Program PWSCF v.5.3.0 (svn rev. 11974) starts on 5Jan2017 at 18: 0: 2 This program is part of the open-source Quantum ESPRESSO suite for quantum simulation of materials; please cite "P. Giannozzi et al., J. Phys.:Condens. Matter 21 395502 (2009); URL http://www.quantum-espresso.org", in publications or presentations arising from this work. More details at http://www.quantum-espresso.org/quote Parallel version (MPI), running on 36 processors R & G space division: proc/nbgrp/npool/nimage = 36 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: ./Rb2GeF6.save/ file F.rel-pbe-n-rrkjus_psl.1.0.0.UPF: wavefunction(s) 2S renormalized file Rb.rel-pbe-spn-rrkjus_psl.1.0.0.UPF: wavefunction(s) 4S renormalized Subspace diagonalization in iterative solution of the eigenvalue problem: one sub-group per k-point group (pool) will be used scalapack distributed-memory algorithm (size of sub-group: 4* 4 procs) Parallelization info -------------------- sticks: dense smooth PW G-vecs: dense smooth PW Min 73 46 13 2509 1252 193 Max 74 47 14 2512 1266 196 Sum 2647 1663 475 90369 45275 6987 bravais-lattice index = 14 lattice parameter (alat) = 10.9982 a.u. unit-cell volume = 948.2189 (a.u.)^3 number of atoms/cell = 9 number of atomic types = 3 number of electrons = 64.00 number of Kohn-Sham states= 76 kinetic-energy cutoff = 50.0000 Ry charge density cutoff = 317.0000 Ry Exchange-correlation = PBE ( 1 4 3 4 0 0) Non magnetic calculation with spin-orbit celldm(1)= 10.998205 celldm(2)= 1.000000 celldm(3)= 0.823024 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 0.823024 ) 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 1.215031 ) PseudoPot. # 1 for Ge read from file: /users/gautes/Pseudo/Ge.rel-pbe-n-rrkjus_psl.1.0.0.UPF MD5 check sum: 069ab8842bb693aa9ce6e533f48e0b78 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 1207 points, 6 beta functions with: l(1) = 0 l(2) = 0 l(3) = 1 l(4) = 1 l(5) = 1 l(6) = 1 Q(r) pseudized with 0 coefficients PseudoPot. # 2 for F read from file: /users/gautes/Pseudo/F.rel-pbe-n-rrkjus_psl.1.0.0.UPF MD5 check sum: ce20c52fa94def3fe434d52ed9f7ea44 Pseudo is Ultrasoft + core correction, Zval = 7.0 Generated using "atomic" code by A. Dal Corso v.5.0.2 svn rev. 9656 Using radial grid of 1105 points, 6 beta functions with: l(1) = 0 l(2) = 0 l(3) = 1 l(4) = 1 l(5) = 1 l(6) = 1 Q(r) pseudized with 0 coefficients PseudoPot. # 3 for Rb read from file: /users/gautes/Pseudo/Rb.rel-pbe-spn-rrkjus_psl.1.0.0.UPF MD5 check sum: 948b8f0a9070089a35782939cf30e963 Pseudo is Ultrasoft + core correction, Zval = 9.0 Generated using "atomic" code by A. Dal Corso v.5.0.2 svn rev. 9656 Using radial grid of 1219 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 Ge 4.00 72.64000 Ge( 1.00) F 7.00 18.99840 F( 1.00) Rb 9.00 85.46780 Rb( 1.00) 12 Sym. Ops., with 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 inversion 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 [1,0,0] 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. 120 deg rotation - cryst. axis [0,0,1] cryst. s( 9) = ( 0 -1 0 ) ( 1 1 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. 120 deg rotation - cryst. axis [0,0,-1] cryst. s(10) = ( 1 1 0 ) ( -1 0 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 [0,1,0] cryst. s(11) = ( 1 1 0 ) ( 0 -1 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 [1,1,0] cryst. s(12) = ( 0 -1 0 ) ( -1 0 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_3d (-3m) there are 12 classes and 6 irreducible representations the character table: E -E 2C3 -2C3 3C2' -3C2' i -i 2S6 -2S6 3s_v -3s_v G_4+ 2.00 -2.00 1.00 -1.00 0.00 0.00 2.00 -2.00 1.00 -1.00 0.00 0.00 G_5+ 1.00 -1.00 -1.00 1.00 0.00 0.00 1.00 -1.00 -1.00 1.00 0.00 0.00 G_6+ 1.00 -1.00 -1.00 1.00 0.00 0.00 1.00 -1.00 -1.00 1.00 0.00 0.00 G_4- 2.00 -2.00 1.00 -1.00 0.00 0.00 -2.00 2.00 -1.00 1.00 0.00 0.00 G_5- 1.00 -1.00 -1.00 1.00 0.00 0.00 -1.00 1.00 1.00 -1.00 0.00 0.00 G_6- 1.00 -1.00 -1.00 1.00 0.00 0.00 -1.00 1.00 1.00 -1.00 0.00 0.00 imaginary part E -E 2C3 -2C3 3C2' -3C2' i -i 2S6 -2S6 3s_v -3s_v G_4+ 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 G_5+ 0.00 0.00 0.00 0.00 1.00 -1.00 0.00 0.00 0.00 0.00 1.00 -1.00 G_6+ 0.00 0.00 0.00 0.00 -1.00 1.00 0.00 0.00 0.00 0.00 -1.00 1.00 G_4- 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 G_5- 0.00 0.00 0.00 0.00 1.00 -1.00 0.00 0.00 0.00 0.00 -1.00 1.00 G_6- 0.00 0.00 0.00 0.00 -1.00 1.00 0.00 0.00 0.00 0.00 1.00 -1.00 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' 2 5 -6 180 deg rotation - cart. axis [1,0,0] 3C2' 6 -5 -2 180 deg rotation - cryst. axis [1,1,0] i 7 inversion -i -7 inversion E 2S6 9 10 inv. 120 deg rotation - cryst. axis [0,0,1] -2S6 -9 -10 inv. 120 deg rotation - cryst. axis [0,0,1] E 3s_v 8 11 -12 inv. 180 deg rotation - cart. axis [1,0,0] 3s_v 12 -11 -8 inv. 180 deg rotation - cryst. axis [1,1,0] Cartesian axes number of k points= 280 Fermi-Dirac smearing, width (Ry)= 0.0010 cart. coord. in units 2pi/alat k( 1) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0035714 k( 2) = ( 0.0156250 0.0090211 -0.0000000), wk = 0.0035714 k( 3) = ( 0.0312500 0.0180422 -0.0000000), wk = 0.0035714 k( 4) = ( 0.0468750 0.0270633 -0.0000000), wk = 0.0035714 k( 5) = ( 0.0625000 0.0360844 -0.0000000), wk = 0.0035714 k( 6) = ( 0.0781250 0.0451055 -0.0000000), wk = 0.0035714 k( 7) = ( 0.0937500 0.0541266 -0.0000000), wk = 0.0035714 k( 8) = ( 0.1093750 0.0631477 -0.0000000), wk = 0.0035714 k( 9) = ( 0.1250000 0.0721688 -0.0000000), wk = 0.0035714 k( 10) = ( 0.1406250 0.0811899 -0.0000000), wk = 0.0035714 k( 11) = ( 0.1562500 0.0902110 -0.0000000), wk = 0.0035714 k( 12) = ( 0.1718750 0.0992321 -0.0000000), wk = 0.0035714 k( 13) = ( 0.1875000 0.1082532 -0.0000000), wk = 0.0035714 k( 14) = ( 0.2031250 0.1172743 -0.0000000), wk = 0.0035714 k( 15) = ( 0.2187500 0.1262954 -0.0000000), wk = 0.0035714 k( 16) = ( 0.2343750 0.1353165 -0.0000000), wk = 0.0035714 k( 17) = ( 0.2500000 0.1443376 -0.0000000), wk = 0.0035714 k( 18) = ( 0.2656250 0.1533587 -0.0000000), wk = 0.0035714 k( 19) = ( 0.2812500 0.1623798 -0.0000000), wk = 0.0035714 k( 20) = ( 0.2968750 0.1714009 -0.0000000), wk = 0.0035714 k( 21) = ( 0.3125000 0.1804220 -0.0000000), wk = 0.0035714 k( 22) = ( 0.3281250 0.1894431 -0.0000000), wk = 0.0035714 k( 23) = ( 0.3437500 0.1984642 -0.0000000), wk = 0.0035714 k( 24) = ( 0.3593750 0.2074853 -0.0000000), wk = 0.0035714 k( 25) = ( 0.3750000 0.2165064 -0.0000000), wk = 0.0035714 k( 26) = ( 0.3906250 0.2255274 -0.0000000), wk = 0.0035714 k( 27) = ( 0.4062500 0.2345485 -0.0000000), wk = 0.0035714 k( 28) = ( 0.4218750 0.2435696 -0.0000000), wk = 0.0035714 k( 29) = ( 0.4375000 0.2525907 -0.0000000), wk = 0.0035714 k( 30) = ( 0.4531250 0.2616118 -0.0000000), wk = 0.0035714 k( 31) = ( 0.4687500 0.2706329 -0.0000000), wk = 0.0035714 k( 32) = ( 0.4843750 0.2796540 -0.0000000), wk = 0.0035714 k( 33) = ( 0.5000000 0.2886751 -0.0000000), wk = 0.0035714 k( 34) = ( 0.5000000 0.2886751 -0.0000000), wk = 0.0035714 k( 35) = ( 0.4907407 0.3047126 -0.0000000), wk = 0.0035714 k( 36) = ( 0.4814815 0.3207502 -0.0000000), wk = 0.0035714 k( 37) = ( 0.4722222 0.3367877 -0.0000000), wk = 0.0035714 k( 38) = ( 0.4629630 0.3528252 -0.0000000), wk = 0.0035714 k( 39) = ( 0.4537037 0.3688627 -0.0000000), wk = 0.0035714 k( 40) = ( 0.4444444 0.3849002 -0.0000000), wk = 0.0035714 k( 41) = ( 0.4351852 0.4009377 -0.0000000), wk = 0.0035714 k( 42) = ( 0.4259259 0.4169752 -0.0000000), wk = 0.0035714 k( 43) = ( 0.4166667 0.4330127 -0.0000000), wk = 0.0035714 k( 44) = ( 0.4074074 0.4490502 -0.0000000), wk = 0.0035714 k( 45) = ( 0.3981481 0.4650877 -0.0000000), wk = 0.0035714 k( 46) = ( 0.3888889 0.4811252 -0.0000000), wk = 0.0035714 k( 47) = ( 0.3796296 0.4971627 -0.0000000), wk = 0.0035714 k( 48) = ( 0.3703704 0.5132002 -0.0000000), wk = 0.0035714 k( 49) = ( 0.3611111 0.5292377 -0.0000000), wk = 0.0035714 k( 50) = ( 0.3518519 0.5452753 -0.0000000), wk = 0.0035714 k( 51) = ( 0.3425926 0.5613128 -0.0000000), wk = 0.0035714 k( 52) = ( 0.3333333 0.5773503 -0.0000000), wk = 0.0035714 k( 53) = ( 0.3333333 0.5773503 -0.0000000), wk = 0.0035714 k( 54) = ( 0.3240741 0.5613128 -0.0000000), wk = 0.0035714 k( 55) = ( 0.3148148 0.5452752 -0.0000000), wk = 0.0035714 k( 56) = ( 0.3055556 0.5292378 -0.0000000), wk = 0.0035714 k( 57) = ( 0.2962963 0.5132002 -0.0000000), wk = 0.0035714 k( 58) = ( 0.2870370 0.4971627 -0.0000000), wk = 0.0035714 k( 59) = ( 0.2777778 0.4811252 -0.0000000), wk = 0.0035714 k( 60) = ( 0.2685185 0.4650877 -0.0000000), wk = 0.0035714 k( 61) = ( 0.2592593 0.4490502 -0.0000000), wk = 0.0035714 k( 62) = ( 0.2500000 0.4330127 -0.0000000), wk = 0.0035714 k( 63) = ( 0.2407407 0.4169752 -0.0000000), wk = 0.0035714 k( 64) = ( 0.2314815 0.4009377 -0.0000000), wk = 0.0035714 k( 65) = ( 0.2222222 0.3849002 -0.0000000), wk = 0.0035714 k( 66) = ( 0.2129630 0.3688627 -0.0000000), wk = 0.0035714 k( 67) = ( 0.2037037 0.3528252 -0.0000000), wk = 0.0035714 k( 68) = ( 0.1944444 0.3367876 -0.0000000), wk = 0.0035714 k( 69) = ( 0.1851852 0.3207502 -0.0000000), wk = 0.0035714 k( 70) = ( 0.1759259 0.3047126 -0.0000000), wk = 0.0035714 k( 71) = ( 0.1666667 0.2886751 -0.0000000), wk = 0.0035714 k( 72) = ( 0.1574074 0.2726376 -0.0000000), wk = 0.0035714 k( 73) = ( 0.1481482 0.2566001 -0.0000000), wk = 0.0035714 k( 74) = ( 0.1388889 0.2405626 -0.0000000), wk = 0.0035714 k( 75) = ( 0.1296296 0.2245251 -0.0000000), wk = 0.0035714 k( 76) = ( 0.1203704 0.2084876 -0.0000000), wk = 0.0035714 k( 77) = ( 0.1111111 0.1924501 -0.0000000), wk = 0.0035714 k( 78) = ( 0.1018518 0.1764126 -0.0000000), wk = 0.0035714 k( 79) = ( 0.0925926 0.1603751 -0.0000000), wk = 0.0035714 k( 80) = ( 0.0833333 0.1443376 -0.0000000), wk = 0.0035714 k( 81) = ( 0.0740741 0.1283001 -0.0000000), wk = 0.0035714 k( 82) = ( 0.0648148 0.1122625 -0.0000000), wk = 0.0035714 k( 83) = ( 0.0555556 0.0962251 -0.0000000), wk = 0.0035714 k( 84) = ( 0.0462963 0.0801875 -0.0000000), wk = 0.0035714 k( 85) = ( 0.0370370 0.0641500 -0.0000000), wk = 0.0035714 k( 86) = ( 0.0277778 0.0481125 -0.0000000), wk = 0.0035714 k( 87) = ( 0.0185185 0.0320750 -0.0000000), wk = 0.0035714 k( 88) = ( 0.0092593 0.0160375 -0.0000000), wk = 0.0035714 k( 89) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0035714 k( 90) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0035714 k( 91) = ( 0.0000000 0.0000000 0.0184096), wk = 0.0035714 k( 92) = ( 0.0000000 0.0000000 0.0368191), wk = 0.0035714 k( 93) = ( 0.0000000 0.0000000 0.0552287), wk = 0.0035714 k( 94) = ( 0.0000000 0.0000000 0.0736383), wk = 0.0035714 k( 95) = ( 0.0000000 0.0000000 0.0920478), wk = 0.0035714 k( 96) = ( 0.0000000 0.0000000 0.1104574), wk = 0.0035714 k( 97) = ( 0.0000000 0.0000000 0.1288670), wk = 0.0035714 k( 98) = ( 0.0000000 0.0000000 0.1472765), wk = 0.0035714 k( 99) = ( 0.0000000 0.0000000 0.1656861), wk = 0.0035714 k( 100) = ( 0.0000000 0.0000000 0.1840957), wk = 0.0035714 k( 101) = ( 0.0000000 0.0000000 0.2025052), wk = 0.0035714 k( 102) = ( 0.0000000 0.0000000 0.2209148), wk = 0.0035714 k( 103) = ( 0.0000000 0.0000000 0.2393244), wk = 0.0035714 k( 104) = ( 0.0000000 0.0000000 0.2577339), wk = 0.0035714 k( 105) = ( 0.0000000 0.0000000 0.2761435), wk = 0.0035714 k( 106) = ( 0.0000000 0.0000000 0.2945530), wk = 0.0035714 k( 107) = ( 0.0000000 0.0000000 0.3129626), wk = 0.0035714 k( 108) = ( 0.0000000 0.0000000 0.3313722), wk = 0.0035714 k( 109) = ( 0.0000000 0.0000000 0.3497817), wk = 0.0035714 k( 110) = ( 0.0000000 0.0000000 0.3681913), wk = 0.0035714 k( 111) = ( 0.0000000 0.0000000 0.3866009), wk = 0.0035714 k( 112) = ( 0.0000000 0.0000000 0.4050104), wk = 0.0035714 k( 113) = ( 0.0000000 0.0000000 0.4234200), wk = 0.0035714 k( 114) = ( 0.0000000 0.0000000 0.4418296), wk = 0.0035714 k( 115) = ( 0.0000000 0.0000000 0.4602391), wk = 0.0035714 k( 116) = ( 0.0000000 0.0000000 0.4786487), wk = 0.0035714 k( 117) = ( 0.0000000 0.0000000 0.4970583), wk = 0.0035714 k( 118) = ( 0.0000000 0.0000000 0.5154678), wk = 0.0035714 k( 119) = ( 0.0000000 0.0000000 0.5338774), wk = 0.0035714 k( 120) = ( 0.0000000 0.0000000 0.5522870), wk = 0.0035714 k( 121) = ( 0.0000000 0.0000000 0.5706965), wk = 0.0035714 k( 122) = ( 0.0000000 0.0000000 0.5891061), wk = 0.0035714 k( 123) = ( 0.0000000 0.0000000 0.6075157), wk = 0.0035714 k( 124) = ( 0.0000000 0.0000000 0.6075157), wk = 0.0035714 k( 125) = ( 0.0156250 0.0090211 0.6075157), wk = 0.0035714 k( 126) = ( 0.0312500 0.0180422 0.6075157), wk = 0.0035714 k( 127) = ( 0.0468750 0.0270633 0.6075157), wk = 0.0035714 k( 128) = ( 0.0625000 0.0360844 0.6075157), wk = 0.0035714 k( 129) = ( 0.0781250 0.0451055 0.6075157), wk = 0.0035714 k( 130) = ( 0.0937500 0.0541266 0.6075157), wk = 0.0035714 k( 131) = ( 0.1093750 0.0631477 0.6075157), wk = 0.0035714 k( 132) = ( 0.1250000 0.0721688 0.6075157), wk = 0.0035714 k( 133) = ( 0.1406250 0.0811899 0.6075157), wk = 0.0035714 k( 134) = ( 0.1562500 0.0902110 0.6075157), wk = 0.0035714 k( 135) = ( 0.1718750 0.0992321 0.6075157), wk = 0.0035714 k( 136) = ( 0.1875000 0.1082532 0.6075157), wk = 0.0035714 k( 137) = ( 0.2031250 0.1172743 0.6075157), wk = 0.0035714 k( 138) = ( 0.2187500 0.1262954 0.6075157), wk = 0.0035714 k( 139) = ( 0.2343750 0.1353165 0.6075157), wk = 0.0035714 k( 140) = ( 0.2500000 0.1443376 0.6075157), wk = 0.0035714 k( 141) = ( 0.2656250 0.1533587 0.6075157), wk = 0.0035714 k( 142) = ( 0.2812500 0.1623798 0.6075157), wk = 0.0035714 k( 143) = ( 0.2968750 0.1714009 0.6075157), wk = 0.0035714 k( 144) = ( 0.3125000 0.1804220 0.6075157), wk = 0.0035714 k( 145) = ( 0.3281250 0.1894431 0.6075157), wk = 0.0035714 k( 146) = ( 0.3437500 0.1984642 0.6075157), wk = 0.0035714 k( 147) = ( 0.3593750 0.2074853 0.6075157), wk = 0.0035714 k( 148) = ( 0.3750000 