.0154 14.4182 14.4182 14.5698 14.5698 14.6547 14.6547 14.8882 14.8882 15.1061 15.1061 17.3318 17.3318 17.5178 17.5178 17.7485 17.7485 17.7632 17.7632 18.2417 18.2417 18.4119 18.4119 20.6205 20.6205 k = 0.3232 0.5599 0.9055 ( 4432 PWs) bands (ev): 5.6901 5.6901 6.3626 6.3626 6.3722 6.3722 7.2183 7.2183 8.5459 8.5459 8.5906 8.5906 9.7565 9.7565 9.7955 9.7955 10.0500 10.0500 10.3230 10.3230 10.4361 10.4361 10.5691 10.5691 10.6507 10.6507 10.7338 10.7338 10.7674 10.7674 11.0969 11.0969 11.2031 11.2031 11.2840 11.2840 11.4726 11.4726 11.5387 11.5387 11.8601 11.8601 12.0984 12.0984 12.6440 12.6440 12.9582 12.9582 13.1118 13.1118 13.1468 13.1468 13.3249 13.3249 13.4494 13.4494 13.5371 13.5371 13.6622 13.6622 14.0150 14.0150 14.4173 14.4173 14.5716 14.5716 14.6551 14.6551 14.8874 14.8874 15.1066 15.1066 17.3166 17.3166 17.5243 17.5243 17.7424 17.7424 17.7787 17.7787 18.2131 18.2131 18.4480 18.4480 20.5979 20.5979 k = 0.3131 0.5424 0.9055 ( 4422 PWs) bands (ev): 5.6902 5.6902 6.3601 6.3601 6.3703 6.3703 7.2253 7.2253 8.5317 8.5317 8.6049 8.6049 9.7458 9.7458 9.8017 9.8017 10.0480 10.0480 10.3103 10.3103 10.4433 10.4433 10.5601 10.5601 10.6540 10.6540 10.7401 10.7401 10.7771 10.7771 11.0877 11.0877 11.2074 11.2074 11.2918 11.2918 11.4692 11.4692 11.5420 11.5420 11.8565 11.8565 12.1056 12.1056 12.6435 12.6435 12.9544 12.9544 13.1083 13.1083 13.1512 13.1512 13.3244 13.3244 13.4485 13.4485 13.5347 13.5347 13.6649 13.6649 14.0139 14.0139 14.4140 14.4140 14.5775 14.5775 14.6562 14.6562 14.8851 14.8851 15.1079 15.1079 17.2827 17.2827 17.5286 17.5286 17.7351 17.7351 17.8180 17.8180 18.1567 18.1567 18.5258 18.5258 20.5323 20.5323 k = 0.3030 0.5249 0.9055 ( 4434 PWs) bands (ev): 5.6904 5.6904 6.3539 6.3539 6.3689 6.3689 7.2375 7.2375 8.5153 8.5153 8.6215 8.6215 9.7326 9.7326 9.8087 9.8087 10.0427 10.0427 10.2912 10.2912 10.4518 10.4518 10.5487 10.5487 10.6588 10.6588 10.7494 10.7494 10.7922 10.7922 11.0736 11.0736 11.2161 11.2161 11.3024 11.3024 11.4664 11.4664 11.5452 11.5452 11.8518 11.8518 12.1169 12.1169 12.6428 12.6428 12.9483 12.9483 13.1039 13.1039 13.1571 13.1571 13.3238 13.3238 13.4467 13.4467 13.5313 13.5313 13.6687 13.6687 14.0120 14.0120 14.4073 14.4073 14.5879 14.5879 14.6587 14.6587 14.8818 14.8818 15.1099 15.1099 17.2418 17.2418 17.5225 17.5225 17.7272 17.7272 17.8731 17.8731 18.1027 18.1027 18.6185 18.6185 20.4295 20.4295 k = 0.2929 0.5074 0.9055 ( 4430 PWs) bands (ev): 5.6908 5.6908 6.3430 6.3430 6.3691 6.3691 7.2550 7.2550 8.4979 8.4979 8.6393 8.6393 9.7185 9.7185 9.8151 9.8151 10.0332 10.0332 10.2671 10.2671 10.4582 10.4582 10.5389 10.5389 10.6649 10.6649 10.7577 10.7577 10.8138 10.8138 11.0574 11.0574 11.2280 11.2280 11.3149 11.3149 11.4656 11.4656 11.5474 11.5474 11.8471 11.8471 12.1317 12.1317 12.6419 12.6419 12.9403 12.9403 13.0990 13.0990 13.1637 13.1637 13.3231 13.3231 13.4437 13.4437 13.5275 13.5275 13.6732 13.6732 14.0094 14.0094 14.3973 14.3973 14.6019 14.6019 14.6632 14.6632 14.8778 14.8778 15.1124 15.1124 17.1989 17.1989 17.5093 17.5093 17.7185 17.7185 17.9112 17.9112 18.0831 18.0831 18.7176 18.7176 20.3051 20.3051 k = 0.2828 0.4899 0.9055 ( 4422 PWs) bands (ev): 5.6913 5.6913 6.3282 6.3282 6.3704 6.3704 7.2777 7.2777 8.4800 8.4800 8.6579 8.6579 9.7044 9.7044 9.8203 9.8203 10.0192 10.0192 10.2390 10.2390 10.4595 10.4595 10.5340 10.5340 10.6721 10.6721 10.7636 10.7636 10.8409 10.8409 11.0414 11.0414 11.2416 11.2416 11.3290 11.3290 11.4674 11.4674 11.5489 11.5489 11.8433 11.8433 12.1493 12.1493 12.6409 12.6409 12.9306 12.9306 13.0939 13.0939 13.1706 13.1706 13.3222 13.3222 13.4394 13.4394 13.5238 13.5238 13.6779 13.6779 14.0062 14.0062 14.3841 14.3841 14.6177 14.6177 14.6709 14.6709 14.8740 14.8740 15.1152 15.1152 17.1558 17.1558 17.4929 17.4929 17.7093 17.7093 17.8912 17.8912 18.1352 18.1352 18.8191 18.8191 20.1704 20.1704 k = 0.2727 0.4724 0.9055 ( 4418 PWs) bands (ev): 5.6918 5.6918 6.3099 6.3099 6.3726 6.3726 7.3054 7.3054 8.4618 8.4618 8.6772 8.6772 9.6909 9.6909 9.8238 9.8238 10.0007 10.0007 10.2073 10.2073 10.4549 10.4549 10.5349 10.5349 10.6804 10.6804 10.7671 10.7671 10.8708 10.8708 11.0277 11.0277 11.2552 11.2552 11.3451 11.3451 11.4713 11.4713 11.5507 11.5507 11.8411 11.8411 12.1692 12.1692 12.6397 12.6397 12.9197 12.9197 13.0886 13.0886 13.1776 13.1776 13.3213 13.3213 13.4339 13.4339 13.5203 13.5203 13.6824 13.6824 14.0023 14.0023 14.3680 14.3680 14.6326 14.6326 14.6839 14.6839 14.8713 14.8713 15.1179 15.1179 17.1134 17.1134 17.4756 17.4756 17.6994 17.6994 17.8422 17.8422 18.2279 18.2279 18.9202 18.9202 20.0306 20.0306 k = 0.2626 0.4549 0.9055 ( 4418 PWs) bands (ev): 5.6925 5.6925 6.2886 6.2886 6.3755 6.3755 7.3380 7.3380 8.4436 8.4436 8.6970 8.6970 9.6783 9.6783 9.8248 9.8248 9.9787 9.9787 10.1726 10.1726 10.4460 10.4460 10.5396 10.5396 10.6895 10.6895 10.7687 10.7687 10.8997 10.8997 11.0189 11.0189 11.2679 11.2679 11.3637 11.3637 11.4757 11.4757 11.5552 11.5552 11.8409 11.8409 12.1908 12.1908 12.6385 12.6385 12.9079 12.9079 13.0832 13.0832 13.1843 13.1843 13.3203 13.3203 13.4275 13.4275 13.5171 13.5171 13.6866 13.6866 13.9979 13.9979 14.3496 14.3496 14.6445 14.6445 14.7030 14.7030 14.8708 14.8708 15.1205 15.1205 17.0721 17.0721 17.4582 17.4582 17.6875 17.6875 17.7902 17.7902 18.3348 18.3348 19.0181 19.0181 19.8887 19.8887 k = 0.2525 0.4374 0.9055 ( 4430 PWs) bands (ev): 5.6933 5.6933 6.2649 6.2649 6.3792 6.3792 7.3749 7.3749 8.4256 8.4256 8.7172 8.7172 9.6665 9.6665 9.8223 9.8223 9.9542 9.9542 10.1355 10.1355 10.4345 10.4345 10.5463 10.5463 10.6993 10.6993 10.7687 10.7687 10.9224 10.9224 11.0193 11.0193 11.2789 11.2789 11.3852 11.3852 11.4788 11.4788 11.5649 11.5649 11.8427 11.8427 12.2138 12.2138 12.6371 12.6371 12.8956 12.8956 13.0777 13.0777 13.1904 13.1904 13.3192 13.3192 13.4202 13.4202 13.5143 13.5143 13.6903 13.6903 13.9931 13.9931 14.3291 14.3291 14.6537 14.6537 14.7266 14.7266 14.8740 14.8740 15.1226 15.1226 17.0320 17.0320 17.4408 17.4408 17.6692 17.6692 17.7463 17.7463 18.4482 18.4482 19.1093 19.1093 19.7468 19.7468 k = 0.2424 0.4199 0.9055 ( 4426 PWs) bands (ev): 5.6941 5.6941 6.2392 6.2392 6.3837 6.3837 7.4158 7.4158 8.4079 8.4079 8.7378 8.7378 9.6556 9.6556 9.8150 9.8150 9.9287 9.9287 10.0968 10.0968 10.4215 10.4215 10.5536 10.5536 10.7093 10.7093 10.7672 10.7672 10.9337 10.9337 11.0326 11.0326 11.2881 11.2881 11.4093 11.4093 11.4805 11.4805 11.5811 11.5811 11.8464 11.8464 12.2380 12.2380 12.6356 12.6356 12.8831 12.8831 13.0723 13.0723 13.1958 13.1958 13.3183 13.3183 13.4126 13.4126 13.5115 13.5115 13.6936 13.6936 13.9879 13.9879 14.3069 14.3069 14.6614 14.6614 14.7519 14.7519 14.8825 14.8825 15.1243 15.1243 16.9932 16.9932 17.4230 17.4230 17.6381 17.6381 17.7191 17.7191 18.5640 18.5640 19.1889 19.1889 19.6071 19.6071 k = 0.2323 0.4024 0.9055 ( 4430 PWs) bands (ev): 5.6951 5.6951 6.2119 6.2119 6.3889 6.3889 7.4605 7.4605 8.3907 8.3907 8.7585 8.7585 9.6456 9.6456 9.8013 9.8013 9.9037 9.9037 10.0577 10.0577 10.4074 10.4074 10.5612 10.5612 10.7191 10.7191 10.7645 10.7645 10.9356 10.9356 11.0555 11.0555 11.2955 11.2955 11.4344 11.4344 11.4834 11.4834 11.6032 11.6032 11.8517 11.8517 12.2630 12.2630 12.6338 12.6338 12.8707 12.8707 13.0669 13.0669 13.2000 13.2000 13.3176 13.3176 13.4050 13.4050 13.5087 13.5087 13.6965 13.6965 13.9825 13.9825 14.2832 14.2832 14.6682 14.6682 14.7769 14.7769 14.8979 14.8979 15.1255 15.1255 16.9556 16.9556 17.4041 17.4041 17.5985 17.5985 17.7060 17.7060 18.6781 18.6781 19.2489 19.2489 19.4739 19.4739 k = 0.2222 0.3849 0.9055 ( 4422 PWs) bands (ev): 5.6961 5.6961 6.1836 6.1836 6.3948 6.3948 7.5084 7.5084 8.3742 8.3742 8.7795 8.7795 9.6360 9.6360 9.7806 9.7806 9.8793 9.8793 10.0199 10.0199 10.3924 10.3924 10.5690 10.5690 10.7281 10.7281 10.7610 10.7610 10.9334 10.9334 11.0812 11.0812 11.3013 11.3013 11.4557 11.4557 11.4944 11.4944 11.6297 11.6297 11.8584 11.8584 12.2887 12.2887 12.6318 12.6318 12.8587 12.8587 13.0618 13.0618 13.2026 13.2026 13.3174 13.3174 13.3979 13.3979 13.5058 13.5058 13.6990 13.6990 13.9768 13.9768 14.2583 14.2583 14.6745 14.6745 14.8006 14.8006 14.9209 14.9209 15.1263 15.1263 16.9191 16.9191 17.3827 17.3827 17.5596 17.5596 17.6994 17.6994 18.7826 18.7826 19.2658 19.2658 19.3652 19.3652 k = 0.2121 0.3674 0.9055 ( 4424 PWs) bands (ev): 5.6972 5.6972 6.1545 6.1545 6.4014 6.4014 7.5593 7.5593 8.3586 8.3586 8.8004 8.8004 9.6263 9.6263 9.7538 9.7538 9.8535 9.8535 9.9858 9.9858 10.3766 10.3766 10.5770 10.5770 10.7351 10.7351 10.7578 10.7578 10.9304 10.9304 11.1053 11.1053 11.3056 11.3056 11.4686 11.4686 11.5193 11.5193 11.6594 11.6594 11.8664 11.8664 12.3147 12.3147 12.6293 12.6293 12.8474 12.8474 13.0569 13.0569 13.2032 13.2032 13.3177 13.3177 13.3920 13.3920 13.5027 13.5027 13.7013 13.7013 13.9710 13.9710 14.2325 14.2325 14.6803 14.6803 14.8236 14.8236 14.9506 14.9506 15.1270 15.1270 16.8835 16.8835 17.3574 17.3574 17.5259 17.5259 17.6957 17.6957 18.8583 18.8583 19.1941 19.1941 19.3203 19.3203 k = 0.2020 0.3499 0.9055 ( 4416 PWs) bands (ev): 5.6984 5.6984 6.1251 6.1251 6.4086 6.4086 7.6128 7.6128 8.3439 8.3439 8.8212 8.8212 9.6157 9.6157 9.7232 9.7232 9.8236 9.8236 9.9574 9.9574 10.3603 10.3603 10.5852 10.5852 10.7369 10.7369 10.7580 10.7580 10.9278 10.9278 11.1254 11.1254 11.3087 11.3087 11.4791 11.4791 11.5529 11.5529 11.6909 11.6909 11.8756 11.8756 12.3407 12.3407 12.6263 12.6263 12.8371 12.8371 13.0526 13.0526 13.2016 13.2016 13.3181 13.3181 13.3879 13.3879 13.4992 13.4992 13.7035 13.7035 13.9652 13.9652 14.2061 14.2061 14.6860 14.6860 14.8474 14.8474 14.9849 14.9849 15.1280 15.1280 16.8486 16.8486 17.3275 17.3275 17.4993 17.4993 17.6937 17.6937 18.8671 18.8671 19.1001 19.1001 19.2803 19.2803 k = 0.1919 0.3324 0.9055 ( 4416 PWs) bands (ev): 5.6996 5.6996 6.0957 6.0957 6.4164 6.4164 7.6687 7.6687 8.3302 8.3302 8.8418 8.8418 9.6024 9.6024 9.6915 9.6915 9.7886 9.7886 9.9351 9.9351 10.3436 10.3436 10.5937 10.5937 10.7322 10.7322 10.7626 10.7626 10.9259 10.9259 11.1405 11.1405 11.3116 11.3116 11.4912 11.4912 11.5904 11.5904 11.7231 11.7231 11.8862 11.8862 12.3664 12.3664 12.6228 12.6228 12.8281 12.8281 13.0488 13.0488 13.1978 13.1978 13.3178 13.3178 13.3870 13.3870 13.4955 13.4955 13.7057 13.7057 13.9593 13.9593 14.1793 14.1793 14.6918 14.6918 14.8731 14.8731 15.0211 15.0211 15.1308 15.1308 16.8142 16.8142 17.2932 17.2932 17.4795 17.4795 17.6928 17.6928 18.7987 18.7987 18.9984 18.9984 19.2341 19.2341 k = 0.1818 0.3149 0.9055 ( 4410 PWs) bands (ev): 5.7009 5.7009 6.0665 6.0665 6.4247 6.4247 7.7266 7.7266 8.3178 8.3178 8.8621 8.8621 9.5842 9.5842 9.6612 9.6612 9.7506 9.7506 9.9175 9.9175 10.3269 10.3269 10.6024 10.6024 10.7241 10.7241 10.7689 10.7689 10.9249 10.9249 11.1500 11.1500 11.3153 11.3153 11.5053 11.5053 11.6302 11.6302 11.7550 11.7550 11.8985 11.8985 12.3913 12.3913 12.6187 12.6187 12.8208 12.8208 13.0455 13.0455 13.1920 13.1920 13.3160 13.3160 13.3902 13.3902 13.4915 13.4915 13.7079 13.7079 13.9536 13.9536 14.1524 14.1524 14.6981 14.6981 14.9013 14.9013 15.0548 15.0548 15.1390 15.1390 16.7801 16.7801 17.2558 17.2558 17.4651 17.4651 17.6925 17.6925 18.6946 18.6946 18.8832 18.8832 19.1577 19.1577 k = 0.1717 0.2974 0.9055 ( 4422 PWs) bands (ev): 5.7021 5.7021 6.0377 6.0377 6.4334 6.4334 7.7864 7.7864 8.3067 8.3067 8.8820 8.8820 9.5592 9.5592 9.6327 9.6327 9.7131 9.7131 9.9028 9.9028 10.3105 10.3105 10.6113 10.6113 10.7141 10.7141 10.7752 10.7752 10.9248 10.9248 11.1542 11.1542 11.3209 11.3209 11.5208 11.5208 11.6711 11.6711 11.7851 11.7851 11.9132 11.9132 12.4148 12.4148 12.6139 12.6139 12.8155 12.8155 13.0428 13.0428 13.1847 13.1847 13.3124 13.3124 13.3975 13.3975 13.4874 13.4874 13.7104 13.7104 13.9480 13.9480 14.1258 14.1258 14.7052 14.7052 14.9318 14.9318 15.0789 15.0789 15.1593 15.1593 16.7459 16.7459 17.2166 17.2166 17.4546 17.4546 17.6927 17.6927 18.5813 18.5813 18.7624 18.7624 19.0543 19.0543 k = 0.1616 0.2799 0.9055 ( 4430 PWs) bands (ev): 5.7034 5.7034 6.0097 6.0097 6.4426 6.4426 7.8477 7.8477 8.2969 8.2969 8.9013 8.9013 9.5279 9.5279 9.6023 9.6023 9.6808 9.6808 9.8899 9.8899 10.2948 10.2948 10.6201 10.6201 10.7027 10.7027 10.7811 10.7811 10.9255 10.9255 11.1538 11.1538 11.3288 11.3288 11.5368 11.5368 11.7122 11.7122 11.8123 11.8123 11.9310 11.9310 12.4364 12.4364 12.6085 12.6085 12.8126 12.8126 13.0406 13.0406 13.1761 13.1761 13.3077 13.3077 13.4084 13.4084 13.4836 13.4836 13.7131 13.7131 13.9428 13.9428 14.0997 14.0997 14.7134 14.7134 14.9638 14.9638 15.0917 15.0917 15.1941 15.1941 16.7114 16.7114 17.1762 17.1762 17.4467 17.4467 17.6928 17.6928 18.4677 18.4677 18.6416 18.6416 18.9381 18.9381 k = 0.1515 0.2624 0.9055 ( 4434 PWs) bands (ev): 5.7047 5.7047 5.9826 5.9826 6.4520 6.4520 7.9102 7.9102 8.2885 8.2885 8.9199 8.9199 9.4929 9.4929 9.5665 9.5665 9.6557 9.6557 9.8783 9.8783 10.2801 10.2801 10.6284 10.6284 10.6907 10.6907 10.7866 10.7866 10.9269 10.9269 11.1500 11.1500 11.3388 11.3388 11.5525 11.5525 11.7527 11.7527 11.8357 11.8357 11.9522 11.9522 12.4554 12.4554 12.6024 12.6024 12.8122 12.8122 13.0386 13.0386 13.1670 13.1670 13.3024 13.3024 13.4212 13.4212 13.4808 13.4808 13.7161 13.7161 13.9380 13.9380 14.0744 14.0744 14.7226 14.7226 14.9951 14.9951 15.1014 15.1014 15.2374 15.2374 16.6763 16.6763 17.1349 17.1349 17.4405 17.4405 17.6927 17.6927 18.3574 18.3574 18.5234 18.5234 18.8178 18.8178 k = 0.1414 0.2449 0.9055 ( 4438 PWs) bands (ev): 5.7059 5.7059 5.9565 5.9565 6.4616 6.4616 7.9738 7.9738 8.2816 8.2816 8.9377 8.9377 9.4562 9.4562 9.5261 9.5261 9.6355 9.6355 9.8681 9.8681 10.2668 10.2668 10.6347 10.6347 10.6792 10.6792 10.7915 10.7915 10.9290 10.9290 11.1437 11.1437 11.3507 11.3507 11.5672 11.5672 11.7915 11.7915 11.8557 11.8557 11.9766 11.9766 12.4715 12.4715 12.5958 12.5958 12.8145 12.8145 13.0367 13.0367 13.1578 13.1578 13.2974 13.2974 13.4334 13.4334 13.4810 13.4810 13.7194 13.7194 13.9338 13.9338 14.0504 14.0504 14.7327 14.7327 15.0205 15.0205 15.1174 15.1174 15.2847 15.2847 16.6405 16.6405 17.0929 17.0929 17.4354 17.4354 17.6920 17.6920 18.2520 18.2520 18.4092 18.4092 18.6975 18.6975 k = 0.1313 0.2274 0.9055 ( 4434 PWs) bands (ev): 5.7071 5.7071 5.9317 5.9317 6.4713 6.4713 8.0382 8.0382 8.2760 8.2760 8.9545 8.9545 9.4191 9.4191 9.4839 9.4839 9.6162 9.6162 9.8594 9.8594 10.2552 10.2552 10.6352 10.6352 10.6723 10.6723 10.7959 10.7959 10.9315 10.9315 11.1359 11.1359 11.3641 11.3641 11.5806 11.5806 11.8270 11.8270 11.8740 11.8740 12.0030 12.0030 12.4843 12.4843 12.5887 12.5887 12.8192 12.8192 13.0345 13.0345 13.1492 13.1492 13.2931 13.2931 13.4410 13.4410 13.4876 13.4876 13.7230 13.7230 13.9302 13.9302 14.0282 14.0282 14.7436 14.7436 15.0350 15.0350 15.1464 15.1464 15.3339 15.3339 16.6038 16.6038 17.0500 17.0500 17.4308 17.4308 17.6901 17.6901 18.1526 18.1526 18.3004 18.3004 18.5797 18.5797 k = 0.1212 0.2099 0.9055 ( 4438 PWs) bands (ev): 5.7083 5.7083 5.9082 5.9082 6.4810 6.4810 8.1030 8.1030 8.2719 8.2719 8.9703 8.9703 9.3822 9.3822 9.4419 9.4419 9.5953 9.5953 9.8526 9.8526 10.2455 10.2455 10.6260 10.6260 10.6736 10.6736 10.7999 10.7999 10.9344 10.9344 11.1273 11.1273 11.3785 11.3785 11.5923 11.5923 11.8558 11.8558 11.8942 11.8942 12.0302 12.0302 12.4938 12.4938 12.5815 12.5815 12.8255 12.8255 13.0319 13.0319 13.1417 13.1417 13.2899 13.2899 13.4421 13.4421 13.5020 13.5020 13.7267 13.7267 13.9269 13.9269 14.0086 14.0086 14.7548 14.7548 15.0405 15.0405 15.1876 15.1876 15.3842 15.3842 16.5662 16.5662 17.0058 17.0058 17.4264 17.4264 17.6866 17.6866 18.0595 18.0595 18.1980 18.1980 18.4661 18.4661 k = 0.1111 0.1925 0.9055 ( 4442 PWs) bands (ev): 5.7094 5.7094 5.8863 5.8863 6.4905 6.4905 8.1681 8.1681 8.2691 8.2691 8.9847 8.9847 9.3462 9.3462 9.4015 9.4015 9.5715 9.5715 9.8478 9.8478 10.2382 10.2382 10.6102 10.6102 10.6800 10.6800 10.8035 10.8035 10.9376 10.9376 11.1185 11.1185 11.3939 11.3939 11.6021 11.6021 11.8751 11.8751 11.9199 11.9199 12.0570 12.0570 12.5001 12.5001 12.5743 12.5743 12.8326 12.8326 13.0288 13.0288 13.1360 13.1360 13.2881 13.2881 13.4393 13.4393 13.5208 13.5208 13.7304 13.7304 13.9228 13.9228 13.9934 13.9934 14.7658 14.7658 15.0416 15.0416 15.2367 15.2367 15.4349 15.4349 16.5278 16.5278 16.9600 16.9600 17.4217 17.4217 17.6806 17.6806 17.9728 17.9728 18.1033 18.1033 18.3586 18.3586 k = 0.1010 0.1750 0.9055 ( 4444 PWs) bands (ev): 5.7105 5.7105 5.8659 5.8659 6.4998 6.4998 8.2330 8.2330 8.2675 8.2675 8.9977 8.9977 9.3115 9.3115 9.3635 9.3635 9.5443 9.5443 9.8449 9.8449 10.2333 10.2333 10.5913 10.5913 10.6880 10.6880 10.8067 10.8067 10.9410 10.9410 11.1099 11.1099 11.4100 11.4100 11.6097 11.6097 11.8876 11.8876 11.9483 11.9483 12.0828 12.0828 12.5036 12.5036 12.5674 12.5674 12.8392 12.8392 13.0256 13.0256 13.1321 13.1321 13.2879 13.2879 13.4350 13.4350 13.5413 13.5413 13.7338 13.7338 13.9161 13.9161 13.9851 13.9851 14.7759 14.7759 15.0414 15.0414 15.2910 15.2910 15.4854 15.4854 16.4888 16.4888 16.9122 16.9122 17.4164 17.4164 17.6715 17.6715 17.8922 17.8922 18.0174 18.0174 18.2588 18.2588 k = 0.0909 0.1575 0.9055 ( 4444 PWs) bands (ev): 5.7115 5.7115 5.8472 5.8472 6.5086 6.5086 8.2670 8.2670 8.2975 8.2975 9.0090 9.0090 9.2787 9.2787 9.3284 9.3284 9.5137 9.5137 9.8436 9.8436 10.2312 10.2312 10.5706 10.5706 10.6962 10.6962 10.8097 10.8097 10.9444 10.9444 11.1017 11.1017 11.4265 11.4265 11.6152 11.6152 11.8968 11.8968 11.9763 11.9763 12.1067 12.1067 12.5048 12.5048 12.5610 12.5610 12.8441 12.8441 13.0230 13.0230 13.1300 13.1300 13.2893 13.2893 13.4299 13.4299 13.5621 13.5621 13.7367 13.7367 13.9055 13.9055 13.9853 13.9853 14.7842 14.7842 15.0417 15.0417 15.3489 15.3489 15.5353 15.5353 16.4499 16.4499 16.8621 16.8621 17.4102 17.4102 17.6582 17.6582 17.8178 17.8178 17.9408 17.9408 18.1690 18.1690 k = 0.0808 0.1400 0.9055 ( 4440 PWs) bands (ev): 5.7124 5.7124 5.8302 5.8302 6.5170 6.5170 8.2676 8.2676 8.3609 8.3609 9.0182 9.0182 9.2484 9.2484 9.2966 9.2966 9.4800 9.4800 9.8434 9.8434 10.2319 10.2319 10.5486 10.5486 10.7041 10.7041 10.8124 10.8124 10.9478 10.9478 11.0941 11.0941 11.4434 11.4434 11.6185 11.6185 11.9042 11.9042 12.0024 12.0024 12.1285 12.1285 12.5042 12.5042 12.5552 12.5552 12.8463 12.8463 13.0218 13.0218 13.1293 13.1293 13.2924 13.2924 13.4246 13.4246 13.5823 13.5823 13.7389 13.7389 13.8917 13.8917 13.9932 13.9932 14.7901 14.7901 15.0435 15.0435 15.4091 15.4091 15.5842 15.5842 16.4117 16.4117 16.8095 16.8095 17.4027 17.4027 17.6394 17.6394 17.7505 17.7505 17.8735 17.8735 18.0912 18.0912 k = 0.0707 0.1225 0.9055 ( 4446 PWs) bands (ev): 5.7132 5.7132 5.8151 5.8151 6.5247 6.5247 8.2689 8.2689 8.4227 8.4227 9.0250 9.0250 9.2216 9.2216 9.2683 9.2683 9.4440 9.4440 9.8441 9.8441 10.2355 10.2355 10.5257 10.5257 10.7114 10.7114 10.8149 10.8149 10.9510 10.9510 11.0873 11.0873 11.4604 11.4604 11.6196 11.6196 11.9103 11.9103 12.0261 12.0261 12.1479 12.1479 12.5025 12.5025 12.5502 12.5502 12.8455 12.8455 13.0225 13.0225 13.1294 13.1294 13.2970 13.2970 13.4190 13.4190 13.6014 13.6014 13.7403 13.7403 13.8766 13.8766 14.0068 14.0068 14.7930 14.7930 15.0474 15.0474 15.4703 15.4703 15.6316 15.6316 16.3751 16.3751 16.7545 16.7545 17.3934 17.3934 17.6134 17.6134 17.6931 17.6931 17.8141 17.8141 18.0270 18.0270 k = 0.0606 0.1050 0.9055 ( 4446 PWs) bands (ev): 5.7139 5.7139 5.8019 5.8019 6.5317 6.5317 8.2707 8.2707 8.4823 8.4823 9.0289 9.0289 9.1990 9.1990 9.2438 9.2438 9.4063 9.4063 9.8451 9.8451 10.2420 10.2420 10.5021 10.5021 10.7180 10.7180 10.8171 10.8171 10.9540 10.9540 11.0815 11.0815 11.4773 11.4773 11.6185 11.6185 11.9154 11.9154 12.0470 12.0470 12.1648 12.1648 12.5003 12.5003 12.5458 12.5458 12.8418 12.8418 13.0250 13.0250 13.1299 13.1299 13.3028 13.3028 13.4134 13.4134 13.6190 13.6190 13.7411 13.7411 13.8613 13.8613 14.0242 14.0242 14.7927 14.7927 15.0534 15.0534 15.5307 15.5307 15.6775 15.6775 16.3412 16.3412 16.6974 16.6974 17.3822 17.3822 17.5785 17.5785 17.6495 17.6495 17.7614 17.7614 17.9768 17.9768 k = 0.0505 0.0875 0.9055 ( 4442 PWs) bands (ev): 5.7145 5.7145 5.7906 5.7906 6.5378 6.5378 8.2730 8.2730 8.5385 8.5385 9.0298 9.0298 9.1811 9.1811 9.2234 9.2234 9.3681 9.3681 9.8462 9.8462 10.2511 10.2511 10.4784 10.4784 10.7237 10.7237 10.8190 10.8190 10.9567 10.9567 11.0765 11.0765 11.4940 11.4940 11.6154 11.6154 11.9196 11.9196 12.0650 12.0650 12.1790 12.1790 12.4978 12.4978 12.5421 12.5421 12.8362 12.8362 13.0289 13.0289 13.1304 13.1304 13.3097 13.3097 13.4078 13.4078 13.6348 13.6348 13.7416 13.7416 13.8464 13.8464 14.0435 14.0435 14.7897 14.7897 15.0610 15.0610 15.5877 15.5877 15.7221 15.7221 16.3110 16.3110 16.6392 16.6392 17.3687 17.3687 17.5393 17.5393 17.6183 17.6183 17.7153 17.7153 17.9390 17.9390 k = 0.0404 0.0700 0.9055 ( 4446 PWs) bands (ev): 5.7151 5.7151 5.7813 5.7813 6.5430 6.5430 8.2752 8.2752 8.5900 8.5900 9.0278 9.0278 9.1677 9.1677 9.2080 9.2080 9.3305 9.3305 9.8473 9.8473 10.2626 10.2626 10.4548 10.4548 10.7285 10.7285 10.8207 10.8207 10.9590 10.9590 11.0725 11.0725 11.5102 11.5102 11.6105 11.6105 11.9229 11.9229 12.0799 12.0799 12.1905 12.1905 12.4955 12.4955 12.5392 12.5392 12.8298 12.8298 13.0333 13.0333 13.1309 13.1309 13.3171 13.3171 13.4021 13.4021 13.6488 13.6488 13.7420 13.7420 13.8324 13.8324 14.0629 14.0629 14.7849 14.7849 15.0693 15.0693 15.6378 15.6378 15.7660 15.7660 16.2855 16.2855 16.5816 16.5816 17.3535 17.3535 17.5035 17.5035 17.5940 17.5940 17.6771 17.6771 17.9111 17.9111 k = 0.0303 0.0525 0.9055 ( 4450 PWs) bands (ev): 5.7155 5.7155 5.7740 5.7740 6.5471 6.5471 8.2773 8.2773 8.6349 8.6349 9.0240 9.0240 9.1574 9.1574 9.1988 9.1988 9.2951 9.2951 9.8482 9.8482 10.2757 10.2757 10.4322 10.4322 10.7323 10.7323 10.8220 10.8220 10.9608 10.9608 11.0695 11.0695 11.5257 11.5257 11.6038 11.6038 11.9254 11.9254 12.0917 12.0917 12.1993 12.1993 12.4935 12.4935 12.5370 12.5370 12.8235 12.8235 13.0375 13.0375 13.1313 13.1313 13.3244 13.3244 13.3966 13.3966 13.6604 13.6604 13.7427 13.7427 13.8198 13.8198 14.0805 14.0805 14.7792 14.7792 15.0773 15.0773 15.6777 15.6777 15.8090 15.8090 16.2655 16.2655 16.5274 16.5274 17.3377 17.3377 17.4752 17.4752 17.5740 17.5740 17.6481 17.6481 17.8908 17.8908 k = 0.0202 0.0350 0.9055 ( 4450 PWs) bands (ev): 5.7158 5.7158 5.7688 5.7688 6.5501 6.5501 8.2790 8.2790 8.6706 8.6706 9.0197 9.0197 9.1494 9.1494 9.1968 9.1968 9.2637 9.2637 9.8488 9.8488 10.2893 10.2893 10.4118 10.4118 10.7350 10.7350 10.8230 10.8230 10.9621 10.9621 11.0673 11.0673 11.5401 11.5401 11.5958 11.5958 11.9272 11.9272 12.1001 12.1001 12.2056 12.2056 12.4920 12.4920 12.5355 12.5355 12.8184 12.8184 13.0409 13.0409 13.1315 13.1315 13.3309 13.3309 13.3917 13.3917 13.6693 13.6693 13.7439 13.7439 13.8093 13.8093 14.0946 14.0946 14.7740 14.7740 15.0839 15.0839 15.7054 15.7054 15.8480 15.8480 16.2515 16.2515 16.4808 16.4808 17.3238 17.3238 17.4555 17.4555 17.5582 17.5582 17.6284 17.6284 17.8767 17.8767 k = 0.0101 0.0175 0.9055 ( 4446 PWs) bands (ev): 5.7160 5.7160 5.7657 5.7657 6.5519 6.5519 8.2801 8.2801 8.6940 8.6940 9.0163 9.0163 9.1437 9.1437 9.2016 9.2016 9.2383 9.2383 9.8492 