0.2165064 0.6075157), wk = 0.0035714 k( 149) = ( 0.3906250 0.2255274 0.6075157), wk = 0.0035714 k( 150) = ( 0.4062500 0.2345485 0.6075157), wk = 0.0035714 k( 151) = ( 0.4218750 0.2435696 0.6075157), wk = 0.0035714 k( 152) = ( 0.4375000 0.2525907 0.6075157), wk = 0.0035714 k( 153) = ( 0.4531250 0.2616118 0.6075157), wk = 0.0035714 k( 154) = ( 0.4687500 0.2706329 0.6075157), wk = 0.0035714 k( 155) = ( 0.4843750 0.2796540 0.6075157), wk = 0.0035714 k( 156) = ( 0.5000000 0.2886751 0.6075157), wk = 0.0035714 k( 157) = ( 0.5000000 0.2886751 0.6075157), wk = 0.0035714 k( 158) = ( 0.4907407 0.3047126 0.6075157), wk = 0.0035714 k( 159) = ( 0.4814815 0.3207502 0.6075157), wk = 0.0035714 k( 160) = ( 0.4722222 0.3367877 0.6075157), wk = 0.0035714 k( 161) = ( 0.4629630 0.3528252 0.6075157), wk = 0.0035714 k( 162) = ( 0.4537037 0.3688627 0.6075157), wk = 0.0035714 k( 163) = ( 0.4444444 0.3849002 0.6075157), wk = 0.0035714 k( 164) = ( 0.4351852 0.4009377 0.6075157), wk = 0.0035714 k( 165) = ( 0.4259259 0.4169752 0.6075157), wk = 0.0035714 k( 166) = ( 0.4166667 0.4330127 0.6075157), wk = 0.0035714 k( 167) = ( 0.4074074 0.4490502 0.6075157), wk = 0.0035714 k( 168) = ( 0.3981481 0.4650877 0.6075157), wk = 0.0035714 k( 169) = ( 0.3888889 0.4811252 0.6075157), wk = 0.0035714 k( 170) = ( 0.3796296 0.4971627 0.6075157), wk = 0.0035714 k( 171) = ( 0.3703704 0.5132002 0.6075157), wk = 0.0035714 k( 172) = ( 0.3611111 0.5292377 0.6075157), wk = 0.0035714 k( 173) = ( 0.3518519 0.5452753 0.6075157), wk = 0.0035714 k( 174) = ( 0.3425926 0.5613128 0.6075157), wk = 0.0035714 k( 175) = ( 0.3333333 0.5773503 0.6075157), wk = 0.0035714 k( 176) = ( 0.3333333 0.5773503 0.6075157), wk = 0.0035714 k( 177) = ( 0.3240741 0.5613128 0.6075157), wk = 0.0035714 k( 178) = ( 0.3148148 0.5452752 0.6075157), wk = 0.0035714 k( 179) = ( 0.3055556 0.5292378 0.6075157), wk = 0.0035714 k( 180) = ( 0.2962963 0.5132002 0.6075157), wk = 0.0035714 k( 181) = ( 0.2870370 0.4971627 0.6075157), wk = 0.0035714 k( 182) = ( 0.2777778 0.4811252 0.6075157), wk = 0.0035714 k( 183) = ( 0.2685185 0.4650877 0.6075157), wk = 0.0035714 k( 184) = ( 0.2592593 0.4490502 0.6075157), wk = 0.0035714 k( 185) = ( 0.2500000 0.4330127 0.6075157), wk = 0.0035714 k( 186) = ( 0.2407407 0.4169752 0.6075157), wk = 0.0035714 k( 187) = ( 0.2314815 0.4009377 0.6075157), wk = 0.0035714 k( 188) = ( 0.2222222 0.3849002 0.6075157), wk = 0.0035714 k( 189) = ( 0.2129630 0.3688627 0.6075157), wk = 0.0035714 k( 190) = ( 0.2037037 0.3528252 0.6075157), wk = 0.0035714 k( 191) = ( 0.1944444 0.3367876 0.6075157), wk = 0.0035714 k( 192) = ( 0.1851852 0.3207502 0.6075157), wk = 0.0035714 k( 193) = ( 0.1759259 0.3047126 0.6075157), wk = 0.0035714 k( 194) = ( 0.1666667 0.2886751 0.6075157), wk = 0.0035714 k( 195) = ( 0.1574074 0.2726376 0.6075157), wk = 0.0035714 k( 196) = ( 0.1481482 0.2566001 0.6075157), wk = 0.0035714 k( 197) = ( 0.1388889 0.2405626 0.6075157), wk = 0.0035714 k( 198) = ( 0.1296296 0.2245251 0.6075157), wk = 0.0035714 k( 199) = ( 0.1203704 0.2084876 0.6075157), wk = 0.0035714 k( 200) = ( 0.1111111 0.1924501 0.6075157), wk = 0.0035714 k( 201) = ( 0.1018518 0.1764126 0.6075157), wk = 0.0035714 k( 202) = ( 0.0925926 0.1603751 0.6075157), wk = 0.0035714 k( 203) = ( 0.0833333 0.1443376 0.6075157), wk = 0.0035714 k( 204) = ( 0.0740741 0.1283001 0.6075157), wk = 0.0035714 k( 205) = ( 0.0648148 0.1122625 0.6075157), wk = 0.0035714 k( 206) = ( 0.0555556 0.0962251 0.6075157), wk = 0.0035714 k( 207) = ( 0.0462963 0.0801875 0.6075157), wk = 0.0035714 k( 208) = ( 0.0370370 0.0641500 0.6075157), wk = 0.0035714 k( 209) = ( 0.0277778 0.0481125 0.6075157), wk = 0.0035714 k( 210) = ( 0.0185185 0.0320750 0.6075157), wk = 0.0035714 k( 211) = ( 0.0092593 0.0160375 0.6075157), wk = 0.0035714 k( 212) = ( 0.0000000 0.0000000 0.6075157), wk = 0.0035714 k( 213) = ( 0.5000000 0.2886751 0.6075157), wk = 0.0035714 k( 214) = ( 0.5000000 0.2886751 0.5891061), wk = 0.0035714 k( 215) = ( 0.5000000 0.2886751 0.5706965), wk = 0.0035714 k( 216) = ( 0.5000000 0.2886751 0.5522870), wk = 0.0035714 k( 217) = ( 0.5000000 0.2886751 0.5338774), wk = 0.0035714 k( 218) = ( 0.5000000 0.2886751 0.5154678), wk = 0.0035714 k( 219) = ( 0.5000000 0.2886751 0.4970583), wk = 0.0035714 k( 220) = ( 0.5000000 0.2886751 0.4786487), wk = 0.0035714 k( 221) = ( 0.5000000 0.2886751 0.4602391), wk = 0.0035714 k( 222) = ( 0.5000000 0.2886751 0.4418296), wk = 0.0035714 k( 223) = ( 0.5000000 0.2886751 0.4234200), wk = 0.0035714 k( 224) = ( 0.5000000 0.2886751 0.4050104), wk = 0.0035714 k( 225) = ( 0.5000000 0.2886751 0.3866009), wk = 0.0035714 k( 226) = ( 0.5000000 0.2886751 0.3681913), wk = 0.0035714 k( 227) = ( 0.5000000 0.2886751 0.3497817), wk = 0.0035714 k( 228) = ( 0.5000000 0.2886751 0.3313722), wk = 0.0035714 k( 229) = ( 0.5000000 0.2886751 0.3129626), wk = 0.0035714 k( 230) = ( 0.5000000 0.2886751 0.2945530), wk = 0.0035714 k( 231) = ( 0.5000000 0.2886751 0.2761435), wk = 0.0035714 k( 232) = ( 0.5000000 0.2886751 0.2577339), wk = 0.0035714 k( 233) = ( 0.5000000 0.2886751 0.2393244), wk = 0.0035714 k( 234) = ( 0.5000000 0.2886751 0.2209148), wk = 0.0035714 k( 235) = ( 0.5000000 0.2886751 0.2025052), wk = 0.0035714 k( 236) = ( 0.5000000 0.2886751 0.1840957), wk = 0.0035714 k( 237) = ( 0.5000000 0.2886751 0.1656861), wk = 0.0035714 k( 238) = ( 0.5000000 0.2886751 0.1472765), wk = 0.0035714 k( 239) = ( 0.5000000 0.2886751 0.1288670), wk = 0.0035714 k( 240) = ( 0.5000000 0.2886751 0.1104574), wk = 0.0035714 k( 241) = ( 0.5000000 0.2886751 0.0920478), wk = 0.0035714 k( 242) = ( 0.5000000 0.2886751 0.0736383), wk = 0.0035714 k( 243) = ( 0.5000000 0.2886751 0.0552287), wk = 0.0035714 k( 244) = ( 0.5000000 0.2886751 0.0368191), wk = 0.0035714 k( 245) = ( 0.5000000 0.2886751 0.0184096), wk = 0.0035714 k( 246) = ( 0.5000000 0.2886751 -0.0000000), wk = 0.0035714 k( 247) = ( 0.3333333 0.5773503 -0.0000000), wk = 0.0035714 k( 248) = ( 0.3333333 0.5773503 0.0184096), wk = 0.0035714 k( 249) = ( 0.3333333 0.5773503 0.0368191), wk = 0.0035714 k( 250) = ( 0.3333333 0.5773503 0.0552287), wk = 0.0035714 k( 251) = ( 0.3333333 0.5773503 0.0736383), wk = 0.0035714 k( 252) = ( 0.3333333 0.5773503 0.0920478), wk = 0.0035714 k( 253) = ( 0.3333333 0.5773503 0.1104574), wk = 0.0035714 k( 254) = ( 0.3333333 0.5773503 0.1288670), wk = 0.0035714 k( 255) = ( 0.3333333 0.5773503 0.1472765), wk = 0.0035714 k( 256) = ( 0.3333333 0.5773503 0.1656861), wk = 0.0035714 k( 257) = ( 0.3333333 0.5773503 0.1840957), wk = 0.0035714 k( 258) = ( 0.3333333 0.5773503 0.2025052), wk = 0.0035714 k( 259) = ( 0.3333333 0.5773503 0.2209148), wk = 0.0035714 k( 260) = ( 0.3333333 0.5773503 0.2393244), wk = 0.0035714 k( 261) = ( 0.3333333 0.5773503 0.2577339), wk = 0.0035714 k( 262) = ( 0.3333333 0.5773503 0.2761435), wk = 0.0035714 k( 263) = ( 0.3333333 0.5773503 0.2945530), wk = 0.0035714 