9.8492 10.3010 10.3010 10.3962 10.3962 10.7366 10.7366 10.8236 10.8236 10.9629 10.9629 11.0661 11.0661 11.5522 11.5522 11.5875 11.5875 11.9283 11.9283 12.1053 12.1053 12.2094 12.2094 12.4910 12.4910 12.5346 12.5346 12.8150 12.8150 13.0432 13.0432 13.1315 13.1315 13.3356 13.3356 13.3881 13.3881 13.6750 13.6750 13.7451 13.7451 13.8020 13.8020 14.1038 14.1038 14.7704 14.7704 15.0883 15.0883 15.7215 15.7215 15.8764 15.8764 16.2434 16.2434 16.4483 16.4483 17.3142 17.3142 17.4439 17.4439 17.5479 17.5479 17.6174 17.6174 17.8683 17.8683 k = 0.0000 0.0000 0.9055 ( 4430 PWs) bands (ev): 5.7160 5.7160 5.7646 5.7646 6.5525 6.5525 8.2804 8.2804 8.7021 8.7021 9.0151 9.0151 9.1417 9.1417 9.2083 9.2083 9.2247 9.2247 9.8493 9.8493 10.3059 10.3059 10.3898 10.3898 10.7371 10.7371 10.8239 10.8239 10.9632 10.9632 11.0656 11.0656 11.5581 11.5581 11.5828 11.5828 11.9286 11.9286 12.1070 12.1070 12.2106 12.2106 12.4907 12.4907 12.5343 12.5343 12.8138 12.8138 13.0439 13.0439 13.1316 13.1316 13.3374 13.3374 13.3867 13.3867 13.6769 13.6769 13.7457 13.7457 13.7993 13.7993 14.1069 14.1069 14.7691 14.7691 15.0898 15.0898 15.7267 15.7267 15.8869 15.8869 16.2408 16.2408 16.4364 16.4364 17.3108 17.3108 17.4401 17.4401 17.5444 17.5444 17.6138 17.6138 17.8655 17.8655 k = 0.5000 0.2887 0.9055 ( 4416 PWs) bands (ev): 5.6939 5.6939 6.2477 6.2477 6.4015 6.4015 7.3667 7.3667 8.4335 8.4335 8.6932 8.6932 9.5680 9.5680 9.7250 9.7250 10.0945 10.0945 10.2797 10.2797 10.4423 10.4423 10.6354 10.6354 10.6887 10.6887 10.7931 10.7931 11.0365 11.0365 11.0433 11.0433 11.0679 11.0679 11.2701 11.2701 11.4736 11.4736 11.5735 11.5735 11.8350 11.8350 12.2654 12.2654 12.5978 12.5978 12.8201 12.8201 13.0724 13.0724 13.1854 13.1854 13.2829 13.2829 13.4703 13.4703 13.4943 13.4943 13.7283 13.7283 14.0270 14.0270 14.4933 14.4933 14.5703 14.5703 14.6911 14.6911 14.8275 14.8275 15.1280 15.1280 16.8050 16.8050 17.0723 17.0723 18.1342 18.1342 18.4411 18.4411 18.5463 18.5463 19.1271 19.1271 19.4256 19.4256 k = 0.5000 0.2887 0.8849 ( 4420 PWs) bands (ev): 5.6893 5.6911 6.2473 6.2495 6.3977 6.3981 7.3669 7.3706 8.4364 8.4376 8.6892 8.6987 9.5631 9.5703 9.7230 9.7235 10.0890 10.0997 10.2773 10.2803 10.4388 10.4457 10.6288 10.6399 10.6857 10.6914 10.7885 10.7970 11.0151 11.0274 11.0489 11.0494 11.0713 11.0745 11.2614 11.2828 11.4516 11.4946 11.5718 11.5772 11.8123 11.8543 12.2617 12.2684 12.5871 12.6043 12.8209 12.8234 13.0679 13.0845 13.1836 13.1906 13.2783 13.2877 13.4687 13.4730 13.4912 13.4981 13.7296 13.7303 14.0239 14.0330 14.4874 14.4987 14.5624 14.5804 14.6753 14.7089 14.8218 14.8334 15.1235 15.1334 16.8031 16.8093 17.0694 17.0804 18.1063 18.1494 18.4367 18.4432 18.5356 18.5529 19.0941 19.1409 19.4108 19.4543 k = 0.5000 0.2887 0.8643 ( 4408 PWs) bands (ev): 5.6776 5.6811 6.2483 6.2525 6.3871 6.3878 7.3710 7.3785 8.4461 8.4486 8.6868 8.7057 9.5556 9.5697 9.7177 9.7183 10.0834 10.1047 10.2733 10.2790 10.4353 10.4491 10.6209 10.6419 10.6825 10.6934 10.7844 10.7993 10.9915 11.0059 11.0448 11.0484 11.0828 11.0879 11.2574 11.2978 11.4297 11.5128 11.5706 11.5849 11.7863 11.8704 12.2576 12.2701 12.5733 12.6064 12.8255 12.8305 13.0715 13.1029 13.1851 13.1993 13.2738 13.2926 13.4689 13.4756 13.4884 13.5036 13.7339 13.7354 14.0238 14.0421 14.4819 14.5020 14.5582 14.5915 14.6618 14.7289 14.8161 14.8395 15.1200 15.1398 16.8039 16.8158 17.0714 17.0937 18.0671 18.1509 18.4309 18.4408 18.5221 18.5552 19.0509 19.1274 19.4165 19.4897 k = 0.5000 0.2887 0.8438 ( 4412 PWs) bands (ev): 5.6592 5.6641 6.2504 6.2563 6.3697 6.3708 7.3791 7.3904 8.4622 8.4662 8.6858 8.7142 9.5458 9.5661 9.7089 9.7094 10.0780 10.1091 10.2677 10.2758 10.4320 10.4524 10.6123 10.6407 10.6792 10.6944 10.7815 10.7991 10.9669 10.9820 11.0328 11.0447 11.0881 11.1071 11.2581 11.3140 11.4089 11.5270 11.5685 11.5974 11.7578 11.8840 12.2536 12.2704 12.5577 12.6051 12.8331 12.8409 13.0825 13.1256 13.1896 13.2112 13.2695 13.2978 13.4709 13.4765 13.4858 13.5121 13.7408 13.7435 14.0264 14.0545 14.4769 14.5019 14.5585 14.6011 14.6520 14.7513 14.8105 14.8464 15.1174 15.1474 16.8078 16.8248 17.0779 17.1121 18.0189 18.1391 18.4242 18.4293 18.5094 18.5534 19.0027 19.0876 19.4409 19.5279 k = 0.5000 0.2887 0.8232 ( 4416 PWs) bands (ev): 5.6348 5.6409 6.2531 6.2603 6.3463 6.3475 7.3910 7.4060 8.4841 8.4899 8.6863 8.7242 9.5339 9.5592 9.6952 9.6982 10.0729 10.1131 10.2607 10.2705 10.4289 10.4559 10.6035 10.6364 10.6759 10.6939 10.7804 10.7957 10.9414 10.9575 11.0161 11.0406 11.0898 11.1254 11.2629 11.3295 11.3896 11.5374 11.5643 11.6136 11.7282 11.8963 12.2503 12.2690 12.5421 12.6020 12.8428 12.8539 13.0998 13.1493 13.1983 13.2257 13.2657 13.3036 13.4744 13.4754 13.4841 13.5238 13.7498 13.7542 14.0317 14.0700 14.4724 14.4989 14.5627 14.6048 14.6504 14.7750 14.8068 14.8546 15.1161 15.1565 16.8155 16.8368 17.0881 17.1353 17.9637 18.1153 18.4041 18.4166 18.5016 18.5477 18.9528 19.0289 19.4761 19.5671 k = 0.5000 0.2887 0.8026 ( 4416 PWs) bands (ev): 5.6052 5.6122 6.2561 6.2637 6.3176 6.3183 7.4063 7.4250 8.5111 8.5192 8.6883 8.7357 9.5201 9.5488 9.6767 9.6845 10.0684 10.1165 10.2526 10.2630 10.4262 10.4593 10.5948 10.6293 10.6725 10.6918 10.7810 10.7884 10.9153 10.9340 10.9965 11.0369 11.0883 11.1415 11.2704 11.3415 11.3740 11.5461 11.5573 11.6298 11.7005 11.9082 12.2480 12.2661 12.5277 12.5984 12.8539 12.8687 13.1217 13.1684 13.2141 13.2420 13.2630 13.3103 13.4726 13.4781 13.4844 13.5383 13.7602 13.7673 14.0399 14.0883 14.4680 14.4945 14.5687 14.5998 14.6589 14.7880 14.8173 14.8648 15.1164 15.1674 16.8280 16.8523 17.1016 17.1630 17.9037 18.0817 18.3647 18.4078 18.4987 18.5387 18.9028 18.9576 19.5160 19.6063 k = 0.5000 0.2887 0.7820 ( 4424 PWs) bands (ev): 5.5711 5.5787 6.2588 6.2635 6.2840 6.2868 7.4248 7.4473 8.5422 8.5533 8.6917 8.7488 9.5047 9.5345 9.6532 9.6687 10.0646 10.1195 10.2436 10.2536 10.4240 10.4627 10.5864 10.6202 10.6690 10.6881 10.7769 10.7826 10.8889 10.9122 10.9756 11.0341 11.0846 11.1545 11.2795 11.3393 11.3714 11.5473 11.5546 11.6368 11.6837 11.9208 12.2471 12.2620 12.5152 12.5956 12.8654 12.8852 13.1465 13.1795 13.2355 13.2585 13.2646 13.3186 13.4686 13.4798 13.4888 13.5550 13.7715 13.7824 14.0510 14.1087 14.4631 14.4902 14.5749 14.5903 14.6728 14.7846 14.8481 14.8782 15.1189 15.1807 16.8458 16.8718 17.1173 17.1949 17.8409 18.0404 18.3133 18.3975 18.4984 18.5267 18.8540 18.8775 19.5565 19.6447 k = 0.5000 0.2887 0.7614 ( 4428 PWs) bands (ev): 5.5332 5.5412 6.2391 6.2451 6.2609 6.2747 7.4462 7.4725 8.5765 8.5913 8.6967 8.7634 9.4880 9.5159 9.6244 9.6515 10.0617 10.1220 10.2342 10.2424 10.4223 10.4658 10.5786 10.6097 10.6653 10.6827 10.7615 10.7845 10.8622 10.8922 10.9553 11.0322 11.0798 11.1626 11.2894 11.3236 11.3798 11.5352 11.5641 11.6243 11.6884 11.9345 12.2478 12.2575 12.5052 12.5942 12.8768 12.9030 13.1723 13.1851 13.2455 13.2736 13.2833 13.3294 13.4638 13.4809 13.4958 13.5734 13.7830 13.7991 14.0647 14.1300 14.4572 14.4870 14.5796 14.5804 14.6879 14.7780 14.8860 14.8960 15.1244 15.1966 16.8698 16.8959 17.1345 17.2307 17.7771 17.9937 18.2518 18.3854 18.4993 18.5120 18.7912 18.8067 19.5942 19.6808 k = 0.5000 0.2887 0.7409 ( 4418 PWs) bands (ev): 5.4922 5.5004 6.1980 6.2023 6.2619 6.2744 7.4702 7.5002 8.6127 8.6320 8.7033 8.7797 9.4704 9.4926 9.5905 9.6338 10.0599 10.1241 10.2247 10.2298 10.4211 10.4684 10.5714 10.5984 10.6613 10.6757 10.7431 10.7859 10.8358 10.8731 10.9374 11.0313 11.0750 11.1641 11.2999 11.3040 11.3880 11.5231 11.5750 11.6067 11.7017 11.9495 12.2503 12.2531 12.4978 12.5947 12.8874 12.9218 13.1877 13.1978 13.2449 13.2862 13.3147 13.3432 13.4584 13.4826 13.5039 13.5930 13.7944 13.8171 14.0808 14.1508 14.4500 14.4857 14.5687 14.5849 14.7019 14.7706 14.9197 14.9283 15.1341 15.2158 16.9005 16.9251 17.1515 17.2700 17.7145 17.9434 18.1821 18.3710 18.4948 18.5004 18.7007 18.7608 19.6248 19.7103 k = 0.5000 0.2887 0.7203 ( 4418 PWs) bands (ev): 5.4487 5.4569 6.1524 6.1563 6.2618 6.2738 7.4962 7.5301 8.6496 8.6734 8.7124 8.7977 9.4525 9.4642 9.5515 9.6166 10.0593 10.1260 10.2153 10.2162 10.4201 10.4699 10.5649 10.5867 10.6567 10.6671 10.7229 10.7860 10.8103 10.8539 10.9234 11.0309 11.0713 11.1574 11.2821 11.3112 11.3923 11.5138 11.5834 11.5976 11.7150 11.9660 12.2498 12.2546 12.4928 12.5972 12.8967 12.9413 13.1881 13.2211 13.2419 13.2966 13.3487 13.3595 13.4529 13.4849 13.5127 13.6131 13.8055 13.8361 14.0987 14.1694 14.4411 14.4865 14.5582 14.5881 14.7136 14.7630 14.9504 14.9739 15.1495 15.2388 16.9386 16.9598 17.1665 17.3126 17.6557 17.8914 18.1053 18.3534 18.4753 18.5014 18.6079 18.7157 19.6406 19.7238 k = 0.5000 0.2887 0.6997 ( 4410 PWs) bands (ev): 5.4031 5.4113 6.1039 6.1076 6.2604 6.2721 7.5239 7.5617 8.6858 8.7074 8.7309 8.8176 9.4307 9.4349 9.5081 9.6009 10.0599 10.1276 10.2021 10.2062 10.4190 10.4699 10.5592 10.5747 10.6511 10.6571 10.7023 10.7784 10.7921 10.8343 10.9139 11.0307 11.0692 11.1423 11.2581 11.3235 11.3912 11.5102 11.5786 11.6101 11.7262 11.9837 12.2482 12.2606 12.4901 12.6017 12.9045 12.9612 13.1869 13.2381 13.2401 13.3067 13.3769 13.3824 13.4474 13.4873 13.5223 13.6332 13.8165 13.8556 14.1176 14.1845 14.4307 14.4894 14.5482 14.5900 14.7223 14.7552 14.9886 15.0215 15.1728 15.2661 16.9844 16.9998 17.1763 17.3584 17.6043 17.8392 18.0231 18.3309 18.4531 18.5022 18.5157 18.6710 19.6309 19.7057 k = 0.5000 0.2887 0.6791 ( 4408 PWs) bands (ev): 5.3559 5.3639 6.0533 6.0567 6.2576 6.2689 7.5530 7.5946 8.7197 8.7235 8.7678 8.8394 9.3923 9.4182 9.4611 9.5880 10.0618 10.1291 10.1879 10.1972 10.4174 10.4679 10.5544 10.5625 10.6437 10.6459 10.6829 10.7563 10.7881 10.8149 10.9086 11.0304 11.0687 11.1199 11.2325 11.3366 11.3848 11.5136 11.5743 11.6302 11.7350 12.0024 12.2487 12.2682 12.4895 12.6079 12.9108 12.9813 13.1842 13.2334 13.2529 13.3182 13.3946 13.4146 13.4420 13.4896 13.5330 13.6524 13.8276 13.8752 14.1364 14.1950 14.4187 14.4938 14.5388 14.5910 14.7279 14.7475 15.0341 15.0696 15.2063 15.2981 17.0379 17.0447 17.1766 17.4071 17.5652 17.7885 17.9367 18.2987 18.4188 18.4394 18.5027 18.6260 19.5906 19.6518 k = 0.5000 0.2887 0.6585 ( 4424 PWs) bands (ev): 5.3075 5.3152 6.0009 6.0042 6.2535 6.2644 7.5830 7.6285 8.7355 8.7499 8.8073 8.8631 9.3494 9.3983 9.4168 9.5787 10.0651 10.1305 10.1740 10.1882 10.4147 10.4633 10.5504 10.5504 10.6325 10.6338 10.6669 10.7329 10.7855 10.7964 10.9072 11.0303 11.0688 11.0925 11.2068 11.3502 11.3751 11.5230 11.5734 11.6542 11.7412 12.0221 12.2516 12.2770 12.4907 12.6155 12.9155 13.0013 13.1801 13.2282 13.2589 13.3311 13.4121 13.4370 13.4440 13.4914 13.5450 13.6700 13.8390 13.8942 14.1540 14.2010 14.4056 14.4983 14.5303 14.5909 14.7307 14.7398 15.0865 15.1173 15.2515 15.3351 17.0936 17.0991 17.1631 17.4586 17.5430 17.7414 17.8473 18.2452 18.3550 18.4087 18.5030 18.5799 19.5268 19.5759 k = 0.5000 0.2887 0.6380 ( 4426 PWs) bands (ev): 5.2582 5.2657 5.9474 5.9505 6.2480 6.2584 7.6135 7.6629 8.7476 8.7755 8.8430 8.8880 9.3029 9.3520 9.4009 9.5741 10.0698 10.1319 10.1603 10.1789 10.4100 10.4564 10.5388 10.5466 10.6170 10.6209 10.6556 10.7102 10.7794 10.7823 10.9093 11.0305 11.0626 11.0669 11.1841 11.3638 11.3643 11.5367 11.5748 11.6814 11.7452 12.0428 12.2568 12.2869 12.4937 12.6242 12.9189 13.0210 13.1747 13.2224 13.2595 13.3439 13.4282 13.4330 13.4690 13.4931 13.5587 13.6854 13.8510 13.9121 14.1695 14.2027 14.3916 14.5019 14.5229 14.5901 14.7311 14.7320 15.1452 15.1655 15.3079 15.3774 17.1339 17.1440 17.1675 17.5124 17.5396 17.7009 17.7566 18.1661 18.3085 18.3822 18.5032 18.5323 19.4505 19.4906 k = 0.5000 0.2887 0.6174 ( 4418 PWs) bands (ev): 5.2084 5.2155 5.8931 5.8959 6.2413 6.2511 7.6441 7.6974 8.7604 8.7958 8.8721 8.9133 9.2535 9.2972 9.3984 9.5751 10.0759 10.1333 10.1471 10.1692 10.4025 10.4471 10.5285 10.5421 10.5994 10.6072 10.6473 10.6886 10.7643 10.7785 10.9149 11.0313 11.0326 11.0597 11.1686 11.3537 11.3771 11.5534 11.5779 11.7113 11.7475 12.0644 12.2640 12.2976 12.4982 12.6337 12.9214 13.0401 13.1681 13.2164 13.2562 13.3551 13.4265 13.4464 13.4843 13.4990 13.5743 13.6982 13.8635 13.9281 14.1820 14.2012 14.3770 14.5033 14.5168 14.5887 14.7239 14.7294 15.2095 15.2160 15.3736 15.4247 17.0926 17.1915 17.2408 17.5519 17.5680 17.6674 17.6713 18.0756 18.2709 18.3554 18.4824 18.5040 19.3686 19.4022 k = 0.5000 0.2887 0.5968 ( 4414 PWs) bands (ev): 5.1582 5.1650 5.8384 5.8410 6.2334 6.2426 7.6745 7.7316 8.7737 8.8104 8.8923 8.9380 9.2022 9.2408 9.4052 9.5824 10.0836 10.1342 10.1345 10.1586 10.3916 10.4357 10.5203 10.5357 10.5824 10.5925 10.6401 10.6681 10.7512 10.7743 10.9238 11.0047 11.0319 11.0464 11.1632 11.3442 11.3897 11.5724 11.5820 11.7412 11.7510 12.0870 12.2728 12.3089 12.5039 12.6435 12.9231 13.0584 13.1600 13.2104 13.2499 13.3638 13.4212 13.4623 13.4858 13.5129 13.5911 13.7081 13.8762 13.9417 14.1911 14.1971 14.3622 14.5021 14.5123 14.5867 14.7154 14.7260 15.2701 15.2787 15.4467 15.4769 17.0436 17.2295 17.3142 17.5601 17.6005 17.6244 17.6581 17.9850 18.2338 18.3287 18.4303 18.5053 19.2852 19.3139 k = 0.5000 0.2887 0.5762 ( 4418 PWs) bands (ev): 5.1080 5.1144 5.7835 5.7859 6.2244 6.2330 7.7043 7.7651 8.7874 8.8188 8.9022 8.9618 9.1498 9.1840 9.4219 9.5961 10.0929 10.1216 10.1352 10.1476 10.3771 10.4219 10.5145 10.5269 10.5678 10.5765 10.6333 10.6487 10.7402 10.7696 10.9358 10.9807 11.0224 11.0396 11.1663 11.3362 11.4015 11.5867 11.5930 11.7475 11.7794 12.1108 12.2827 12.3205 12.5108 12.6534 12.9245 13.0757 13.1506 13.2047 13.2415 13.3701 13.4152 13.4772 13.4831 13.5257 13.6081 13.7153 13.8887 13.9522 14.1914 14.1966 14.3476 14.4982 14.5094 14.5843 14.7062 14.7210 15.3280 15.3520 15.5254 15.5332 16.9916 17.2504 17.3630 17.5167 17.6236 17.6612 17.6806 17.9056 18.1942 18.3026 18.3754 18.5083 19.2027 19.2275 k = 0.5000 0.2887 0.5556 ( 4426 PWs) bands (ev): 5.0580 5.0640 5.7288 5.7310 6.2144 6.2224 7.7331 7.7973 8.8011 8.8209 8.9020 8.9842 9.0974 9.1277 9.4482 9.6160 10.1038 10.1090 10.1307 10.1404 10.3597 10.4049 10.5107 10.5165 10.5557 10.5592 10.6263 10.6306 10.7314 10.7648 10.9497 10.9629 11.0037 11.0425 11.1745 11.3301 11.4124 11.5915 11.6150 11.7484 11.8147 12.1358 12.2932 12.3321 12.5186 12.6629 12.9258 13.0918 13.1399 13.1995 13.2313 13.3738 13.4086 13.4787 13.4906 13.5359 13.6241 13.7198 13.9001 13.9594 14.1847 14.1989 14.3336 14.4918 14.5078 14.5815 14.6963 14.7147 15.3892 15.4286 15.5926 15.6088 16.9401 17.2521 17.3285 17.5430 17.6541 17.6708 17.7401 17.8633 18.1514 18.2784 18.3179 18.5140 19.1225 19.1441 k = 0.5000 0.2887 0.5351 ( 4414 PWs) bands (ev): 5.0084 5.0139 5.6746 5.6765 6.2035 6.2109 7.7605 7.8279 8.8141 8.8164 8.8934 9.0037 9.0478 9.0730 9.4826 9.6411 10.0960 10.1168 10.1177 10.1405 10.3402 10.3841 10.5065 10.5079 10.5404 10.5455 10.6141 10.6188 10.7251 10.7597 10.9464 10.9708 10.9868 11.0473 11.1853 11.3264 11.4224 11.5962 11.6379 11.7496 11.8511 12.1622 12.3039 12.3434 12.5272 12.6720 12.9275 13.1063 13.1277 13.1950 13.2197 13.3747 13.4020 13.4728 13.5022 13.5439 13.6380 13.7220 13.9100 13.9630 14.1774 14.1985 14.3206 14.4835 14.5073 14.5786 14.6855 14.7073 15.4524 15.5071 15.6539 15.6959 16.8923 17.2395 17.2494 17.6015 17.6044 17.7345 17.8123 17.8771 18.1063 18.2579 18.2584 18.5236 19.0457 19.0645 k = 0.5000 0.2887 0.5145 ( 4418 PWs) bands (ev): 4.9593 4.9645 5.6210 5.6227 6.1919 6.1986 7.7862 7.8563 8.8057 8.8239 8.8801 8.9868 9.0209 9.0356 9.5229 9.6699 10.0826 10.1025 10.1317 10.1417 10.3197 10.3594 10.4974 10.5033 10.5215 10.5371 10.6003 10.6110 10.7214 10.7548 10.9390 10.9740 10.9913 11.0534 11.1970 11.3257 11.4316 11.6005 11.6615 11.7520 11.8879 12.1900 12.3143 12.3543 12.5363 12.6803 12.9298 13.1144 13.1189 13.1914 13.2071 13.3713 13.3973 13.4657 13.5115 13.5498 13.6491 13.7219 13.9177 13.9631 14.1697 14.1962 14.3090 14.4736 14.5075 14.5755 14.6741 14.6990 15.5161 15.5857 15.7155 15.7858 16.8512 17.1633 17.2196 17.5222 17.6583 17.8154 17.8968 17.9136 18.0640 18.1992 18.2450 18.5389 18.9731 18.9893 k = 0.5000 0.2887 0.4939 ( 4418 PWs) bands (ev): 4.9110 4.9158 5.5682 5.5697 6.1796 6.1857 7.8097 7.8820 8.7894 8.8233 8.8702 8.9397 8.9733 9.0556 9.5671 9.7007 10.0685 10.0861 10.1431 10.1489 10.2993 10.3313 10.4887 10.4891 10.5089 10.5314 10.5903 10.6032 10.7204 10.7501 10.9367 10.9661 11.0146 11.0606 11.2083 11.3286 11.4399 11.6042 11.6855 11.7559 11.9244 12.2192 12.3242 12.3644 12.5460 12.6878 12.9328 13.1001 13.1292 13.1885 13.1934 13.3627 13.3959 13.4577 13.5184 13.5539 13.6573 13.7197 13.9230 13.9602 14.1616 14.1925 14.2993 14.4625 14.5080 14.5723 14.6620 14.6900 15.5783 15.6611 15.7760 15.8776 16.8201 17.0786 17.1978 17.4371 17.6999 17.9007 17.9253 17.9840 18.0492 18.1479 18.2475 18.5617 18.9054 18.9190 k = 0.5000 0.2887 0.4733 ( 4422 PWs) bands (ev): 4.8636 4.8680 5.5165 5.5178 6.1668 6.1723 7.8306 7.9044 8.7683 8.8056 8.8675 8.8931 8.9351 9.0776 9.6131 9.7315 10.0535 10.0690 10.1444 10.1685 10.2798 10.3008 10.4659 10.4797 10.5015 10.5284 10.5853 10.5965 10.7219 10.7462 10.9390 10.9630 11.0403 11.0689 11.2184 11.3356 11.4477 11.6073 11.7097 11.7614 11.9601 12.2499 12.3335 12.3736 12.5560 12.6943 12.9367 13.0849 13.1366 13.1791 13.1864 13.3506 13.3966 13.4490 13.5227 13.5562 13.6623 13.7155 13.9260 13.9545 14.1530 14.1881 14.2917 14.4507 14.5086 14.5690 14.6494 14.6806 15.6368 15.7274 15.8353 15.9698 16.8025 16.9993 17.1769 17.3552 17.7304 17.8920 17.9527 18.0179 18.1161 18.1361 18.2773 18.5933 18.8435 18.8546 k = 0.5000 0.2887 0.4527 ( 4422 PWs) bands (ev): 4.8172 4.8213 5.4660 5.4671 6.1535 6.1585 7.8487 7.9230 8.7434 8.7782 8.8494 8.8529 8.9196 9.1000 9.6593 9.7605 10.0376 10.0515 10.1453 10.1905 10.2621 10.2692 10.4399 10.4705 10.4935 10.5269 10.5852 10.5927 10.7255 10.7435 10.9453 10.9644 11.0682 11.0783 11.2270 11.3467 11.4551 11.6098 11.7338 11.7686 11.9941 12.2820 12.3421 12.3815 12.5666 12.6999 12.9414 13.0690 13.1404 13.1643 13.1848 13.3368 13.3985 13.4401 13.5243 13.5568 13.6643 13.7094 13.9270 13.9468 14.1438 14.1832 14.2865 14.4385 14.5091 14.5656 14.6365 14.6710 15.6894 15.7769 15.8942 16.0605 16.8009 16.9302 17.1553 17.2852 17.7487 17.8357 17.9330 18.0185 18.2000 18.2115 18.3400 18.6320 18.7890 18.8001 k = 0.5000 0.2887 0.4322 ( 4422 PWs) bands (ev): 4.7721 4.7758 5.4169 5.4178 6.1399 6.1444 7.8634 7.9374 8.7155 8.7468 8.8092 8.8233 8.9259 9.1225 9.7041 9.7858 10.0210 10.0338 10.1450 10.2140 10.2381 10.2473 10.4131 10.4621 10.4849 10.5246 10.5893 10.5937 10.7309 10.7425 10.9548 10.9695 11.0888 11.0980 11.2344 11.3617 11.4623 11.6118 11.7579 11.7773 12.0257 12.3153 12.3501 12.3880 12.5778 12.7045 12.9468 13.0528 13.1380 13.1510 13.1834 13.3225 13.4010 13.4314 13.5231 13.5555 13.6637 13.7016 13.9267 13.9376 14.1337 14.1778 14.2834 14.4260 14.5095 14.5619 14.6236 14.6615 15.7336 15.8045 15.9502 16.1464 16.8112 16.8829 17.1249 17.2415 17.7494 17.7719 17.8872 18.0056 18.2967 18.3014 18.4286 18.6590 18.7457 18.7760 k = 0.5000 0.2887 0.4116 ( 4414 PWs) bands (ev): 4.7282 4.7316 5.3693 5.3700 6.1262 6.1301 7.8745 7.9470 8.6856 8.7139 8.7731 8.7920 8.9395 9.1448 9.7462 9.8056 10.0043 10.0162 10.1414 10.2106 10.2276 10.2467 10.3862 10.4550 10.4769 10.5203 10.5963 10.6005 10.7379 10.7435 10.9669 10.9778 11.1004 11.1297 11.2411 11.3796 11.4694 11.6133 11.7817 11.7874 12.0540 12.3495 12.3578 12.3929 12.5899 12.7084 12.9521 13.0369 13.1255 13.1427 13.1818 13.3088 13.4037 13.4235 13.5188 13.5524 13.6608 13.6923 13.9257 13.9275 14.1229 14.1722 14.2823 14.4134 14.5096 14.5580 14.6108 14.6524 15.7677 15.8108 15.9951 16.2226 16.8074 16.8905 17.0846 17.2320 17.7053 17.7221 17.8521 17.9859 18.3774 18.3981 18.5283 18.6385 18.7245 18.8193 k = 0.5000 0.2887 0.3910 ( 4418 PWs) bands (ev): 4.6858 4.6888 5.3233 5.3239 6.1123 6.1157 7.8817 7.9516 8.6547 8.6805 8.7410 8.7636 8.9555 9.1668 9.7846 9.8182 9.9885 9.9986 10.1304 10.1918 10.2200 10.2704 10.3599 10.4498 10.4709 10.5149 10.6056 10.6122 10.7463 10.7470 10.9813 10.9887 11.1131 11.1629 11.2479 11.3996 11.4767 11.6145 11.7986 11.8054 12.0780 12.3655 12.3830 12.3972 12.6032 12.7115 12.9562 13.0221 13.1077 13.1342 13.1793 13.2964 13.4065 13.4170 13.5116 13.5476 13.6564 13.6821 13.9168 13.9248 14.1112 14.1663 14.2826 14.4007 14.5095 14.5536 14.5986 14.6441 15.7900 15.7994 16.0194 16.2817 16.8027 16.9454 17.0522 17.2463 17.6383 17.6680 17.8337 17.9635 18.4261 18.4919 18.6021 18.6202 18.7509 18.9024 k = 0.5000 0.2887 0.3704 ( 4418 PWs) bands (ev): 4.6450 4.6477 5.2791 5.2795 6.0984 6.1014 7.8850 7.9512 8.6236 8.6472 8.7128 8.7391 8.9726 9.1885 9.8181 9.8226 9.9747 9.9810 10.1103 10.1842 10.2128 10.2949 10.3348 10.4460 10.4683 10.5099 10.6170 10.6276 10.7532 10.7559 10.9973 11.0018 11.1269 11.1977 11.2554 11.4211 11.4844 11.6155 11.8109 11.8288 12.0970 12.3734 12.3946 12.4214 12.6181 12.7143 12.9566 13.0108 13.0875 13.1227 13.1751 13.2861 13.4090 13.4126 13.5013 13.5411 13.6510 13.6716 13.9060 13.9243 14.0990 14.1605 14.2839 14.3881 14.5093 14.5485 14.5873 14.6369 15.7742 15.8002 16.0174 16.3149 16.8232 17.0223 17.0441 17.2743 17.5745 17.6021 17.8209 17.9409 18.4348 18.5206 18.6255 18.7023 18.8351 19.0026 k = 0.5000 0.2887 0.3499 ( 4420 PWs) bands (ev): 4.6058 4.6082 5.2367 5.2370 6.0847 6.0873 7.8843 7.9460 8.5929 8.6145 8.6885 8.7189 8.9904 9.2097 9.8181 9.8460 9.9630 9.9638 10.0865 10.1834 10.2081 10.3086 10.3179 10.4428 10.4706 10.5071 10.6304 10.6455 10.7623 10.7670 11.0148 11.0166 11.1418 11.2338 11.2639 11.4434 11.4925 11.6161 11.8239 11.8521 12.1106 12.3816 12.3936 12.4554 12.6349 12.7170 12.9504 13.0054 13.0651 13.1083 13.1687 13.2778 13.4105 13.4107 13.4880 13.5336 13.6454 13.6612 13.8953 13.9246 14.0864 14.1549 14.2858 14.3755 14.5091 14.5425 14.5773 14.6312 15.7390 15.7984 15.9897 16.3169 16.8706 17.0681 17.1138 17.3058 17.5209 17.5338 17.8075 17.9202 18.4151 18.4823 18.7152 18.7932 18.9436 19.1118 k = 0.5000 0.2887 0.3293 ( 4420 PWs) bands (ev): 4.5683 4.5705 5.1963 5.1965 6.0711 6.0733 7.8798 7.9364 8.5631 8.5826 8.6681 8.7027 9.0089 9.2305 9.8056 9.8673 9.9446 9.9556 10.0638 10.1858 10.2058 10.2875 10.3310 10.4389 10.4782 10.5079 10.6462 10.6653 10.7744 10.7795 11.0331 11.0334 11.1575 11.2710 11.2740 11.4660 11.5010 11.6164 11.8377 11.8753 12.1188 12.3900 12.3901 12.4881 12.6538 12.7202 12.9378 13.0054 13.0403 13.0919 13.1596 13.2713 13.4108 13.4114 13.4725 13.5255 13.6402 13.6516 13.8847 13.9256 14.0739 14.1496 14.2877 14.3630 14.5090 14.5354 14.5690 14.6270 15.6968 15.7856 15.9422 16.2899 16.9374 17.1212 17.2158 17.3206 17.4687 17.4958 17.7919 17.9040 18.3834 18.4378 18.8118 18.8938 19.0558 19.2249 k = 0.5000 0.2887 0.3087 ( 4430 PWs) bands (ev): 4.5327 4.5347 5.1579 5.1580 6.0579 6.0598 7.8720 7.9231 8.5343 8.5517 8.6513 8.6901 9.0279 9.2508 9.7870 9.8802 9.9270 9.9493 10.0448 10.1896 10.2056 10.2666 10.3391 10.4335 10.4901 10.5128 10.6646 10.6861 10.7895 10.7937 11.0510 11.0529 11.1741 11.2858 11.3094 11.4886 11.5101 11.6163 11.8521 11.8985 12.1219 12.3840 12.3985 12.5178 12.6748 12.7248 12.9216 13.0072 13.0133 13.0747 13.1474 13.2663 13.4099 13.4127 13.4558 13.5181 