k( 264) = ( 0.3333333 0.5773503 0.3129626), wk = 0.0035714 k( 265) = ( 0.3333333 0.5773503 0.3313722), wk = 0.0035714 k( 266) = ( 0.3333333 0.5773503 0.3497817), wk = 0.0035714 k( 267) = ( 0.3333333 0.5773503 0.3681913), wk = 0.0035714 k( 268) = ( 0.3333333 0.5773503 0.3866009), wk = 0.0035714 k( 269) = ( 0.3333333 0.5773503 0.4050104), wk = 0.0035714 k( 270) = ( 0.3333333 0.5773503 0.4234200), wk = 0.0035714 k( 271) = ( 0.3333333 0.5773503 0.4418296), wk = 0.0035714 k( 272) = ( 0.3333333 0.5773503 0.4602391), wk = 0.0035714 k( 273) = ( 0.3333333 0.5773503 0.4786487), wk = 0.0035714 k( 274) = ( 0.3333333 0.5773503 0.4970583), wk = 0.0035714 k( 275) = ( 0.3333333 0.5773503 0.5154678), wk = 0.0035714 k( 276) = ( 0.3333333 0.5773503 0.5338774), wk = 0.0035714 k( 277) = ( 0.3333333 0.5773503 0.5522870), wk = 0.0035714 k( 278) = ( 0.3333333 0.5773503 0.5706965), wk = 0.0035714 k( 279) = ( 0.3333333 0.5773503 0.5891061), wk = 0.0035714 k( 280) = ( 0.3333333 0.5773503 0.6075157), wk = 0.0035714 cryst. coord. k( 1) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0035714 k( 2) = ( 0.0156250 0.0000000 0.0000000), wk = 0.0035714 k( 3) = ( 0.0312500 0.0000000 0.0000000), wk = 0.0035714 k( 4) = ( 0.0468750 -0.0000000 -0.0000000), wk = 0.0035714 k( 5) = ( 0.0625000 0.0000000 0.0000000), wk = 0.0035714 k( 6) = ( 0.0781250 -0.0000000 0.0000000), wk = 0.0035714 k( 7) = ( 0.0937500 -0.0000000 -0.0000000), wk = 0.0035714 k( 8) = ( 0.1093750 -0.0000000 0.0000000), wk = 0.0035714 k( 9) = ( 0.1250000 0.0000000 0.0000000), wk = 0.0035714 k( 10) = ( 0.1406250 0.0000000 -0.0000000), wk = 0.0035714 k( 11) = ( 0.1562500 -0.0000000 0.0000000), wk = 0.0035714 k( 12) = ( 0.1718750 0.0000000 -0.0000000), wk = 0.0035714 k( 13) = ( 0.1875000 -0.0000000 -0.0000000), wk = 0.0035714 k( 14) = ( 0.2031250 -0.0000000 -0.0000000), wk = 0.0035714 k( 15) = ( 0.2187500 -0.0000000 0.0000000), wk = 0.0035714 k( 16) = ( 0.2343750 0.0000000 -0.0000000), wk = 0.0035714 k( 17) = ( 0.2500000 0.0000000 0.0000000), wk = 0.0035714 k( 18) = ( 0.2656250 -0.0000000 -0.0000000), wk = 0.0035714 k( 19) = ( 0.2812500 0.0000000 -0.0000000), wk = 0.0035714 k( 20) = ( 0.2968750 -0.0000000 -0.0000000), wk = 0.0035714 k( 21) = ( 0.3125000 -0.0000000 0.0000000), wk = 0.0035714 k( 22) = ( 0.3281250 -0.0000000 -0.0000000), wk = 0.0035714 k( 23) = ( 0.3437500 0.0000000 -0.0000000), wk = 0.0035714 k( 24) = ( 0.3593750 -0.0000000 -0.0000000), wk = 0.0035714 k( 25) = ( 0.3750000 -0.0000000 -0.0000000), wk = 0.0035714 k( 26) = ( 0.3906250 -0.0000000 -0.0000000), wk = 0.0035714 k( 27) = ( 0.4062500 -0.0000000 -0.0000000), wk = 0.0035714 k( 28) = ( 0.4218750 0.0000000 0.0000000), wk = 0.0035714 k( 29) = ( 0.4375000 -0.0000000 0.0000000), wk = 0.0035714 k( 30) = ( 0.4531250 0.0000000 -0.0000000), wk = 0.0035714 k( 31) = ( 0.4687500 0.0000000 -0.0000000), wk = 0.0035714 k( 32) = ( 0.4843750 -0.0000000 -0.0000000), wk = 0.0035714 k( 33) = ( 0.5000000 0.0000000 0.0000000), wk = 0.0035714 k( 34) = ( 0.5000000 0.0000000 0.0000000), wk = 0.0035714 k( 35) = ( 0.4907407 0.0185185 0.0000000), wk = 0.0035714 k( 36) = ( 0.4814815 0.0370370 -0.0000000), wk = 0.0035714 k( 37) = ( 0.4722222 0.0555556 -0.0000000), wk = 0.0035714 k( 38) = ( 0.4629630 0.0740741 -0.0000000), wk = 0.0035714 k( 39) = ( 0.4537037 0.0925926 -0.0000000), wk = 0.0035714 k( 40) = ( 0.4444444 0.1111111 0.0000000), wk = 0.0035714 k( 41) = ( 0.4351852 0.1296296 -0.0000000), wk = 0.0035714 k( 42) = ( 0.4259259 0.1481482 0.0000000), wk = 0.0035714 k( 43) = ( 0.4166667 0.1666667 -0.0000000), wk = 0.0035714 k( 44) = ( 0.4074074 0.1851852 0.0000000), wk = 0.0035714 k( 45) = ( 0.3981481 0.2037037 0.0000000), wk = 0.0035714 k( 46) = ( 0.3888889 0.2222222 -0.0000000), wk = 0.0035714 k( 47) = ( 0.3796296 0.2407407 0.0000000), wk = 0.0035714 k( 48) = ( 0.3703704 0.2592593 0.0000000), wk = 0.0035714 k( 49) = ( 0.3611111 0.2777778 -0.0000000), wk = 0.0035714 k( 50) = ( 0.3518519 0.2962963 0.0000000), wk = 0.0035714 k( 51) = ( 0.3425926 0.3148148 0.0000000), wk = 0.0035714 k( 52) = ( 0.3333333 0.3333333 0.0000000), wk = 0.0035714 k( 53) = ( 0.3333333 0.3333333 0.0000000), wk = 0.0035714 k( 54) = ( 0.3240741 0.3240741 0.0000000), wk = 0.0035714 k( 55) = ( 0.3148148 0.3148148 0.0000000), wk = 0.0035714 k( 56) = ( 0.3055556 0.3055556 0.0000000), wk = 0.0035714 k( 57) = ( 0.2962963 0.2962963 0.0000000), wk = 0.0035714 k( 58) = ( 0.2870370 0.2870370 0.0000000), wk = 0.0035714 k( 59) = ( 0.2777778 0.2777778 0.0000000), wk = 0.0035714 k( 60) = ( 0.2685185 0.2685185 0.0000000), wk = 0.0035714 k( 61) = ( 0.2592593 0.2592593 0.0000000), wk = 0.0035714 k( 62) = ( 0.2500000 0.2500000 0.0000000), wk = 0.0035714 k( 63) = ( 0.2407407 0.2407407 0.0000000), wk = 0.0035714 k( 64) = ( 0.2314815 0.2314815 0.0000000), wk = 0.0035714 k( 65) = ( 0.2222222 0.2222222 0.0000000), wk = 0.0035714 k( 66) = ( 0.2129630 0.2129630 0.0000000), wk = 0.0035714 k( 67) = ( 0.2037037 0.2037037 0.0000000), wk = 0.0035714 k( 68) = ( 0.1944444 0.1944444 0.0000000), wk = 0.0035714 k( 69) = ( 0.1851852 0.1851852 0.0000000), wk = 0.0035714 k( 70) = ( 0.1759259 0.1759259 -0.0000000), wk = 0.0035714 k( 71) = ( 0.1666667 0.1666667 0.0000000), wk = 0.0035714 k( 72) = ( 0.1574074 0.1574074 0.0000000), wk = 0.0035714 k( 73) = ( 0.1481482 0.1481481 0.0000000), wk = 0.0035714 k( 74) = ( 0.1388889 0.1388889 0.0000000), wk = 0.0035714 k( 75) = ( 0.1296296 0.1296296 0.0000000), wk = 0.0035714 k( 76) = ( 0.1203704 0.1203704 0.0000000), wk = 0.0035714 k( 77) = ( 0.1111111 0.1111111 0.0000000), wk = 0.0035714 k( 78) = ( 0.1018518 0.1018519 0.0000000), wk = 0.0035714 k( 79) = ( 0.0925926 0.0925926 -0.0000000), wk = 0.0035714 k( 80) = ( 0.0833333 0.0833333 -0.0000000), wk = 0.0035714 k( 81) = ( 0.0740741 0.0740741 0.0000000), wk = 0.0035714 k( 82) = ( 0.0648148 0.0648148 -0.0000000), wk = 0.0035714 k( 83) = ( 0.0555556 0.0555556 0.0000000), wk = 0.0035714 k( 84) = ( 0.0462963 0.0462963 -0.0000000), wk = 0.0035714 k( 85) = ( 0.0370370 0.0370370 -0.0000000), wk = 0.0035714 k( 86) = ( 0.0277778 0.0277778 0.0000000), wk = 0.0035714 k( 87) = ( 0.0185185 0.0185185 -0.0000000), wk = 0.0035714 k( 88) = ( 0.0092593 0.0092593 -0.0000000), wk = 0.0035714 k( 89) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0035714 k( 90) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0035714 k( 91) = ( 0.0000000 0.0000000 0.0151515), wk = 0.0035714 k( 92) = ( 0.0000000 0.0000000 0.0303030), wk = 0.0035714 k( 93) = ( 0.0000000 0.0000000 0.0454546), wk = 0.0035714 k( 94) = ( 0.0000000 0.0000000 0.0606061), wk = 0.0035714 k( 95) = ( 0.0000000 0.0000000 0.0757576), wk = 0.0035714 k( 96) = ( 0.0000000 0.0000000 0.0909091), wk = 0.0035714 k( 97) = ( 0.0000000 0.0000000 0.1060606), wk = 0.0035714 k( 98) = ( 0.0000000 0.0000000 0.1212121), wk = 0.0035714 k( 99) = ( 0.0000000 0.0000000 0.1363636), wk = 