13.6362 13.6431 13.8744 13.9270 14.0619 14.1448 14.2896 14.3505 14.5093 14.5274 14.5622 14.6247 15.6501 15.7633 15.8816 16.2417 17.0119 17.1870 17.3073 17.3255 17.4136 17.5144 17.7743 17.8961 18.3477 18.3940 18.9092 19.0007 19.1649 19.3378 k = 0.5000 0.2887 0.2881 ( 4426 PWs) bands (ev): 4.4990 4.5008 5.1217 5.1217 6.0451 6.0466 7.8612 7.9068 8.5065 8.5219 8.6380 8.6804 9.0475 9.2707 9.7644 9.8788 9.9164 9.9437 10.0304 10.1945 10.2072 10.2472 10.3423 10.4267 10.5037 10.5211 10.6857 10.7075 10.8073 10.8098 11.0702 11.0731 11.1912 11.2996 11.3486 11.5108 11.5195 11.6157 11.8670 11.9218 12.1209 12.3760 12.4067 12.5427 12.6973 12.7320 12.9041 12.9842 13.0085 13.0572 13.1324 13.2622 13.4037 13.4148 13.4413 13.5128 13.6342 13.6361 13.8643 13.9287 14.0508 14.1406 14.2912 14.3382 14.5102 14.5191 14.5565 14.6243 15.6007 15.7329 15.8133 16.1805 17.0750 17.2036 17.3354 17.3830 17.4403 17.5534 17.7551 17.9029 18.3113 18.3521 19.0061 19.1109 19.2679 19.4474 k = 0.5000 0.2887 0.2675 ( 4424 PWs) bands (ev): 4.4673 4.4689 5.0876 5.0876 6.0327 6.0340 7.8482 7.8884 8.4800 8.4934 8.6279 8.6729 9.0677 9.2902 9.7393 9.8612 9.9155 9.9382 10.0206 10.1999 10.2093 10.2300 10.3423 10.4189 10.5166 10.5314 10.7087 10.7287 10.8275 10.8280 11.0909 11.0937 11.2086 11.3155 11.3885 11.5289 11.5325 11.6148 11.8822 11.9451 12.1167 12.3661 12.4144 12.5608 12.7208 12.7427 12.8864 12.9536 13.0080 13.0401 13.1147 13.2586 13.3892 13.4151 13.4332 13.5113 13.6308 13.6348 13.8544 13.9300 14.0411 14.1370 14.2925 14.3262 14.5111 14.5120 14.5516 14.6258 15.5498 15.6960 15.7410 16.1119 17.0984 17.1592 17.4022 17.4272 17.5577 17.5875 17.7355 17.9317 18.2758 18.3131 19.1010 19.2217 19.3644 19.5520 k = 0.5000 0.2887 0.2470 ( 4428 PWs) bands (ev): 4.4377 4.4391 5.0557 5.0558 6.0209 6.0219 7.8335 7.8687 8.4548 8.4664 8.6204 8.6669 9.0886 9.3093 9.7126 9.8372 9.9162 9.9327 10.0148 10.2057 10.2059 10.2210 10.3405 10.4104 10.5278 10.5424 10.7329 10.7493 10.8481 10.8496 11.1129 11.1148 11.2261 11.3336 11.4289 11.5378 11.5535 11.6138 11.8974 11.9683 12.1104 12.3545 12.4215 12.5711 12.7439 12.7572 12.8696 12.9221 13.0050 13.0236 13.0948 13.2551 13.3680 13.4118 13.4310 13.5148 13.6274 13.6385 13.8446 13.9305 14.0332 14.1341 14.2935 14.3145 14.5038 14.5148 14.5471 14.6291 15.4982 15.6540 15.6676 16.0397 17.0773 17.1040 17.4738 17.5336 17.6068 17.6692 17.7220 17.9853 18.2428 18.2778 19.1917 19.3276 19.4573 19.6514 k = 0.5000 0.2887 0.2264 ( 4420 PWs) bands (ev): 4.4103 4.4114 5.0262 5.0264 6.0098 6.0106 7.8178 7.8483 8.4311 8.4411 8.6151 8.6620 9.1102 9.3281 9.6851 9.8112 9.9156 9.9270 10.0119 10.1923 10.2122 10.2239 10.3378 10.4017 10.5371 10.5531 10.7570 10.7692 10.8698 10.8727 11.1360 11.1363 11.2436 11.3540 11.4694 11.5452 11.5735 11.6135 11.9120 11.9912 12.1034 12.3416 12.4281 12.5741 12.7643 12.7737 12.8560 12.8909 12.9992 13.0080 13.0733 13.2514 13.3438 13.4046 13.4320 13.5229 13.6260 13.6457 13.8349 13.9299 14.0278 14.1319 14.2942 14.3035 14.4977 14.5188 14.5431 14.6341 15.4465 15.5954 15.6080 15.9663 17.0352 17.0484 17.5725 17.6032 17.6530 17.6860 17.8015 18.0568 18.2152 18.2483 19.2755 19.4190 19.5550 19.7469 k = 0.5000 0.2887 0.2058 ( 4410 PWs) bands (ev): 4.3850 4.3860 4.9991 4.9993 5.9994 6.0000 7.8018 7.8281 8.4090 8.4175 8.6116 8.6577 9.1324 9.3467 9.6573 9.7847 9.9137 9.9214 10.0114 10.1777 10.2188 10.2295 10.3347 10.3929 10.5447 10.5628 10.7803 10.7880 10.8924 10.8958 11.1574 11.1608 11.2609 11.3765 11.5093 11.5499 11.5925 11.6151 11.9253 12.0134 12.0971 12.3278 12.4342 12.5710 12.7771 12.7886 12.8500 12.8620 12.9904 12.9939 13.0511 13.2469 13.3186 13.3943 13.4352 13.5340 13.6267 13.6565 13.8252 13.9279 14.0250 14.1304 14.2932 14.2948 14.4930 14.5237 14.5395 14.6407 15.3945 15.5268 15.5591 15.8931 16.9872 16.9949 17.6003 17.6623 17.6868 17.7633 17.9094 18.1225 18.2095 18.2293 19.3495 19.4880 19.6651 19.8415 k = 0.5000 0.2887 0.1852 ( 4402 PWs) bands (ev): 4.3620 4.3628 4.9745 4.9746 5.9897 5.9902 7.7859 7.8084 8.3886 8.3958 8.6095 8.6537 9.1553 9.3651 9.6296 9.7583 9.9109 9.9158 10.0125 10.1637 10.2256 10.2360 10.3313 10.3842 10.5510 10.5711 10.8024 10.8058 10.9150 10.9179 11.1787 11.1859 11.2780 11.4011 11.5415 11.5570 11.6104 11.6200 11.9362 12.0345 12.0933 12.3133 12.4400 12.5635 12.7768 12.7937 12.8421 12.8569 12.9783 12.9818 13.0297 13.2409 13.2941 13.3819 13.4405 13.5462 13.6295 13.6706 13.8157 13.9244 14.0251 14.1292 14.2841 14.2951 14.4898 14.5292 14.5365 14.6487 15.3418 15.4645 15.5082 15.8214 16.9393 16.9447 17.5903 17.6450 17.7972 17.8731 17.9973 18.1316 18.2338 18.2717 19.4109 19.5361 19.7860 19.9383 k = 0.5000 0.2887 0.1646 ( 4410 PWs) bands (ev): 4.3412 4.3420 4.9523 4.9524 5.9809 5.9812 7.7707 7.7897 8.3701 8.3762 8.6085 8.6498 9.1787 9.3834 9.6020 9.7322 9.9076 9.9106 10.0150 10.1504 10.2325 10.2430 10.3277 10.3755 10.5564 10.5777 10.8227 10.8229 10.9367 10.9382 11.1998 11.2110 11.2948 11.4274 11.5412 11.5899 11.6270 11.6284 11.9435 12.0537 12.0935 12.2986 12.4454 12.5528 12.7666 12.7792 12.8394 12.8731 12.9626 12.9722 13.0106 13.2312 13.2732 13.3680 13.4480 13.5579 13.6344 13.6873 13.8064 13.9193 14.0281 14.1283 14.2764 14.2953 14.4884 14.5344 14.5350 14.6577 15.2881 15.4109 15.4561 15.7518 16.8941 16.8984 17.5783 17.6254 17.9098 17.9729 18.0425 18.1224 18.2828 18.3645 19.4584 19.5679 19.9134 20.0397 k = 0.5000 0.2887 0.1441 ( 4406 PWs) bands (ev): 4.3229 4.3235 4.9326 4.9328 5.9730 5.9732 7.7565 7.7724 8.3535 8.3586 8.6083 8.6459 9.2027 9.4013 9.5749 9.7068 9.9041 9.9057 10.0186 10.1378 10.2395 10.2501 10.3241 10.3669 10.5611 10.5827 10.8384 10.8416 10.9564 10.9568 11.2204 11.2352 11.3113 11.4554 11.5324 11.6219 11.6418 11.6424 11.9471 12.0700 12.0989 12.2842 12.4505 12.5400 12.7526 12.7559 12.8427 12.8920 12.9442 12.9656 12.9952 13.2148 13.2594 13.3534 13.4577 13.5679 13.6412 13.7057 13.7976 13.9130 14.0341 14.1274 14.2704 14.2952 14.4887 14.5338 14.5403 14.6668 15.2342 15.3676 15.4037 15.6851 16.8528 16.8566 17.5660 17.6067 18.0135 18.0342 18.0555 18.1449 18.3697 18.4612 19.4921 19.5868 20.0444 20.1467 k = 0.5000 0.2887 0.1235 ( 4398 PWs) bands (ev): 4.3069 4.3074 4.9155 4.9157 5.9661 5.9662 7.7438 7.7569 8.3390 8.3432 8.6087 8.6420 9.2271 9.4188 9.5487 9.6819 9.9007 9.9014 10.0232 10.1258 10.2464 10.2574 10.3204 10.3585 10.5654 10.5862 10.8530 10.8584 10.9722 10.9746 11.2402 11.2577 11.3275 11.4847 11.5203 11.6409 11.6564 11.6655 11.9483 12.0823 12.1090 12.2706 12.4553 12.5262 12.7329 12.7376 12.8436 12.9053 12.9301 12.9617 12.9833 13.1926 13.2523 13.3386 13.4695 13.5753 13.6495 13.7240 13.7901 13.9055 14.0426 14.1263 14.2664 14.2949 14.4906 14.5351 14.5445 14.6750 15.1829 15.3347 15.3517 15.6217 16.8161 16.8197 17.5547 17.5894 18.0337 18.0384 18.1319 18.2190 18.4696 18.5555 19.5134 19.5949 20.1775 20.2586 k = 0.5000 0.2887 0.1029 ( 4404 PWs) bands (ev): 4.2933 4.2937 4.9010 4.9012 5.9601 5.9602 7.7326 7.7432 8.3267 8.3300 8.6097 8.6381 9.2518 9.4349 9.5243 9.6578 9.8975 9.8976 10.0286 10.1144 10.2533 10.2646 10.3166 10.3502 10.5693 10.5884 10.8662 10.8728 10.9857 10.9897 11.2589 11.2776 11.3432 11.5060 11.5151 11.6525 11.6688 11.6904 11.9499 12.0891 12.1227 12.2581 12.4596 12.5125 12.7127 12.7227 12.8414 12.8944 12.9390 12.9597 12.9755 13.1682 13.2492 13.3240 13.4829 13.5798 13.6592 13.7391 13.7860 13.8971 14.0530 14.1248 14.2647 14.2942 14.4941 14.5392 14.5470 14.6804 15.1378 15.3010 15.3119 15.5622 16.7846 16.7879 17.5448 17.5739 18.0229 18.0269 18.2280 18.3015 18.5692 18.6439 19.5246 19.5938 20.3111 20.3739 k = 0.5000 0.2887 0.0823 ( 4408 PWs) bands (ev): 4.2821 4.2824 4.8891 4.8892 5.9552 5.9552 7.7234 7.7316 8.3165 8.3191 8.6111 8.6343 9.2768 9.4463 9.5051 9.6344 9.8944 9.8947 10.0348 10.1036 10.2600 10.2716 10.3130 10.3421 10.5729 10.5894 10.8778 10.8847 10.9969 11.0018 11.2761 11.2943 11.3584 11.4901 11.5459 11.6616 11.6794 11.7080 11.9554 12.0894 12.1385 12.2470 12.4633 12.4997 12.6963 12.7087 12.8372 12.8761 12.9512 12.9584 12.9754 13.1433 13.2485 13.3099 13.4975 13.5810 13.6698 13.7455 13.7897 13.8879 14.0644 14.1227 14.2653 14.2929 14.4989 14.5468 14.5475 14.6806 15.1027 15.2524 15.2990 15.5071 16.7586 16.7615 17.5368 17.5602 18.0112 18.0143 18.3149 18.3756 18.6621 18.7234 19.5282 19.5852 20.4435 20.4904 k = 0.5000 0.2887 0.0617 ( 4416 PWs) bands (ev): 4.2734 4.2736 4.8798 4.8799 5.9513 5.9513 7.7163 7.7223 8.3086 8.3105 8.6129 8.6306 9.3020 9.4435 9.5007 9.6117 9.8920 9.8923 10.0416 10.0933 10.2664 10.2779 10.3097 10.3342 10.5763 10.5893 10.8875 10.8938 11.0060 11.0109 11.2911 11.3071 11.3734 11.4732 11.5763 11.6680 11.6881 11.7160 11.9670 12.0828 12.1551 12.2367 12.4663 12.4891 12.6843 12.6962 12.8326 12.8594 12.9533 12.9570 12.9887 13.1187 13.2498 13.2967 13.5128 13.5789 13.6810 13.7424 13.8015 13.8780 14.0759 14.1199 14.2679 14.2911 14.5050 14.5456 14.5585 14.6738 15.0809 15.2069 15.2959 15.4568 16.7383 16.7406 17.5310 17.5487 18.0012 18.0035 18.3888 18.4359 18.7437 18.7902 19.5271 19.5714 20.5718 20.6048 k = 0.5000 0.2887 0.0412 ( 4416 PWs) bands (ev): 4.2672 4.2674 4.8732 4.8733 5.9485 5.9485 7.7113 7.7153 8.3030 8.3043 8.6151 8.6270 9.3273 9.4256 9.5119 9.5897 9.8902 9.8905 10.0489 10.0835 10.2725 10.2826 10.3078 10.3266 10.5794 10.5885 10.8952 10.8999 11.0130 11.0168 11.3035 11.3155 11.3886 11.4558 11.6054 11.6705 11.6950 11.7153 11.9847 12.0697 12.1717 12.2264 12.4686 12.4811 12.6766 12.6859 12.8292 12.8459 12.9521 12.9553 13.0077 13.0948 13.2531 13.2847 13.5279 13.5737 13.6924 13.7348 13.8159 13.8674 14.0868 14.1160 14.2719 14.2886 14.5122 14.5415 14.5744 14.6595 15.0741 15.1655 15.3023 15.4120 16.7238 16.7254 17.5277 17.5395 17.9938 17.9953 18.4467 18.4791 18.8093 18.8405 19.5246 19.5552 20.6902 20.7108 k = 0.5000 0.2887 0.0206 ( 4412 PWs) bands (ev): 4.2635 4.2636 4.8692 4.8693 5.9468 5.9469 7.7087 7.7107 8.2998 8.3004 8.6177 8.6236 9.3526 9.4024 9.5289 9.5685 9.8892 9.8894 10.0569 10.0742 10.2779 10.2842 10.3088 10.3194 10.5823 10.5869 10.9005 10.9030 11.0177 11.0198 11.3127 11.3192 11.4045 11.4383 11.6317 11.6663 11.7002 11.7100 12.0066 12.0514 12.1875 12.2150 12.4705 12.4758 12.6732 12.6782 12.8282 12.8361 12.9516 12.9536 13.0282 13.0718 13.2583 13.2742 13.5421 13.5655 13.7038 13.7253 13.8302 13.8559 14.0963 14.1109 14.2766 14.2853 14.5201 14.5355 14.5942 14.6394 15.0815 15.1296 15.3177 15.3734 16.7153 16.7161 17.5268 17.5328 17.9894 17.9901 18.4861 18.5027 18.8544 18.8700 19.5244 19.5400 20.7850 20.7947 k = 0.5000 0.2887-0.0000 ( 4416 PWs) bands (ev): 4.2623 4.2623 4.8679 4.8679 5.9463 5.9463 7.7085 7.7085 8.2989 8.2989 8.6205 8.6205 9.3778 9.3778 9.5482 9.5482 9.8889 9.8889 10.0653 10.0653 10.2821 10.2821 10.3132 10.3132 10.5848 10.5848 10.9031 10.9031 11.0200 11.0200 11.3181 11.3181 11.4211 11.4211 11.6530 11.6530 11.7048 11.7048 12.0296 12.0296 12.2020 12.2020 12.4726 12.4726 12.6739 12.6739 12.8303 12.8303 12.9522 12.9522 13.0496 13.0496 13.2653 13.2653 13.5549 13.5549 13.7148 13.7148 13.8436 13.8436 14.1044 14.1044 14.2812 14.2812 14.5281 14.5281 14.6166 14.6166 15.1008 15.1009 15.3417 15.3417 16.7127 16.7127 17.5285 17.5285 17.9881 17.9881 18.5051 18.5051 18.8752 18.8752 19.5292 19.5292 20.8273 20.8273 k = 0.3333 0.5774-0.0000 ( 4461 PWs) bands (ev): 4.4373 4.4373 5.2040 5.2040 5.2160 5.2160 8.1005 8.1005 8.2083 8.2083 8.2273 8.2273 9.4536 9.4536 9.8018 9.8018 9.8304 9.8304 9.9934 9.9934 10.2647 10.2647 10.2932 10.2932 10.8038 10.8038 11.0295 11.0295 11.2048 11.2048 11.3267 11.3267 11.3720 11.3720 11.4711 11.4711 11.5136 11.5136 12.1544 12.1544 12.2635 12.2635 12.4558 12.4558 12.6341 12.6341 12.7803 12.7803 13.1058 13.1058 13.1172 13.1172 13.1177 13.1177 13.6258 13.6258 13.7001 13.7001 13.7177 13.7177 14.1992 14.1992 14.3132 14.3132 14.5656 14.5656 14.7124 14.7124 14.8070 14.8070 14.9637 14.9637 17.6927 17.6927 17.7849 17.7849 17.9577 17.9577 19.0325 19.0325 19.0487 19.0487 19.5304 19.5304 19.6862 19.6862 k = 0.3333 0.5774 0.0206 ( 4446 PWs) bands (ev): 4.4384 4.4384 5.2052 5.2052 5.2170 5.2172 8.1010 8.1010 8.2092 8.2093 8.2282 8.2282 9.4521 9.4521 9.8012 9.8035 9.8306 9.8306 9.9943 9.9943 10.2600 10.2696 10.2931 10.2931 10.8030 10.8030 11.0224 11.0352 11.2032 11.2032 11.3250 11.3250 11.3441 11.3948 11.4701 11.4701 11.5133 11.5133 12.1546 12.1546 12.2448 12.2831 12.4568 12.4568 12.6361 12.6361 12.7598 12.8005 13.1007 13.1049 13.1049 13.1183 13.1183 13.1354 13.6226 13.6226 13.6986 13.6997 13.7202 13.7202 14.1994 14.1994 14.2864 14.3410 14.5621 14.5621 14.7169 14.7169 14.7790 14.8410 14.9666 14.9666 17.6960 17.6960 17.7867 17.7867 17.9540 17.9638 19.0178 19.0193 19.0329 19.0329 19.5269 19.5269 19.6912 19.6947 k = 0.3333 0.5774 0.0412 ( 4446 PWs) bands (ev): 4.4419 4.4419 5.2087 5.2087 5.2204 5.2208 8.1025 8.1025 8.2121 8.2122 8.2310 8.2310 9.4478 9.4478 9.8018 9.8064 9.8314 9.8314 9.9971 9.9971 10.2554 10.2748 10.2930 10.2930 10.8005 10.8005 11.0137 11.0396 11.1984 11.1984 11.3117 11.3198 11.3198 11.4121 11.4670 11.4670 11.5123 11.5123 12.1554 12.1554 12.2273 12.3025 12.4601 12.4601 12.6418 12.6418 12.7404 12.8191 13.0863 13.1027 13.1027 13.1212 13.1212 13.1521 13.6141 13.6141 13.6949 13.6976 13.7265 13.7265 14.2000 14.2000 14.2622 14.3676 14.5529 14.5529 14.7291 14.7291 14.7586 14.8795 14.9754 14.9754 17.7059 17.7059 17.7921 17.7921 17.9525 17.9723 18.9772 18.9809 18.9890 18.9890 19.5071 19.5071 19.7085 19.7138 k = 0.3333 0.5774 0.0617 ( 4458 PWs) bands (ev): 4.4476 4.4476 5.2145 5.2145 5.2260 5.2267 8.1050 8.1050 8.2168 8.2170 8.2356 8.2356 9.4406 9.4406 9.8034 9.8105 9.8329 9.8329 10.0017 10.0017 10.2509 10.2801 10.2928 10.2928 10.7964 10.7964 11.0034 11.0427 11.1903 11.1903 11.2754 11.3116 11.3116 11.4238 11.4622 11.4622 11.5106 11.5106 12.1565 12.1565 12.2113 12.3204 12.4656 12.4656 12.6509 12.6509 12.7232 12.8349 13.0766 13.0997 13.0997 13.1254 13.1254 13.1661 13.6023 13.6023 13.6894 13.6945 13.7348 13.7348 14.2011 14.2011 14.2413 14.3902 14.5405 14.5405 14.7463 14.7463 14.7483 14.9217 14.9899 14.9899 17.7224 17.7224 17.8007 17.8007 17.9528 17.9830 18.9161 18.9223 18.9241 18.9241 19.4562 19.4562 19.7344 19.7387 k = 0.3333 0.5774 0.0823 ( 4443 PWs) bands (ev): 4.4556 4.4556 5.2226 5.2226 5.2340 5.2349 8.1083 8.1083 8.2234 8.2237 8.2420 8.2420 9.4308 9.4308 9.8062 9.8157 9.8352 9.8352 10.0078 10.0078 10.2465 10.2858 10.2924 10.2924 10.7907 10.7907 10.9912 11.0448 11.1785 11.1785 11.2360 11.3012 11.3012 11.4300 11.4557 11.4557 11.5078 11.5078 12.1576 12.1576 12.1964 12.3355 12.4734 12.4734 12.6626 12.6626 12.7093 12.8471 13.0734 13.0964 13.0964 13.1309 13.1309 13.1762 13.5887 13.5887 13.6823 13.6911 13.7433 13.7433 14.2030 14.2030 14.2241 14.4058 14.5269 14.5269 14.7506 14.7664 14.7664 14.9669 15.0099 15.0099 17.7453 17.7453 17.8122 17.8122 17.9542 17.9953 18.8406 18.8452 18.8452 18.8495 19.3759 19.3759 19.7644 19.7648 k = 0.3333 0.5774 0.1029 ( 4440 PWs) bands (ev): 4.4659 4.4659 5.2330 5.2330 5.2442 5.2453 8.1123 8.1123 8.2318 8.2321 8.2502 8.2502 9.4185 9.4185 9.8099 9.8222 9.8385 9.8385 10.0153 10.0153 10.2422 10.2918 10.2921 10.2921 10.7836 10.7836 10.9771 11.0457 11.1631 11.1631 11.1941 11.2893 11.2893 11.4311 11.4479 11.4479 11.5041 11.5041 12.1585 12.1585 12.1818 12.3459 12.4833 12.4833 12.6762 12.6762 12.6997 12.8560 13.0774 13.0932 13.0932 13.1375 13.1375 13.1811 13.5745 13.5745 13.6739 13.6887 13.7512 13.7512 14.2058 14.2058 14.2108 14.4126 14.5135 14.5135 14.7668 14.7880 14.7880 15.0147 15.0352 15.0352 17.7744 17.7744 17.8257 17.8257 17.9553 18.0086 18.7567 18.7577 18.7577 18.7672 19.2758 19.2758 19.7889 19.7955 k = 0.3333 0.5774 0.1235 ( 4431 PWs) bands (ev): 4.4784 4.4784 5.2456 5.2456 5.2567 5.2580 8.1169 8.1169 8.2420 8.2423 8.2601 8.2601 9.4039 9.4039 9.8145 9.8297 9.8430 9.8430 10.0241 10.0241 10.2379 10.2917 10.2917 10.2983 10.7752 10.7752 10.9611 11.0454 11.1438 11.1438 11.1507 11.2766 11.2766 11.4276 11.4389 11.4389 11.4993 11.4993 12.1588 12.1588 12.1668 12.3502 12.4953 12.4953 12.6909 12.6909 12.6951 12.8630 13.0880 13.0904 13.0904 13.1454 13.1454 13.1800 13.5603 13.5603 13.6646 13.6880 13.7577 13.7577 14.2010 14.2098 14.2098 14.4109 14.5010 14.5010 14.7961 14.8103 14.8103 15.0645 15.0653 15.0653 17.8094 17.8094 17.8402 17.8402 17.9544 18.0212 18.6660 18.6660 18.6698 18.6802 19.1635 19.1635 19.8091 19.8255 k = 0.3333 0.5774 0.1441 ( 4413 PWs) bands (ev): 4.4931 4.4931 5.2605 5.2605 5.2714 5.2729 8.1218 8.1218 8.2539 8.2542 8.2716 8.2716 9.3874 9.3874 9.8200 9.8384 9.8487 9.8487 10.0339 10.0339 10.2335 10.2914 10.2914 10.3052 10.7656 10.7656 10.9433 11.0428 11.1073 11.1211 11.1211 11.2636 11.2636 11.4203 11.4291 11.4291 11.4935 11.4935 12.1505 12.1582 12.1582 12.3474 12.5088 12.5088 12.6959 12.7058 12.7058 12.8700 13.0886 13.0886 13.1039 13.1543 13.1543 13.1725 13.5466 13.5466 13.6548 13.6898 13.7625 13.7625 14.1945 14.2152 14.2152 14.4025 14.4898 14.4898 14.8329 14.8329 14.8359 15.0996 15.0996 15.1161 17.8459 17.8459 17.8576 17.8576 17.9481 18.0309 18.5741 18.5741 18.5856 18.5932 19.0435 19.0435 19.8248 19.8533 k = 0.3333 0.5774 0.1646 ( 4425 PWs) bands (ev): 4.5100 4.5100 5.2776 5.2776 5.2883 5.2899 8.1266 8.1266 8.2674 8.2676 8.2846 8.2846 9.3695 9.3695 9.8263 9.8482 9.8558 9.8558 10.0446 10.0446 10.2292 10.2912 10.2912 10.3126 10.7548 10.7548 10.9236 11.0320 11.0705 11.0952 11.0952 11.2504 11.2504 11.4101 11.4186 11.4186 11.4866 11.4866 12.1325 12.1564 12.1564 12.3369 12.5235 12.5235 12.7022 12.7202 12.7202 12.8783 13.0883 13.0883 13.1237 13.1589 13.1644 13.1644 13.5338 13.5338 13.6451 13.6945 13.7657 13.7657 14.1908 14.2219 14.2219 14.3899 14.4801 14.4801 14.8557 14.8557 14.8837 15.1374 15.1374 15.1689 17.8583 17.8583 17.8998 17.8998 17.9318 18.0328 18.4865 18.4865 18.5107 18.5125 18.9190 18.9190 19.8356 19.8784 k = 0.3333 0.5774 0.1852 ( 4425 PWs) bands (ev): 4.5291 4.5291 5.2967 5.2967 5.3073 5.3091 8.1312 8.1312 8.2824 8.2826 8.2990 8.2990 9.3506 9.3506 9.8332 9.8590 9.8640 9.8640 10.0561 10.0561 10.2248 10.2912 10.2912 10.3205 10.7432 10.7432 10.9024 10.9988 11.0551 11.0669 11.0669 11.2373 11.2373 11.3975 11.4075 11.4075 11.4788 11.4788 12.1124 12.1531 12.1531 12.3190 12.5385 12.5385 12.7134 12.7339 12.7339 12.8883 13.0900 13.0900 13.1398 13.1461 13.1755 13.1755 13.5220 13.5220 13.6358 13.7017 13.7671 13.7671 14.1896 14.2300 14.2300 14.3748 14.4721 14.4721 14.8784 14.8784 14.9369 15.1780 15.1780 15.2226 17.8562 17.8562 17.8998 17.9518 17.9518 18.0199 18.4089 18.4089 18.4468 18.4522 18.7928 18.7928 19.8419 19.9010 k = 0.3333 0.5774 0.2058 ( 4431 PWs) bands (ev): 4.5502 4.5502 5.3180 5.3180 5.3285 5.3303 8.1351 8.1351 8.2988 8.2988 8.3147 8.3147 9.3312 9.3312 9.8406 9.8707 9.8734 9.8734 10.0684 10.0684 10.2203 10.2915 10.2915 10.3290 10.7307 10.7307 10.8798 10.9544 11.0367 11.0367 11.0503 11.2242 11.2242 11.3832 11.3961 11.3961 11.4701 11.4701 12.0903 12.1484 12.1484 12.2945 12.5529 12.5529 12.7289 12.7466 12.7466 12.8995 13.0941 13.0941 13.1163 13.1702 13.1875 13.1875 13.5115 13.5115 13.6274 13.7110 13.7671 13.7671 14.1904 14.2392 14.2392 14.3584 14.4658 14.4658 14.9010 14.9010 14.9940 15.2209 15.2209 15.2768 17.8369 17.8369 17.8482 17.9842 18.0091 18.0091 18.3470 18.3470 18.4051 18.4153 18.6683 18.6683 19.8440 19.9168 k = 0.3333 0.5774 0.2264 ( 4422 PWs) bands (ev): 4.5734 4.5734 5.3413 5.3413 5.3516 5.3535 8.1379 8.1379 8.3163 8.3165 8.3316 8.3316 9.3121 9.3121 9.8485 9.8832 9.8837 9.8837 10.0814 10.0814 10.2157 10.2923 10.2923 10.3381 10.7176 10.7176 10.8563 10.9080 11.0053 11.0053 11.0475 11.2112 11.2112 11.3678 11.3845 11.3845 11.4606 11.4606 12.0665 12.1419 12.1419 12.2645 12.5657 12.5657 12.7476 12.7589 12.7589 12.9111 13.0895 13.1006 13.1006 13.1955 13.2002 13.2002 13.5024 13.5024 13.6202 13.7216 13.7659 13.7659 14.1932 14.2494 14.2494 14.3415 14.4612 14.4612 14.9233 14.9233 15.0538 15.2653 15.2653 15.3310 17.7774 17.7955 17.7955 17.9237 18.0711 18.0711 18.3014 18.3014 18.3903 18.4005 18.5522 18.5522 19.8423 19.9274 k = 0.3333 0.5774 0.2470 ( 4434 PWs) bands (ev): 4.5985 4.5985 5.3666 5.3666 5.3767 5.3787 8.1391 8.1391 8.3349 8.3354 8.3494 8.3494 9.2938 9.2938 9.8566 9.8946 9.8946 9.8965 10.0951 10.0951 10.2112 10.2938 10.2938 10.3478 10.7039 10.7039 10.8322 10.8617 10.9734 10.9734 11.0451 11.1980 11.1980 11.3514 11.3728 11.3728 11.4504 11.4504 12.0413 12.1337 12.1337 12.2302 12.5757 12.5757 12.7682 12.7715 12.7715 12.9218 13.0610 13.1095 13.1095 13.2135 13.2135 13.2216 13.4947 13.4947 13.6147 13.7330 13.7639 13.7639 14.1977 14.2602 14.2602 14.3246 14.4583 14.4583 14.9450 14.9450 15.1151 15.3107 15.3107 15.3845 17.6919 17.7326 17.7326 17.8446 18.1361 18.1361 18.2568 18.2568 18.3971 18.4040 18.4623 18.4623 19.8374 19.9333 k = 0.3333 0.5774 0.2675 ( 4428 PWs) bands (ev): 4.6256 4.6256 5.3937 5.3937 5.4037 5.4057 8.1383 8.1383 8.3543 8.3552 8.3681 8.3681 9.2771 9.2771 9.8650 9.9059 9.9059 9.9103 10.1095 10.1095 10.2066 10.2963 10.2963 10.3580 10.6898 10.6898 10.8079 10.8161 10.9416 10.9416 11.0429 11.1849 11.1849 11.3344 11.3609 11.3609 11.4397 11.4397 12.0151 12.1238 12.1238 12.1924 12.5819 12.5819 12.7854 12.7854 12.7891 12.9309 13.0323 13.1204 13.1204 13.2269 13.2269 13.2479 13.4885 13.4885 13.6112 13.7442 13.7613 13.7613 14.2038 14.2712 14.2712 14.3081 14.4571 14.4571 14.9658 14.9658 15.1773 15.3563 15.3563 15.4369 17.5970 17.6540 17.6540 17.7553 18.1647 18.1647 18.2219 18.2219 18.4180 18.4212 18.4246 18.4246 19.8297 19.9342 k = 0.3333 0.5774 0.2881 ( 4431 PWs) bands (ev): 4.6545 4.6545 5.4227 5.4227 5.4326 5.4346 8.1349 8.1349 8.3744 8.3758 8.3874 8.3874 9.2625 9.2625 9.8734 9.9170 9.9170 9.9245 10.1245 10.1245 10.2021 10.3001 10.3001 10.3686 10.6754 10.6754 10.7719 10.7839 10.9103 10.9103 11.0408 11.1716 11.1716 11.3170 11.3489 11.3489 11.4288 11.4288 11.9883 12.1121 12.1121 12.1521 12.5837 12.5837 12.8013 12.8013 12.8080 12.9375 13.0060 13.1329 13.1329 13.2402 13.2402 13.2739 13.4837 13.4837 13.6098 13.7548 13.7586 13.7586 14.2114 14.2822 14.2822 14.2920 14.4575 14.4575 14.9853 14.9853 15.2396 15.4015 15.4015 15.4873 17.4974 17.5663 17.5663 17.6619 18.0670 18.0670 18.2878 18.2878 18.4326 18.4326 18.4475 18.4481 19.8195 19.9300 k = 0.3333 0.5774 0.3087 ( 4437 PWs) bands (ev): 4.6853 4.6853 5.4534 5.4534 5.4631 5.4651 8.1285 8.1285 8.3950 8.3971 8.4072 8.4072 9.2507 9.2507 9.8817 9.9275 9.9275 9.9387 10.1404 10.1404 10.1980 10.3055 10.3055 10.3794 10.6609 10.6609 10.7297 10.7606 10.8800 10.8800 11.0390 11.1583 11.1583 11.2992 11.3367 11.3367 11.4179 11.4179 11.9611 12.0989 12.0989 12.1100 12.5811 12.5811 12.8193 12.8193 12.8210 12.9412 12.9859 13.1468 13.1468 13.2528 13.2528 13.2991 13.4803 13.4803 13.6107 13.7561 13.7561 13.7641 14.2206 14.2768 14.2929 14.2929 14.4596 14.4596 15.0028 15.0028 15.3012 15.4454 15.4454 15.5350 17.3964 17.4748 17.4748 17.5684 17.9522 17.9522 18.3632 18.3632 18.4646 18.4646 18.4821 18.4824 19.8073 19.9202 k = 0.3333 0.5774 0.3293 ( 4425 PWs) bands (ev): 4.7177 4.7177 5.4857 5.4857 5.4954 5.4972 8.1187 8.1187 8.4159 8.4188 