0.0035714 k( 100) = ( 0.0000000 0.0000000 0.1515151), wk = 0.0035714 k( 101) = ( 0.0000000 0.0000000 0.1666667), wk = 0.0035714 k( 102) = ( 0.0000000 0.0000000 0.1818182), wk = 0.0035714 k( 103) = ( 0.0000000 0.0000000 0.1969697), wk = 0.0035714 k( 104) = ( 0.0000000 0.0000000 0.2121212), wk = 0.0035714 k( 105) = ( 0.0000000 0.0000000 0.2272727), wk = 0.0035714 k( 106) = ( 0.0000000 0.0000000 0.2424242), wk = 0.0035714 k( 107) = ( 0.0000000 0.0000000 0.2575758), wk = 0.0035714 k( 108) = ( 0.0000000 0.0000000 0.2727273), wk = 0.0035714 k( 109) = ( 0.0000000 0.0000000 0.2878788), wk = 0.0035714 k( 110) = ( 0.0000000 0.0000000 0.3030303), wk = 0.0035714 k( 111) = ( 0.0000000 0.0000000 0.3181818), wk = 0.0035714 k( 112) = ( 0.0000000 0.0000000 0.3333333), wk = 0.0035714 k( 113) = ( 0.0000000 0.0000000 0.3484849), wk = 0.0035714 k( 114) = ( 0.0000000 0.0000000 0.3636364), wk = 0.0035714 k( 115) = ( 0.0000000 0.0000000 0.3787879), wk = 0.0035714 k( 116) = ( 0.0000000 0.0000000 0.3939394), wk = 0.0035714 k( 117) = ( 0.0000000 0.0000000 0.4090909), wk = 0.0035714 k( 118) = ( 0.0000000 0.0000000 0.4242424), wk = 0.0035714 k( 119) = ( 0.0000000 0.0000000 0.4393939), wk = 0.0035714 k( 120) = ( 0.0000000 0.0000000 0.4545455), wk = 0.0035714 k( 121) = ( 0.0000000 0.0000000 0.4696970), wk = 0.0035714 k( 122) = ( 0.0000000 0.0000000 0.4848485), wk = 0.0035714 k( 123) = ( 0.0000000 0.0000000 0.5000000), wk = 0.0035714 k( 124) = ( 0.0000000 0.0000000 0.5000000), wk = 0.0035714 k( 125) = ( 0.0156250 0.0000000 0.5000000), wk = 0.0035714 k( 126) = ( 0.0312500 0.0000000 0.5000000), wk = 0.0035714 k( 127) = ( 0.0468750 -0.0000000 0.5000000), wk = 0.0035714 k( 128) = ( 0.0625000 0.0000000 0.5000000), wk = 0.0035714 k( 129) = ( 0.0781250 -0.0000000 0.5000000), wk = 0.0035714 k( 130) = ( 0.0937500 -0.0000000 0.5000000), wk = 0.0035714 k( 131) = ( 0.1093750 -0.0000000 0.5000000), wk = 0.0035714 k( 132) = ( 0.1250000 0.0000000 0.5000000), wk = 0.0035714 k( 133) = ( 0.1406250 0.0000000 0.5000000), wk = 0.0035714 k( 134) = ( 0.1562500 -0.0000000 0.5000000), wk = 0.0035714 k( 135) = ( 0.1718750 0.0000000 0.5000000), wk = 0.0035714 k( 136) = ( 0.1875000 -0.0000000 0.5000000), wk = 0.0035714 k( 137) = ( 0.2031250 -0.0000000 0.5000000), wk = 0.0035714 k( 138) = ( 0.2187500 -0.0000000 0.5000000), wk = 0.0035714 k( 139) = ( 0.2343750 0.0000000 0.5000000), wk = 0.0035714 k( 140) = ( 0.2500000 0.0000000 0.5000000), wk = 0.0035714 k( 141) = ( 0.2656250 -0.0000000 0.5000000), wk = 0.0035714 k( 142) = ( 0.2812500 0.0000000 0.5000000), wk = 0.0035714 k( 143) = ( 0.2968750 -0.0000000 0.5000000), wk = 0.0035714 k( 144) = ( 0.3125000 -0.0000000 0.5000000), wk = 0.0035714 k( 145) = ( 0.3281250 -0.0000000 0.5000000), wk = 0.0035714 k( 146) = ( 0.3437500 0.0000000 0.5000000), wk = 0.0035714 k( 147) = ( 0.3593750 -0.0000000 0.5000000), wk = 0.0035714 k( 148) = ( 0.3750000 -0.0000000 0.5000000), wk = 0.0035714 k( 149) = ( 0.3906250 -0.0000000 0.5000000), wk = 0.0035714 k( 150) = ( 0.4062500 -0.0000000 0.5000000), wk = 0.0035714 k( 151) = ( 0.4218750 0.0000000 0.5000000), wk = 0.0035714 k( 152) = ( 0.4375000 -0.0000000 0.5000000), wk = 0.0035714 k( 153) = ( 0.4531250 0.0000000 0.5000000), wk = 0.0035714 k( 154) = ( 0.4687500 0.0000000 0.5000000), wk = 0.0035714 k( 155) = ( 0.4843750 -0.0000000 0.5000000), wk = 0.0035714 k( 156) = ( 0.5000000 0.0000000 0.5000000), wk = 0.0035714 k( 157) = ( 0.5000000 0.0000000 0.5000000), wk = 0.0035714 k( 158) = ( 0.4907407 0.0185185 0.5000000), wk = 0.0035714 k( 159) = ( 0.4814815 0.0370370 0.5000000), wk = 0.0035714 k( 160) = ( 0.4722222 0.0555556 0.5000000), wk = 0.0035714 k( 161) = ( 0.4629630 0.0740741 0.5000000), wk = 0.0035714 k( 162) = ( 0.4537037 0.0925926 0.5000000), wk = 0.0035714 k( 163) = ( 0.4444444 0.1111111 0.5000000), wk = 0.0035714 k( 164) = ( 0.4351852 0.1296296 0.5000000), wk = 0.0035714 k( 165) = ( 0.4259259 0.1481482 0.5000000), wk = 0.0035714 k( 166) = ( 0.4166667 0.1666667 0.5000000), wk = 0.0035714 k( 167) = ( 0.4074074 0.1851852 0.5000000), wk = 0.0035714 k( 168) = ( 0.3981481 0.2037037 0.5000000), wk = 0.0035714 k( 169) = ( 0.3888889 0.2222222 0.5000000), wk = 0.0035714 k( 170) = ( 0.3796296 0.2407407 0.5000000), wk = 0.0035714 k( 171) = ( 0.3703704 0.2592593 0.5000000), wk = 0.0035714 k( 172) = ( 0.3611111 0.2777778 0.5000000), wk = 0.0035714 k( 173) = ( 0.3518519 0.2962963 0.5000000), wk = 0.0035714 k( 174) = ( 0.3425926 0.3148148 0.5000000), wk = 0.0035714 k( 175) = ( 0.3333333 0.3333333 0.5000000), wk = 0.0035714 k( 176) = ( 0.3333333 0.3333333 0.5000000), wk = 0.0035714 k( 177) = ( 0.3240741 0.3240741 0.5000000), wk = 0.0035714 k( 178) = ( 0.3148148 0.3148148 0.5000000), wk = 0.0035714 k( 179) = ( 0.3055556 0.3055556 0.5000000), wk = 0.0035714 k( 180) = ( 0.2962963 0.2962963 0.5000000), wk = 0.0035714 k( 181) = ( 0.2870370 0.2870370 0.5000000), wk = 0.0035714 k( 182) = ( 0.2777778 0.2777778 0.5000000), wk = 0.0035714 k( 183) = ( 0.2685185 0.2685185 0.5000000), wk = 0.0035714 k( 184) = ( 0.2592593 0.2592593 0.5000000), wk = 0.0035714 k( 185) = ( 0.2500000 0.2500000 0.5000000), wk = 0.0035714 k( 186) = ( 0.2407407 0.2407407 0.5000000), wk = 0.0035714 k( 187) = ( 0.2314815 0.2314815 0.5000000), wk = 0.0035714 k( 188) = ( 0.2222222 0.2222222 0.5000000), wk = 0.0035714 k( 189) = ( 0.2129630 0.2129630 0.5000000), wk = 0.0035714 k( 190) = ( 0.2037037 0.2037037 0.5000000), wk = 0.0035714 k( 191) = ( 0.1944444 0.1944444 0.5000000), wk = 0.0035714 k( 192) = ( 0.1851852 0.1851852 0.5000000), wk = 0.0035714 k( 193) = ( 0.1759259 0.1759259 0.5000000), wk = 0.0035714 k( 194) = ( 0.1666667 0.1666667 0.5000000), wk = 0.0035714 k( 195) = ( 0.1574074 0.1574074 0.5000000), wk = 0.0035714 k( 196) = ( 0.1481482 0.1481481 0.5000000), wk = 0.0035714 k( 197) = ( 0.1388889 0.1388889 0.5000000), wk = 0.0035714 k( 198) = ( 0.1296296 0.1296296 0.5000000), wk = 0.0035714 k( 199) = ( 0.1203704 0.1203704 0.5000000), wk = 0.0035714 k( 200) = ( 0.1111111 0.1111111 0.5000000), wk = 0.0035714 k( 201) = ( 0.1018518 0.1018519 0.5000000), wk = 0.0035714 k( 202) = ( 0.0925926 0.0925926 0.5000000), wk = 0.0035714 k( 203) = ( 0.0833333 0.0833333 0.5000000), wk = 0.0035714 k( 204) = ( 0.0740741 0.0740741 0.5000000), wk = 0.0035714 k( 205) = ( 0.0648148 0.0648148 0.5000000), wk = 0.0035714 k( 206) = ( 0.0555556 0.0555556 0.5000000), wk = 0.0035714 k( 207) = ( 0.0462963 0.0462963 0.5000000), wk = 0.0035714 k( 208) = ( 0.0370370 0.0370370 0.5000000), wk = 0.0035714 k( 209) = ( 0.0277778 0.0277778 0.5000000), wk = 0.0035714 k( 210) = ( 0.0185185 0.0185185 0.5000000), wk = 0.0035714 k( 211) = ( 0.0092593 0.0092593 0.5000000), wk = 0.0035714 k( 212) = ( 0.0000000 0.0000000 0.5000000), wk = 0.0035714 k( 213) = ( 0.5000000 0.0000000 0.5000000), wk = 0.0035714 k( 214) = ( 0.5000000 0.0000000 0.4848485), wk = 0.0035714 k( 215) = ( 0.5000000 