8.4271 8.4271 9.2424 9.2424 9.8897 9.9367 9.9367 9.9525 10.1572 10.1572 10.1946 10.3130 10.3130 10.3900 10.6463 10.6463 10.6902 10.7385 10.8511 10.8511 11.0374 11.1448 11.1448 11.2811 11.3241 11.3241 11.4075 11.4075 11.9338 12.0666 12.0843 12.0843 12.5744 12.5744 12.8232 12.8393 12.8393 12.9420 12.9770 13.1615 13.1615 13.2643 13.2643 13.3228 13.4784 13.4784 13.6138 13.7539 13.7539 13.7718 14.2314 14.2626 14.3031 14.3031 14.4632 14.4632 15.0180 15.0180 15.3613 15.4872 15.4872 15.5789 17.2966 17.3830 17.3830 17.4779 17.8360 17.8360 18.4385 18.4385 18.5120 18.5120 18.5207 18.5212 19.7935 19.9041 k = 0.3333 0.5774 0.3499 ( 4425 PWs) bands (ev): 4.7518 4.7518 5.5195 5.5195 5.5291 5.5308 8.1052 8.1052 8.4368 8.4406 8.4471 8.4471 9.2378 9.2378 9.8974 9.9441 9.9441 9.9655 10.1750 10.1750 10.1923 10.3229 10.3229 10.3998 10.6319 10.6319 10.6544 10.7179 10.8241 10.8241 11.0362 11.1312 11.1312 11.2628 11.3108 11.3108 11.3980 11.3980 11.9067 12.0225 12.0684 12.0684 12.5645 12.5645 12.8121 12.8607 12.8607 12.9399 12.9815 13.1767 13.1767 13.2744 13.2744 13.3447 13.4779 13.4779 13.6188 13.7523 13.7523 13.7775 14.2436 14.2498 14.3126 14.3126 14.4681 14.4681 15.0299 15.0299 15.4189 15.5258 15.5258 15.6179 17.2000 17.2939 17.2939 17.3925 17.7225 17.7225 18.5080 18.5080 18.5610 18.5642 18.5748 18.5748 19.7784 19.8804 k = 0.3333 0.5774 0.3704 ( 4443 PWs) bands (ev): 4.7874 4.7874 5.5548 5.5548 5.5643 5.5659 8.0876 8.0876 8.4574 8.4624 8.4668 8.4668 9.2374 9.2374 9.9045 9.9491 9.9491 9.9770 10.1918 10.1940 10.1940 10.3353 10.3353 10.4076 10.6179 10.6179 10.6233 10.6991 10.7991 10.7991 11.0355 11.1174 11.1174 11.2442 11.2968 11.2968 11.3897 11.3897 11.8798 11.9781 12.0515 12.0515 12.5518 12.5518 12.7914 12.8831 12.8831 12.9351 12.9960 13.1918 13.1918 13.2830 13.2830 13.3642 13.4787 13.4787 13.6253 13.7513 13.7513 13.7810 14.2384 14.2572 14.3215 14.3215 14.4741 14.4741 15.0381 15.0381 15.4730 15.5601 15.5601 15.6508 17.1087 17.2096 17.2096 17.3143 17.6142 17.6142 18.5691 18.5691 18.6022 18.6100 18.6525 18.6525 19.7623 19.8464 k = 0.3333 0.5774 0.3910 ( 4431 PWs) bands (ev): 4.8244 4.8244 5.5913 5.5913 5.6007 5.6022 8.0660 8.0660 8.4776 8.4840 8.4862 8.4862 9.2413 9.2413 9.9111 9.9514 9.9514 9.9862 10.1940 10.2145 10.2145 10.3505 10.3505 10.4121 10.5989 10.6045 10.6045 10.6823 10.7764 10.7764 11.0354 11.1032 11.1032 11.2256 11.2819 11.2819 11.3831 11.3831 11.8532 11.9338 12.0339 12.0339 12.5370 12.5370 12.7658 12.9060 12.9060 12.9278 13.0158 13.2064 13.2064 13.2903 13.2903 13.3811 13.4805 13.4805 13.6325 13.7510 13.7510 13.7822 14.2291 14.2721 14.3298 14.3298 14.4809 14.4809 15.0416 15.0416 15.5220 15.5887 15.5887 15.6761 17.0245 17.1321 17.1321 17.2452 17.5127 17.5127 18.6255 18.6255 18.6433 18.6579 18.7393 18.7393 19.7457 19.7981 k = 0.3333 0.5774 0.4116 ( 4431 PWs) bands (ev): 4.8628 4.8628 5.6290 5.6290 5.6384 5.6396 8.0405 8.0405 8.4970 8.5049 8.5049 8.5049 9.2494 9.2494 9.9169 9.9507 9.9507 9.9926 10.1995 10.2362 10.2362 10.3683 10.3683 10.4114 10.5830 10.5922 10.5922 10.6676 10.7562 10.7562 11.0359 11.0887 11.0887 11.2068 11.2662 11.2662 11.3781 11.3781 11.8272 11.8899 12.0158 12.0158 12.5204 12.5204 12.7383 12.9184 12.9289 12.9289 13.0376 13.2194 13.2194 13.2971 13.2971 13.3953 13.4830 13.4830 13.6395 13.7513 13.7513 13.7809 14.2220 14.2881 14.3375 14.3375 14.4880 14.4880 15.0399 15.0399 15.5645 15.6101 15.6101 15.6925 16.9495 17.0635 17.0635 17.1869 17.4192 17.4192 18.6797 18.6797 18.6835 18.7069 18.8311 18.8311 19.7313 19.7314 k = 0.3333 0.5774 0.4322 ( 4437 PWs) bands (ev): 4.9024 4.9024 5.6678 5.6678 5.6771 5.6780 8.0111 8.0111 8.5154 8.5227 8.5227 8.5251 9.2616 9.2616 9.9219 9.9473 9.9473 9.9959 10.2088 10.2591 10.2591 10.3886 10.3886 10.4048 10.5765 10.5813 10.5813 10.6552 10.7387 10.7387 11.0371 11.0736 11.0736 11.1880 11.2499 11.2499 11.3749 11.3749 11.8018 11.8466 11.9977 11.9977 12.5025 12.5025 12.7106 12.9072 12.9514 12.9514 13.0599 13.2296 13.2296 13.3047 13.3047 13.4070 13.4858 13.4858 13.6454 13.7520 13.7520 13.7774 14.2175 14.3050 14.3449 14.3449 14.4952 14.4952 15.0324 15.0324 15.5986 15.6229 15.6229 15.6990 16.8859 17.0053 17.0053 17.1408 17.3351 17.3351 18.7218 18.7318 18.7318 18.7563 18.9257 18.9257 19.6472 19.6472 k = 0.3333 0.5774 0.4527 ( 4443 PWs) bands (ev): 4.9432 4.9432 5.7074 5.7074 5.7167 5.7174 7.9783 7.9783 8.5324 8.5395 8.5395 8.5441 9.2776 9.2776 9.9261 9.9413 9.9413 9.9961 10.2219 10.2825 10.2825 10.3933 10.4109 10.4109 10.5724 10.5724 10.5784 10.6449 10.7241 10.7241 11.0391 11.0578 11.0578 11.1691 11.2335 11.2335 11.3734 11.3734 11.7770 11.8044 11.9797 11.9797 12.4834 12.4834 12.6837 12.8945 12.9734 12.9734 13.0818 13.2358 13.2358 13.3144 13.3144 13.4162 13.4883 13.4883 13.6492 13.7529 13.7529 13.7717 14.2159 14.3226 14.3521 14.3521 14.5019 14.5019 15.0186 15.0186 15.6225 15.6257 15.6257 15.6948 16.8358 16.9592 16.9592 17.1079 17.2611 17.2611 18.7571 18.7809 18.7809 18.8052 19.0221 19.0221 19.5518 19.5518 k = 0.3333 0.5774 0.4733 ( 4443 PWs) bands (ev): 4.9849 4.9849 5.7477 5.7477 5.7570 5.7574 7.9423 7.9423 8.5480 8.5550 8.5550 8.5617 9.2970 9.2970 9.9296 9.9332 9.9332 9.9940 10.2385 10.3060 10.3060 10.3791 10.4345 10.4345 10.5666 10.5666 10.5864 10.6369 10.7127 10.7127 11.0412 11.0412 11.0419 11.1503 11.2172 11.2172 11.3735 11.3735 11.7529 11.7635 11.9624 11.9624 12.4633 12.4633 12.6581 12.8805 12.9944 12.9944 13.1027 13.2379 13.2379 13.3267 13.3267 13.4232 13.4901 13.4901 13.6502 13.7539 13.7539 13.7638 14.2173 14.3405 14.3592 14.3592 14.5077 14.5077 14.9985 14.9985 15.6177 15.6177 15.6346 15.6800 16.8009 16.9259 16.9259 17.0885 17.1982 17.1982 18.7883 18.8255 18.8255 18.8522 19.1186 19.1186 19.4521 19.4521 k = 0.3333 0.5774 0.4939 ( 4425 PWs) bands (ev): 5.0274 5.0274 5.7885 5.7885 5.7979 5.7979 7.9036 7.9036 8.5617 8.5691 8.5691 8.5777 9.3195 9.3195 9.9234 9.9234 9.9325 9.9901 10.2577 10.3286 10.3286 10.3643 10.4577 10.4577 10.5652 10.5652 10.5983 10.6311 10.7050 10.7050 11.0236 11.0236 11.0454 11.1315 11.2012 11.2012 11.3751 11.3751 11.7243 11.7297 11.9459 11.9459 12.4423 12.4423 12.6341 12.8656 13.0142 13.0142 13.1222 13.2364 13.2364 13.3412 13.3412 13.4281 13.4908 13.4908 13.6477 13.7540 13.7546 13.7546 14.2217 14.3584 14.3664 14.3664 14.5121 14.5121 14.9724 14.9724 15.5989 15.5989 15.6343 15.6553 16.7824 16.9057 16.9057 17.0820 17.1466 17.1466 18.8140 18.8632 18.8632 18.8961 19.2082 19.2082 19.3587 19.3587 k = 0.3333 0.5774 0.5145 ( 4425 PWs) bands (ev): 5.0706 5.0706 5.8297 5.8297 5.8388 5.8392 7.8626 7.8626 8.5736 8.5816 8.5816 8.5918 9.3445 9.3445 9.9125 9.9125 9.9349 9.9854 10.2789 10.3492 10.3492 10.3503 10.4782 10.4782 10.5707 10.5707 10.6125 10.6275 10.7016 10.7016 11.0049 11.0049 11.0496 11.1127 11.1860 11.1860 11.3781 11.3781 11.6871 11.7074 11.9306 11.9306 12.4206 12.4206 12.6120 12.8501 13.0327 13.0327 13.1401 13.2324 13.2324 13.3569 13.3569 13.4311 13.4902 13.4902 13.6416 13.7424 13.7548 13.7548 14.2288 14.3738 14.3738 14.3760 14.5142 14.5142 14.9410 14.9410 15.5699 15.5699 15.6218 15.6220 16.7799 16.8977 16.8977 17.0875 17.1068 17.1068 18.8328 18.8905 18.8905 18.9346 19.2166 19.2166 19.3493 19.3493 k = 0.3333 0.5774 0.5351 ( 4428 PWs) bands (ev): 5.1144 5.1144 5.8711 5.8711 5.8799 5.8806 7.8198 7.8198 8.5833 8.5925 8.5925 8.6039 9.3715 9.3715 9.9010 9.9010 9.9372 9.9806 10.3010 10.3378 10.3670 10.3670 10.4932 10.4932 10.5853 10.5853 10.6264 10.6279 10.7034 10.7034 10.9853 10.9853 11.0544 11.0940 11.1716 11.1716 11.3824 11.3824 11.6523 11.6862 11.9168 11.9168 12.3982 12.3982 12.5920 12.8340 13.0494 13.0494 13.1563 13.2268 13.2268 13.3730 13.3730 13.4323 13.4881 13.4881 13.6318 13.7292 13.7542 13.7542 14.2383 14.3814 14.3814 14.3930 14.5132 14.5132 14.9058 14.9058 15.5322 15.5322 15.5819 15.5987 16.7924 16.9003 16.9003 17.0788 17.0788 17.1033 18.8436 18.9007 18.9007 18.9652 19.1356 19.1356 19.4368 19.4368 k = 0.3333 0.5774 0.5556 ( 4416 PWs) bands (ev): 5.1585 5.1585 5.9124 5.9124 5.9209 5.9220 7.7756 7.7756 8.5909 8.6016 8.6016 8.6136 9.4000 9.4000 9.8893 9.8893 9.9395 9.9762 10.3232 10.3270 10.3811 10.3811 10.5025 10.5025 10.6082 10.6082 10.6279 10.6438 10.7114 10.7114 10.9647 10.9647 11.0594 11.0755 11.1584 11.1584 11.3879 11.3879 11.6203 11.6660 11.9046 11.9046 12.3752 12.3752 12.5742 12.8178 13.0640 13.0640 13.1706 13.2205 13.2205 13.3885 13.3885 13.4316 13.4848 13.4848 13.6187 13.7145 13.7527 13.7527 14.2495 14.3894 14.3894 14.4091 14.5080 14.5080 14.8687 14.8687 15.4875 15.4875 15.5370 15.5672 16.8177 16.9112 16.9112 17.0627 17.0627 17.1278 18.8454 18.8821 18.8821 18.9850 19.0623 19.0623 19.5332 19.5332 k = 0.3333 0.5774 0.5762 ( 4410 PWs) bands (ev): 5.2028 5.2028 5.9535 5.9535 5.9617 5.9632 7.7303 7.7303 8.5962 8.6088 8.6088 8.6211 9.4297 9.4297 9.8777 9.8777 9.9423 9.9728 10.3181 10.3443 10.3916 10.3916 10.5083 10.5083 10.6326 10.6357 10.6357 10.6596 10.7264 10.7264 10.9434 10.9434 11.0570 11.0644 11.1464 11.1464 11.3946 11.3946 11.5915 11.6469 11.8942 11.8942 12.3519 12.3519 12.5589 12.8015 13.0760 13.0760 13.1829 13.2142 13.2142 13.4024 13.4024 13.4292 13.4808 13.4808 13.6026 13.6985 13.7501 13.7501 14.2621 14.3977 14.3977 14.4240 14.4970 14.4970 14.8322 14.8322 15.4377 15.4377 15.4892 15.5297 16.8535 16.9277 16.9277 17.0587 17.0587 17.1593 18.8253 18.8253 18.8378 18.9912 19.0137 19.0137 19.6245 19.6245 k = 0.3333 0.5774 0.5968 ( 4410 PWs) bands (ev): 5.2471 5.2471 5.9940 5.9940 6.0020 6.0038 7.6845 7.6845 8.5995 8.6142 8.6142 8.6261 9.4599 9.4599 9.8667 9.8667 9.9459 9.9705 10.3107 10.3633 10.3987 10.3987 10.5121 10.5121 10.6407 10.6644 10.6644 10.6750 10.7486 10.7486 10.9218 10.9218 11.0388 11.0692 11.1360 11.1360 11.4024 11.4024 11.5661 11.6289 11.8856 11.8856 12.3283 12.3283 12.5461 12.7855 13.0847 13.0847 13.1931 13.2086 13.2086 13.4130 13.4130 13.4247 13.4776 13.4776 13.5841 13.6813 13.7464 13.7464 14.2754 14.4062 14.4062 14.4372 14.4788 14.4788 14.7988 14.7988 15.3849 15.3849 15.4404 15.4887 16.8977 16.9469 16.9469 17.0668 17.0668 17.1964 18.7433 18.7433 18.8208 18.9788 18.9788 18.9819 19.6885 19.6885 k = 0.3333 0.5774 0.6174 ( 4410 PWs) bands (ev): 5.2911 5.2911 6.0338 6.0338 6.0416 6.0438 7.6385 7.6385 8.6006 8.6178 8.6178 8.6287 9.4903 9.4903 9.8564 9.8564 9.9504 9.9697 10.3049 10.3794 10.4034 10.4034 10.5147 10.5147 10.6526 10.6894 10.6924 10.6924 10.7770 10.7770 10.9004 10.9004 11.0211 11.0735 11.1277 11.1277 11.4112 11.4112 11.5446 11.6121 11.8788 11.8788 12.3046 12.3046 12.5360 12.7699 13.0894 13.0894 13.2012 13.2043 13.2043 13.4175 13.4175 13.4180 13.4775 13.4775 13.5640 13.6632 13.7414 13.7414 14.2889 14.4145 14.4145 14.4487 14.4531 14.4531 14.7709 14.7709 15.3308 15.3308 15.3920 15.4461 16.9481 16.9670 16.9670 17.0864 17.0864 17.2378 18.6525 18.6525 18.7952 18.9434 18.9434 18.9576 19.7285 19.7285 k = 0.3333 0.5774 0.6380 ( 4425 PWs) bands (ev): 5.3345 5.3345 6.0726 6.0726 6.0803 6.0827 7.5928 7.5928 8.5999 8.6197 8.6197 8.6290 9.5204 9.5204 9.8470 9.8470 9.9560 9.9704 10.3003 10.3917 10.4065 10.4065 10.5167 10.5167 10.6682 10.7026 10.7182 10.7182 10.8090 10.8090 10.8803 10.8803 11.0042 11.0773 11.1223 11.1223 11.4209 11.4209 11.5270 11.5963 11.8737 11.8737 12.2811 12.2811 12.5286 12.7551 13.0895 13.0895 13.2019 13.2019 13.2070 13.4087 13.4143 13.4143 13.4824 13.4824 13.5433 13.6441 13.7354 13.7354 14.3023 14.4108 14.4108 14.4318 14.4318 14.4581 14.7493 14.7493 15.2766 15.2766 15.3455 15.4037 16.9877 16.9877 17.0034 17.1155 17.1155 17.2825 18.5599 18.5599 18.7620 18.9031 18.9031 18.9204 19.7706 19.7706 k = 0.3333 0.5774 0.6585 ( 4410 PWs) bands (ev): 5.3772 5.3772 6.1102 6.1102 6.1177 6.1204 7.5476 7.5476 8.5975 8.6200 8.6200 8.6272 9.5499 9.5499 9.8386 9.8386 9.9629 9.9726 10.2967 10.4002 10.4087 10.4087 10.5184 10.5184 10.6868 10.7143 10.7406 10.7406 10.8352 10.8352 10.8696 10.8696 10.9888 11.0804 11.1210 11.1210 11.4314 11.4314 11.5132 11.5815 11.8700 11.8700 12.2580 12.2580 12.5241 12.7411 13.0850 13.0850 13.2013 13.2013 13.2107 13.3960 13.4049 13.4049 13.4908 13.4908 13.5233 13.6245 13.7283 13.7283 14.3152 14.3735 14.3735 14.4383 14.4383 14.4652 14.7336 14.7336 15.2237 15.2237 15.3019 15.3627 17.0096 17.0096 17.0621 17.1513 17.1513 17.3295 18.4686 18.4686 18.7223 18.8580 18.8580 18.8733 19.8196 19.8196 k = 0.3333 0.5774 0.6791 ( 4416 PWs) bands (ev): 5.4188 5.4188 6.1462 6.1462 6.1536 6.1565 7.5035 7.5035 8.5937 8.6188 8.6188 8.6235 9.5784 9.5784 9.8314 9.8314 9.9710 9.9764 10.2940 10.4049 10.4105 10.4105 10.5203 10.5203 10.7071 10.7239 10.7576 10.7576 10.8305 10.8305 10.8929 10.8929 10.9757 11.0832 11.1247 11.1247 11.4426 11.4426 11.5031 11.5677 11.8676 11.8676 12.2355 12.2355 12.5226 12.7284 13.0766 13.0766 13.2015 13.2015 13.2121 13.3793 13.3919 13.3919 13.5003 13.5003 13.5050 13.6044 13.7206 13.7206 14.3274 14.3289 14.3289 14.4487 14.4487 14.4700 14.7225 14.7225 15.1730 15.1730 15.2621 15.3240 17.0335 17.0335 17.1234 17.1914 17.1914 17.3782 18.3797 18.3797 18.6774 18.8095 18.8095 18.8193 19.8753 19.8753 k = 0.3333 0.5774 0.6997 ( 4422 PWs) bands (ev): 5.4590 5.4590 6.1804 6.1804 6.1878 6.1908 7.4608 7.4608 8.5889 8.6165 8.6165 8.6181 9.6057 9.6057 9.8251 9.8251 9.9802 9.9815 10.2920 10.4062 10.4123 10.4123 10.5226 10.5226 10.7269 10.7315 10.7657 10.7657 10.8180 10.8180 10.9286 10.9286 10.9663 11.0859 11.1342 11.1342 11.4542 11.4542 11.4959 11.5546 11.8660 11.8660 12.2139 12.2139 12.5239 12.7170 13.0651 13.0651 13.2014 13.2014 13.2112 13.3585 13.3773 13.3773 13.4893 13.5097 13.5097 13.5843 13.7124 13.7124 14.2825 14.2825 14.3388 14.4599 14.4599 14.4724 14.7144 14.7144 15.1253 15.1253 15.2266 15.2881 17.0597 17.0597 17.1864 17.2337 17.2337 17.4279 18.2940 18.2940 18.6284 18.7592 18.7592 18.7609 19.9368 19.9368 k = 0.3333 0.5774 0.7203 ( 4422 PWs) bands (ev): 5.4974 5.4974 6.2124 6.2124 6.2199 6.2230 7.4201 7.4201 8.5833 8.6115 8.6132 8.6132 9.6313 9.6313 9.8199 9.8199 9.9878 9.9903 10.2908 10.4048 10.4142 10.4142 10.5256 10.5256 10.7366 10.7438 10.7615 10.7615 10.8108 10.8109 10.9623 10.9655 10.9655 11.0888 11.1496 11.1496 11.4661 11.4661 11.4912 11.5422 11.8650 11.8650 12.1934 12.1934 12.5282 12.7071 13.0515 13.0515 13.1998 13.1998 13.2080 13.3339 13.3626 13.3626 13.4766 13.5181 13.5181 13.5644 13.7040 13.7040 14.2365 14.2365 14.3493 14.4718 14.4718 14.4724 14.7081 14.7081 15.0810 15.0810 15.1958 15.2555 17.0880 17.0880 17.2504 17.2769 17.2769 17.4780 18.2121 18.2121 18.5764 18.6999 18.7082 18.7082 20.0035 20.0036 k = 0.3333 0.5774 0.7409 ( 4416 PWs) bands (ev): 5.5336 5.5336 6.2421 6.2421 6.2497 6.2528 7.3816 7.3816 8.5774 8.6040 8.6091 8.6091 9.6551 9.6551 9.8154 9.8154 9.9950 10.0009 10.2902 10.4010 10.4164 10.4164 10.5294 10.5294 10.7396 10.7483 10.7483 10.7555 10.8073 10.8073 10.9653 11.0022 11.0022 11.0923 11.1695 11.1695 11.4780 11.4780 11.4880 11.5305 11.8644 11.8644 12.1744 12.1744 12.5352 12.6987 13.0367 13.0367 13.1955 13.1955 13.2027 13.3067 13.3494 13.3494 13.4666 13.5253 13.5253 13.5451 13.6958 13.6958 14.1928 14.1928 14.3588 14.4704 14.4841 14.4841 14.7027 14.7027 15.0408 15.0408 15.1699 15.2263 17.1183 17.1183 17.3149 17.3199 17.3199 17.5280 18.1342 18.1342 18.5225 18.6379 18.6579 18.6579 20.0748 20.0750 k = 0.3333 0.5774 0.7614 ( 4428 PWs) bands (ev): 5.5671 5.5671 6.2691 6.2691 6.2768 6.2798 7.3460 7.3460 8.5714 8.5959 8.6047 8.6047 9.6769 9.6769 9.8116 9.8116 10.0030 10.0117 10.2905 10.3952 10.4189 10.4189 10.5341 10.5341 10.7320 10.7320 10.7404 10.7608 10.8030 10.8030 10.9758 11.0382 11.0382 11.0963 11.1920 11.1920 11.4858 11.4896 11.4896 11.5195 11.8638 11.8638 12.1571 12.1571 12.5449 12.6917 13.0216 13.0216 13.1877 13.1877 13.1954 13.2781 13.3387 13.3387 13.4588 13.5269 13.5309 13.5309 13.6880 13.6880 14.1525 14.1525 14.3676 14.4665 14.4969 14.4969 14.6974 14.6974 15.0048 15.0048 15.1487 15.2006 17.1502 17.1502 17.3614 17.3614 17.3794 17.5771 18.0609 18.0609 18.4679 18.5759 18.6093 18.6093 20.1489 20.1502 k = 0.3333 0.5774 0.7820 ( 4428 PWs) bands (ev): 5.5976 5.5976 6.2932 6.2932 6.3011 6.3039 7.3137 7.3137 8.5657 8.5877 8.6001 8.6001 9.6966 9.6966 9.8083 9.8083 10.0114 10.0221 10.2918 10.3879 10.4215 10.4215 10.5396 10.5396 10.7152 10.7152 10.7397 10.7605 10.7968 10.7968 10.9924 11.0731 11.0731 11.1007 11.2148 11.2148 11.4839 11.5007 11.5007 11.5092 11.8632 11.8632 12.1417 12.1417 12.5567 12.6859 13.0069 13.0069 13.1764 13.1764 13.1866 13.2495 13.3313 13.3313 13.4529 13.5101 13.5350 13.5350 13.6809 13.6809 14.1167 14.1167 14.3756 14.4612 14.5100 14.5100 14.6917 14.6917 14.9735 14.9735 15.1320 15.1783 17.1832 17.1832 17.4004 17.4004 17.4432 17.6245 17.9928 17.9928 18.4138 18.5149 18.5635 18.5635 20.2243 20.2297 k = 0.3333 0.5774 0.8026 ( 4419 PWs) bands (ev): 5.6245 5.6245 6.3141 6.3141 6.3222 6.3247 7.2853 7.2853 8.5606 8.5797 8.5957 8.5957 9.7140 9.7140 9.8053 9.8053 10.0199 10.0316 10.2941 10.3792 10.4243 10.4243 10.5459 10.5459 10.6990 10.6990 10.7378 10.7565 10.7893 10.7893 11.0128 11.1050 11.1061 11.1061 11.2359 11.2359 11.4819 11.4998 11.5109 11.5109 11.8626 11.8626 12.1282 12.1282 12.5705 12.6809 12.9933 12.9933 13.1626 13.1626 13.1766 13.2223 13.3270 13.3270 13.4486 13.4950 13.5375 13.5375 13.6748 13.6748 14.0859 14.0859 14.3832 14.4549 14.5232 14.5232 14.6853 14.6853 14.9470 14.9470 15.1194 15.1592 17.2167 17.2167 17.4358 17.4358 17.5058 17.6690 17.9305 17.9305 18.3618 18.4558 18.5216 18.5216 20.2950 20.3131 k = 0.3333 0.5774 0.8232 ( 4419 PWs) bands (ev): 5.6473 5.6473 6.3315 6.3315 6.3399 6.3420 7.2611 7.2611 8.5565 8.5722 8.5917 8.5917 9.7291 9.7291 9.8023 9.8023 10.0281 10.0396 10.2979 10.3696 10.4271 10.4271 10.5526 10.5526 10.6839 10.6839 10.7354 10.7507 10.7815 10.7815 11.0344 11.1086 11.1363 11.1363 11.2535 11.2535 11.4798 11.4916 11.5199 11.5199 11.8620 11.8620 12.1170 12.1170 12.5855 12.6760 12.9815 12.9815 13.1480 13.1480 13.1664 13.1977 13.3250 13.3250 13.4458 13.4819 13.5387 13.5387 13.6698 13.6698 14.0605 14.0605 14.3903 14.4478 14.5362 14.5362 14.6781 14.6781 14.9255 14.9255 15.1106 15.1432 17.2496 17.2496 17.4661 17.4661 17.5661 17.7085 17.8753 17.8753 18.3143 18.3997 18.4848 18.4848 20.3714 20.4000 k = 0.3333 0.5774 0.8438 ( 4422 PWs) bands (ev): 5.6657 5.6657 6.3453 6.3453 6.3539 6.3556 7.2417 7.2417 8.5534 8.5655 8.5883 8.5883 9.7417 9.7417 9.7993 9.7993 10.0357 10.0458 10.3031 10.3592 10.4295 10.4295 10.5595 10.5595 10.6706 10.6706 10.7332 10.7446 10.7743 10.7743 11.0552 11.1107 11.1627 11.1627 11.2667 11.2667 11.4776 11.4847 11.5272 11.5272 11.8617 11.8617 12.1080 12.1080 12.6011 12.6706 12.9720 12.9720 13.1342 13.1342 13.1569 13.1769 13.3244 13.3244 13.4444 13.4708 13.5389 13.5389 13.6659 13.6659 14.0407 14.0407 14.3973 14.4404 14.5485 14.5485 14.6703 14.6703 14.9090 14.9090 15.1052 15.1300 17.2804 17.2804 17.4900 17.4900 17.6230 17.7400 17.8288 17.8288 18.2744 18.3478 18.4542 18.4542 20.4484 20.4902 k = 0.3333 0.5774 0.8643 ( 4440 PWs) bands (ev): 5.6791 5.6791 6.3552 6.3552 6.3642 6.3654 7.2276 7.2276 8.5518 8.5599 8.5858 8.5858 9.7517 9.7517 9.7963 9.7963 10.0421 10.0497 10.3098 10.3485 10.4314 10.4314 10.5659 10.5659 10.6597 10.6597 10.7317 10.7392 10.7685 10.7685 11.0736 11.1105 11.1837 11.1837 11.2753 11.2753 11.4756 11.4795 11.5327 11.5327 11.8615 11.8615 12.1014 12.1014 12.6167 12.6638 12.9650 12.9650 13.1230 13.1230 13.1494 13.1608 13.3246 13.3246 13.4446 13.4618 13.5386 13.5386 13.6633 13.6633 14.0266 14.0266 14.4041 14.4329 14.5592 14.5592 14.6628 14.6628 14.8974 14.8974 15.1028 15.1195 17.3067 17.3067 17.5063 17.5063 17.6745 17.7597 17.7932 17.7932 18.2464 18.3021 18.4312 18.4312 20.5212 20.5807 k = 0.3333 0.5774 0.8849 ( 4440 PWs) bands (ev): 5.6873 5.6873 6.3613 6.3613 6.3706 6.3712 7.2189 7.2189 8.5516 8.5557 8.5842 8.5842 9.7584 9.7584 9.7938 9.7938 10.0471 10.0511 10.3181 10.3378 10.4327 10.4327 10.5706 10.5706 10.6523 10.6523 10.7313 10.7350 10.7647 10.7647 11.0887 11.1071 11.1975 11.1975 11.2796 11.2796 11.4744 11.4760 11.5360 11.5360 11.8614 11.8614 12.0973 12.0973 12.6312 12.6551 12.9608 12.9608 13.1157 13.1157 13.1451 13.1502 13.3249 13.3249 13.4463 13.4548 13.5382 13.5382 13.6617 13.6617 14.0182 14.0182 14.4111 14.4255 14.5669 14.5669 14.6570 14.6570 14.8905 14.8905 15.1032 15.1116 17.3251 17.3251 17.5152 17.5152 17.7176 17.7631 17.7709 17.7709 18.2348 18.2655 18.4168 18.4168 20.5834 20.6136 k = 0.3333 0.5774 0.9055 ( 4440 PWs) bands (ev): 5.6900 5.6900 6.3633 6.3633 6.3729 6.3729 7.2160 7.2160 8.5529 8.5529 8.5837 8.5837 9.7609 9.7609 9.7928 9.7928 10.0502 10.0502 10.3275 10.3275 10.4331 10.4331 10.5724 10.5724 10.6496 10.6496 10.7323 10.7323 10.7634 10.7634 11.0999 11.0999 11.2024 11.2024 11.2809 11.2809 11.4744 11.4744 11.5371 11.5371 11.8614 11.8614 12.0960 12.0960 12.6442 12.6442 12.9594 12.9594 13.1132 13.1132 13.1450 13.1450 13.3251 13.3251 13.4497 13.4497 13.5380 13.5380 13.6612 13.6612 14.0154 14.0154 14.4182 14.4182 14.5698 14.5698 14.6547 14.6547 14.8882 14.8882 15.1061 15.1061 17.3318 17.3318 17.5178 17.5178 17.7485 17.7485 17.7632 17.7632 18.2417 18.2417 18.4119 18.4119 20.6205 20.6205 Writing output data file SiPt2.save init_run : 1.37s CPU 0.81s WALL ( 1 calls) electrons : 949.41s CPU 830.76s WALL ( 1 calls) Called by init_run: wfcinit : 0.01s CPU 0.01s WALL ( 1 calls) potinit : 0.16s CPU 0.11s WALL ( 1 calls) Called by electrons: c_bands : 949.40s CPU 830.75s WALL ( 1 calls) v_of_rho : 0.02s CPU 0.01s WALL ( 1 calls) v_h : 0.00s CPU 0.00s WALL ( 1 calls) v_xc : 0.02s CPU 0.01s WALL ( 1 calls) newd : 0.58s CPU 0.31s WALL ( 1 calls) Called by c_bands: init_us_2 : 0.22s CPU 0.29s WALL ( 297 calls) cegterg : 847.59s CPU 774.29s WALL ( 900 calls) Called by sum_band: Called by *egterg: h_psi : 529.52s CPU 423.73s WALL ( 16544 calls) s_psi : 33.52s CPU 29.12s WALL ( 16544 calls) g_psi : 0.32s CPU 0.35s WALL ( 15347 calls) cdiaghg : 322.75s CPU 317.08s WALL ( 15644 calls) cegterg:over : 24.43s CPU 24.37s WALL ( 15347 calls) cegterg:upda : 12.79s CPU 13.42s WALL ( 15347 calls) cegterg:last : 8.27s CPU 8.32s WALL ( 2088 calls) cdiaghg:chol : 13.18s CPU 13.41s WALL ( 15644 calls) cdiaghg:inve : 9.33s CPU 9.50s WALL ( 15644 calls) cdiaghg:para : 18.44s CPU 18.79s WALL ( 31288 calls) Called by h_psi: h_psi:vloc : 454.94s CPU 357.88s WALL ( 16544 calls) h_psi:vnl : 74.09s CPU 65.45s WALL ( 16544 calls) add_vuspsi : 43.18s CPU 37.30s WALL ( 16544 calls) General routines calbec : 30.82s CPU 28.10s WALL ( 16544 calls) fft : 0.11s CPU 0.06s WALL ( 19 calls) ffts : 0.02s CPU 0.02s WALL ( 4 calls) fftw : 440.88s CPU 344.63s WALL ( 2042964 calls) interpolate : 0.03s CPU 0.02s WALL ( 4 calls) davcio : 0.44s CPU 0.80s WALL ( 594 calls) Parallel routines fft_scatter : 214.09s CPU 201.70s WALL ( 2042987 calls) PWSCF : 16m30.22s CPU 14m49.87s WALL This run was terminated on: 7: 1:19 29Mar2017 =------------------------------------------------------------------------------= JOB DONE. =------------------------------------------------------------------------------=