0.0000000 0.4696970), wk = 0.0035714 k( 216) = ( 0.5000000 0.0000000 0.4545454), wk = 0.0035714 k( 217) = ( 0.5000000 0.0000000 0.4393939), wk = 0.0035714 k( 218) = ( 0.5000000 0.0000000 0.4242424), wk = 0.0035714 k( 219) = ( 0.5000000 0.0000000 0.4090909), wk = 0.0035714 k( 220) = ( 0.5000000 0.0000000 0.3939394), wk = 0.0035714 k( 221) = ( 0.5000000 0.0000000 0.3787879), wk = 0.0035714 k( 222) = ( 0.5000000 0.0000000 0.3636364), wk = 0.0035714 k( 223) = ( 0.5000000 0.0000000 0.3484849), wk = 0.0035714 k( 224) = ( 0.5000000 0.0000000 0.3333333), wk = 0.0035714 k( 225) = ( 0.5000000 0.0000000 0.3181818), wk = 0.0035714 k( 226) = ( 0.5000000 0.0000000 0.3030303), wk = 0.0035714 k( 227) = ( 0.5000000 0.0000000 0.2878788), wk = 0.0035714 k( 228) = ( 0.5000000 0.0000000 0.2727273), wk = 0.0035714 k( 229) = ( 0.5000000 0.0000000 0.2575758), wk = 0.0035714 k( 230) = ( 0.5000000 0.0000000 0.2424242), wk = 0.0035714 k( 231) = ( 0.5000000 0.0000000 0.2272727), wk = 0.0035714 k( 232) = ( 0.5000000 0.0000000 0.2121212), wk = 0.0035714 k( 233) = ( 0.5000000 0.0000000 0.1969697), wk = 0.0035714 k( 234) = ( 0.5000000 0.0000000 0.1818182), wk = 0.0035714 k( 235) = ( 0.5000000 0.0000000 0.1666667), wk = 0.0035714 k( 236) = ( 0.5000000 0.0000000 0.1515151), wk = 0.0035714 k( 237) = ( 0.5000000 0.0000000 0.1363636), wk = 0.0035714 k( 238) = ( 0.5000000 0.0000000 0.1212121), wk = 0.0035714 k( 239) = ( 0.5000000 0.0000000 0.1060606), wk = 0.0035714 k( 240) = ( 0.5000000 0.0000000 0.0909091), wk = 0.0035714 k( 241) = ( 0.5000000 0.0000000 0.0757576), wk = 0.0035714 k( 242) = ( 0.5000000 0.0000000 0.0606061), wk = 0.0035714 k( 243) = ( 0.5000000 0.0000000 0.0454546), wk = 0.0035714 k( 244) = ( 0.5000000 0.0000000 0.0303030), wk = 0.0035714 k( 245) = ( 0.5000000 0.0000000 0.0151515), wk = 0.0035714 k( 246) = ( 0.5000000 0.0000000 0.0000000), wk = 0.0035714 k( 247) = ( 0.3333333 0.3333333 0.0000000), wk = 0.0035714 k( 248) = ( 0.3333333 0.3333333 0.0151515), wk = 0.0035714 k( 249) = ( 0.3333333 0.3333333 0.0303030), wk = 0.0035714 k( 250) = ( 0.3333333 0.3333333 0.0454546), wk = 0.0035714 k( 251) = ( 0.3333333 0.3333333 0.0606061), wk = 0.0035714 k( 252) = ( 0.3333333 0.3333333 0.0757576), wk = 0.0035714 k( 253) = ( 0.3333333 0.3333333 0.0909091), wk = 0.0035714 k( 254) = ( 0.3333333 0.3333333 0.1060606), wk = 0.0035714 k( 255) = ( 0.3333333 0.3333333 0.1212121), wk = 0.0035714 k( 256) = ( 0.3333333 0.3333333 0.1363636), wk = 0.0035714 k( 257) = ( 0.3333333 0.3333333 0.1515151), wk = 0.0035714 k( 258) = ( 0.3333333 0.3333333 0.1666667), wk = 0.0035714 k( 259) = ( 0.3333333 0.3333333 0.1818182), wk = 0.0035714 k( 260) = ( 0.3333333 0.3333333 0.1969697), wk = 0.0035714 k( 261) = ( 0.3333333 0.3333333 0.2121212), wk = 0.0035714 k( 262) = ( 0.3333333 0.3333333 0.2272727), wk = 0.0035714 k( 263) = ( 0.3333333 0.3333333 0.2424242), wk = 0.0035714 k( 264) = ( 0.3333333 0.3333333 0.2575758), wk = 0.0035714 k( 265) = ( 0.3333333 0.3333333 0.2727273), wk = 0.0035714 k( 266) = ( 0.3333333 0.3333333 0.2878788), wk = 0.0035714 k( 267) = ( 0.3333333 0.3333333 0.3030303), wk = 0.0035714 k( 268) = ( 0.3333333 0.3333333 0.3181818), wk = 0.0035714 k( 269) = ( 0.3333333 0.3333333 0.3333333), wk = 0.0035714 k( 270) = ( 0.3333333 0.3333333 0.3484849), wk = 0.0035714 k( 271) = ( 0.3333333 0.3333333 0.3636364), wk = 0.0035714 k( 272) = ( 0.3333333 0.3333333 0.3787879), wk = 0.0035714 k( 273) = ( 0.3333333 0.3333333 0.3939394), wk = 0.0035714 k( 274) = ( 0.3333333 0.3333333 0.4090909), wk = 0.0035714 k( 275) = ( 0.3333333 0.3333333 0.4242424), wk = 0.0035714 k( 276) = ( 0.3333333 0.3333333 0.4393939), wk = 0.0035714 k( 277) = ( 0.3333333 0.3333333 0.4545455), wk = 0.0035714 k( 278) = ( 0.3333333 0.3333333 0.4696970), wk = 0.0035714 k( 279) = ( 0.3333333 0.3333333 0.4848485), wk = 0.0035714 k( 280) = ( 0.3333333 0.3333333 0.5000000), wk = 0.0035714 Dense grid: 90369 G-vectors FFT dimensions: ( 64, 64, 54) Smooth grid: 45275 G-vectors FFT dimensions: ( 50, 50, 45) Largest allocated arrays est. size (Mb) dimensions Kohn-Sham Wavefunctions 0.39 Mb ( 340, 76) NL pseudopotentials 0.43 Mb ( 170, 166) Each V/rho on FFT grid 0.12 Mb ( 8192) Each G-vector array 0.02 Mb ( 2512) G-vector shells 0.01 Mb ( 1153) Largest temporary arrays est. size (Mb) dimensions Auxiliary wavefunctions 1.58 Mb ( 340, 304) Each subspace H/S matrix 0.09 Mb ( 76, 76) Each matrix 0.39 Mb ( 166, 2, 76) Check: negative/imaginary core charge= -0.000001 0.000000 The potential is recalculated from file : ./Rb2GeF6.save/charge-density.dat Starting wfc are 88 randomized atomic wfcs Band Structure Calculation Davidson diagonalization with overlap Computing kpt #: 1 total cpu time spent up to now is 3.0 secs Computing kpt #: 2 total cpu time spent up to now is 4.0 secs Computing kpt #: 3 total cpu time spent up to now is 4.9 secs Computing kpt #: 4 total cpu time spent up to now is 5.8 secs Computing kpt #: 5 total cpu time spent up to now is 6.6 secs Computing kpt #: 6 total cpu time spent up to now is 7.5 secs Computing kpt #: 7 total cpu time spent up to now is 8.4 secs Computing kpt #: 8 total cpu time spent up to now is 9.3 secs Computing kpt #: 9 total cpu time spent up to now is 10.3 secs Computing kpt #: 10 total cpu time spent up to now is 11.3 secs Computing kpt #: 11 total cpu time spent up to now is 12.3 secs Computing kpt #: 12 total cpu time spent up to now is 13.3 secs Computing kpt #: 13 total cpu time spent up to now is 14.3 secs Computing kpt #: 14 total cpu time spent up to now is 15.2 secs Computing kpt #: 15 total cpu time spent up to now is 16.2 secs Computing kpt #: 16 total cpu time spent up to now is 17.2 secs Computing kpt #: 17 total cpu time spent up to now is 18.2 secs Computing kpt #: 18 total cpu time spent up to now is 19.3 secs Computing kpt #: 19 total cpu time spent up to now is 20.3 secs Computing kpt #: 20 total cpu time spent up to now is 21.3 secs Computing kpt #: 21 total cpu time spent up to now is 22.3 secs Computing kpt #: 22 total cpu time spent up to now is 23.3 secs Computing kpt #: 23 total cpu time spent up to now is 24.4 secs Computing kpt #: 24 total cpu time spent up to now is 25.4 secs Computing kpt #: 25 total cpu time spent up to now is 26.5 secs Computing kpt #: 26 total cpu time spent up to now is 27.5 secs Computing kpt #: 27 total cpu time spent up to now is 28.5 secs Computing kpt #: 28 total cpu time spent up to now is 29.5 secs Computing kpt #: 29 total cpu time spent up to now is 30.6 secs Computing kpt #: 30 total cpu time spent up to now is 31.6 secs Computing kpt #: 31 total cpu time spent up to now is 32.6 secs Computing kpt #: 32 total cpu time spent up to now is 33.6 secs Computing kpt #: 33 total cpu time spent up to now is 34.6 secs Computing kpt #: 34 total cpu time spent up to now is 35.6 secs Computing kpt #: 35 total cpu time spent up to now is 36.6 secs Computing kpt #: 36 total cpu time spent up to now is 37.6 secs Computing kpt #: 37 total cpu time spent up to now is 38.5 secs Computing kpt #: 38 total cpu time spent up to now is 39.5 secs Computing kpt #: 39 total cpu time spent up to now is 40.3 secs Computing kpt #: 40 total cpu time spent up to now is 41.2 secs Computing kpt #: 41 total cpu time spent up to now is 42.1 secs Computing kpt #: 42 total cpu time spent up to now is 43.0 secs Computing kpt #: 43 total cpu time spent up to now is 43.9 secs Computing kpt #: 44 total cpu time spent up to now is 44.7 secs Computing kpt #: 45 total cpu time spent up to now is 45.6 secs Computing kpt #: 46 total cpu time spent up to now is 46.5 secs Computing kpt #: 47 total cpu time spent up to now is 47.3 secs Computing kpt #: 48 total cpu time spent up to now is 48.2 secs Computing kpt #: 49 total cpu time spent up to now is 49.0 secs Computing kpt #: 50 total cpu time spent up to now is 49.9 secs Computing kpt #: 51 total cpu time spent up to now is 50.8 secs Computing kpt #: 52 total cpu time spent up to now is 51.6 secs Computing kpt #: 53 total cpu time spent up to now is 52.5 secs Computing kpt #: 54 total cpu time spent up to now is 53.4 secs Computing kpt #: 55 total cpu time spent up to now is 54.2 secs Computing kpt #: 56 total cpu time spent up to now is 55.1 secs Computing kpt #: 57 total cpu time spent up to now is 56.1 secs Computing kpt #: 58 total cpu time spent up to now is 57.1 secs Computing kpt #: 59 total cpu time spent up to now is 58.1 secs Computing kpt #: 60 total cpu time spent up to now is 59.1 secs Computing kpt #: 61 total cpu time spent up to now is 60.1 secs Computing kpt #: 62 total cpu time spent up to now is 61.1 secs Computing kpt #: 63 total cpu time spent up to now is 62.1 secs Computing kpt #: 64 total cpu time spent up to now is 63.1 secs Computing kpt #: 65 total cpu time spent up to now is 64.2 secs Computing kpt #: 66 total cpu time spent up to now is 65.2 secs Computing kpt #: 67 total cpu time spent up to now is 66.2 secs Computing kpt #: 68 total cpu time spent up to now is 67.2 secs Computing kpt #: 69 total cpu time spent up to now is 68.2 secs Computing kpt #: 70 total cpu time spent up to now is 69.2 secs Computing kpt #: 71 total cpu time spent up to now is 70.2 secs Computing kpt #: 72 total cpu time spent up to now is 71.2 secs Computing kpt #: 73 total cpu time spent up to now is 72.2 secs Computing kpt #: 74 total cpu time spent up to now is 73.2 secs Computing kpt #: 75 total cpu time spent up to now is 74.2 secs Computing kpt #: 76 total cpu time spent up to now is 75.3 secs Computing kpt #: 77 total cpu time spent up to now is 76.3 secs Computing kpt #: 78 total cpu time spent up to now is 77.3 secs Computing kpt #: 79 total cpu time spent up to now is 78.3 secs Computing kpt #: 80 total cpu time spent up to now is 79.2 secs Computing kpt #: 81 total cpu time spent up to now is 80.1 secs Computing kpt #: 82 total cpu time spent up to now is 80.9 secs Computing kpt #: 83 total cpu time spent up to now is 81.8 secs Computing kpt #: 84 total cpu time spent up to now is 82.7 secs Computing kpt #: 85 total cpu time spent up to now is 83.6 secs Computing kpt #: 86 total cpu time spent up to now is 84.5 secs Computing kpt #: 87 total cpu time spent up to now is 85.4 secs Computing kpt #: 88 total cpu time spent up to now is 86.2 secs Computing kpt #: 89 total cpu time spent up to now is 87.2 secs Computing kpt #: 90 total cpu time spent up to now is 88.2 secs Computing kpt #: 91 total cpu time spent up to now is 89.1 secs Computing kpt #: 92 total cpu time spent up to now is 90.0 secs Computing kpt #: 93 total cpu time spent up to now is 90.8 secs Computing kpt #: 94 total cpu time spent up to now is 91.7 secs Computing kpt #: 95 total cpu time spent up to now is 92.6 secs Computing kpt #: 96 total cpu time spent up to now is 93.6 secs Computing kpt #: 97 total cpu time spent up to now is 94.4 secs Computing kpt #: 98 total cpu time spent up to now is 95.4 secs Computing kpt #: 99 total cpu time spent up to now is 96.3 secs Computing kpt #: 100 total cpu time spent up to now is 97.3 secs Computing kpt #: 101 total cpu time spent up to now is 98.3 secs Computing kpt #: 102 total cpu time spent up to now is 99.3 secs Computing kpt #: 103 total cpu time spent up to now is 100.3 secs Computing kpt #: 104 total cpu time spent up to now is 101.2 secs Computing kpt #: 105 total cpu time spent up to now is 102.2 secs Computing kpt #: 106 total cpu time spent up to now is 103.2 secs Computing kpt #: 107 total cpu time spent up to now is 104.2 secs Computing kpt #: 108 total cpu time spent up to now is 105.2 secs Computing kpt #: 109 total cpu time spent up to now is 106.0 secs Computing kpt #: 110 total cpu time spent up to now is 107.0 secs Computing kpt #: 111 total cpu time spent up to now is 108.0 secs Computing kpt #: 112 total cpu time spent up to now is 109.0 secs Computing kpt #: 113 total cpu time spent up to now is 109.9 secs Computing kpt #: 114 total cpu time spent up to now is 110.9 secs Computing kpt #: 115 total cpu time spent up to now is 111.8 secs Computing kpt #: 116 total cpu time spent up to now is 112.8 secs Computing kpt #: 117 total cpu time spent up to now is 113.7 secs Computing kpt #: 118 total cpu time spent up to now is 114.7 secs Computing kpt #: 119 total cpu time spent up to now is 115.6 secs Computing kpt #: 120 total cpu time spent up to now is 116.6 secs Computing kpt #: 121 total cpu time spent up to now is 117.5 secs Computing kpt #: 122 total cpu time spent up to now is 118.4 secs Computing kpt #: 123 total cpu time spent up to now is 119.2 secs Computing kpt #: 124 total cpu time spent up to now is 120.1 secs Computing kpt #: 125 total cpu time spent up to now is 120.9 secs Computing kpt #: 126 total cpu time spent up to now is 121.8 secs Computing kpt #: 127 total cpu time spent up to now is 122.7 secs Computing kpt #: 128 total cpu time spent up to now is 123.5 secs Computing kpt #: 129 total cpu time spent up to now is 124.4 secs Computing kpt #: 130 total cpu time spent up to now is 125.3 secs Computing kpt #: 131 total cpu time spent up to now is 126.1 secs Computing kpt #: 132 total cpu time spent up to now is 127.0 secs Computing kpt #: 133 total cpu time spent up to now is 127.9 secs Computing kpt #: 134 total cpu time spent up to now is 128.9 secs Computing kpt #: 135 total cpu time spent up to now is 129.8 secs Computing kpt #: 136 total cpu time spent up to now is 130.6 secs Computing kpt #: 137 total cpu time spent up to now is 131.5 secs Computing kpt #: 138 total cpu time spent up to now is 132.5 secs Computing kpt #: 139 total cpu time spent up to now is 133.5 secs Computing kpt #: 140 total cpu time spent up to now is 134.5 secs Computing kpt #: 141 total cpu time spent up to now is 135.5 secs Computing kpt #: 142 total cpu time spent up to now is 136.5 secs Computing kpt #: 143 total cpu time spent up to now is 137.5 secs Computing kpt #: 144 total cpu time spent up to now is 138.5 secs Computing kpt #: 145 total cpu time spent up to now is 139.5 secs Computing kpt #: 146 total cpu time spent up to now is 140.5 secs Computing kpt #: 147 total cpu time spent up to now is 141.5 secs Computing kpt #: 148 total cpu time spent up to now is 142.5 secs Computing kpt #: 149 total cpu time spent up to now is 143.5 secs Computing kpt #: 150 total cpu time spent up to now is 144.5 secs Computing kpt #: 151 total cpu time spent up to now is 145.6 secs Computing kpt #: 152 total cpu time spent up to now is 146.6 secs Computing kpt #: 153 total cpu time spent up to now is 147.6 secs Computing kpt #: 154 total cpu time spent up to now is 148.6 secs Computing kpt #: 155 total cpu time spent up to now is 149.5 secs Computing kpt #: 156 total cpu time spent up to now is 150.4 secs Computing kpt #: 157 total cpu time spent up to now is 151.2 secs Computing kpt #: 158 total cpu time spent up to now is 152.1 secs Computing kpt #: 159 total cpu time spent up to now is 153.0 secs Computing kpt #: 160 total cpu time spent up to now is 153.9 secs Computing kpt #: 161 total cpu time spent up to now is 154.8 secs Computing kpt #: 162 total cpu time spent up to now is 155.7 secs Computing kpt #: 163 total cpu time spent up to now is 156.5 secs Computing kpt #: 164 total cpu time spent up to now is 157.4 secs Computing kpt #: 165 total cpu time spent up to now is 158.2 secs Computing kpt #: 166 total cpu time spent up to now is 159.0 secs Computing kpt #: 167 total cpu time spent up to now is 159.9 secs Computing kpt #: 168 total cpu time spent up to now is 160.7 secs Computing kpt #: 169 total cpu time spent up to now is 161.6 secs Computing kpt #: 170 total cpu time spent up to now is 162.4 secs Computing kpt #: 171 total cpu time spent up to now is 163.3 secs Computing kpt #: 172 total cpu time spent up to now is 164.1 secs Computing kpt #: 173 total cpu time spent up to now is 165.0 secs Computing kpt #: 174 total cpu time spent up to now is 166.0 secs Computing kpt #: 175 total cpu time spent up to now is 167.1 secs Computing kpt #: 176 total cpu time spent up to now is 168.0 secs Computing kpt #: 177 total cpu time spent up to now is 168.9 secs Computing kpt #: 178 total cpu time spent up to now is 169.7 secs Computing kpt #: 179 total cpu time spent up to now is 170.6 secs Computing kpt #: 180 total cpu time spent up to now is 171.4 secs Computing kpt #: 181 total cpu time spent up to now is 172.2 secs Computing kpt #: 182 total cpu time spent up to now is 173.1 secs Computing kpt #: 183 total cpu time spent up to now is 173.9 secs Computing kpt #: 184 total cpu time spent up to now is 174.8 secs Computing kpt #: 185 total cpu time spent up to now is 175.6 secs Computing kpt #: 186 total cpu time spent up to now is 176.4 secs Computing kpt #: 187 total cpu time spent up to now is 177.3 secs Computing kpt #: 188 total cpu time spent up to now is 178.1 secs Computing kpt #: 189 total cpu time spent up to now is 178.9 secs Computing kpt #: 190 total cpu time spent up to now is 179.7 secs Computing kpt #: 191 total cpu time spent up to now is 180.6 secs Computing kpt #: 192 total cpu time spent up to now is 181.4 secs Computing kpt #: 193 total cpu time spent up to now is 182.3 secs Computing kpt #: 194 total cpu time spent up to now is 183.1 secs Computing kpt #: 195 total cpu time spent up to now is 184.0 secs Computing kpt #: 196 total cpu time spent up to now is 184.8 secs Computing kpt #: 197 total cpu time spent up to now is 185.7 secs Computing kpt #: 198 total cpu time spent up to now is 186.5 secs Computing kpt #: 199 total cpu time spent up to now is 187.4 secs Computing kpt #: 200 total cpu time spent up to now is 188.3 secs Computing kpt #: 201 total cpu time spent up to now is 189.1 secs Computing kpt #: 202 total cpu time spent up to now is 190.0 secs Computing kpt #: 203 total cpu time spent up to now is 190.9 secs Computing kpt #: 204 total cpu time spent up to now is 191.7 secs Computing kpt #: 205 total cpu time spent up to now is 192.7 secs Computing kpt #: 206 total cpu time spent up to now is 193.6 secs Computing kpt #: 207 total cpu time spent up to now is 194.5 secs Computing kpt #: 208 total cpu time spent up to now is 195.3 secs Computing kpt #: 209 total cpu time spent up to now is 196.2 secs Computing kpt #: 210 total cpu time spent up to now is 197.0 secs Computing kpt #: 211 total cpu time spent up to now is 197.9 secs Computing kpt #: 212 total cpu time spent up to now is 198.9 secs Computing kpt #: 213 total cpu time spent up to now is 199.7 secs Computing kpt #: 214 total cpu time spent up to now is 200.8 secs Computing kpt #: 215 total cpu time spent up to now is 201.6 secs Computing kpt #: 216 total cpu time spent up to now is 202.5 secs Computing kpt #: 217 total cpu time spent up to now is 203.4 secs Computing kpt #: 218 total cpu time spent up to now is 204.4 secs Computing kpt #: 219 total cpu time spent up to now is 205.4 secs Computing kpt #: 220 total cpu time spent up to now is 206.4 secs Computing kpt #: 221 total cpu time spent up to now is 207.4 secs Computing kpt #: 222 total cpu time spent up to now is 208.4 secs Computing kpt #: 223 total cpu time spent up to now is 209.4 secs Computing kpt #: 224 total cpu time spent up to now is 210.4 secs Computing kpt #: 225 total cpu time spent up to now is 211.4 secs Computing kpt #: 226 total cpu time spent up to now is 212.5 secs Computing kpt #: 227 total cpu time spent up to now is 213.5 secs Computing kpt #: 228 total cpu time spent up to now is 214.5 secs Computing kpt #: 229 total cpu time spent up to now is 215.5 secs Computing kpt #: 230 total cpu time spent up to now is 216.5 secs Computing kpt #: 231 total cpu time spent up to now is 217.5 secs Computing kpt #: 232 total cpu time spent up to now is 218.5 secs Computing kpt #: 233 total cpu time spent up to now is 219.5 secs Computing kpt #: 234 total cpu time spent up to now is 220.4 secs Computing kpt #: 235 total cpu time spent up to now is 221.3 secs Computing kpt #: 236 total cpu time spent up to now is 222.3 secs Computing kpt #: 237 total cpu time spent up to now is 223.3 secs Computing kpt #: 238 total cpu time spent up to now is 224.3 secs Computing kpt #: 239 total cpu time spent up to now is 225.3 secs Computing kpt #: 240 total cpu time spent up to now is 226.2 secs Computing kpt #: 241 total cpu time spent up to now is 227.1 secs Computing kpt #: 242 total cpu time spent up to now is 228.1 secs Computing kpt #: 243 total cpu time spent up to now is 229.1 secs Computing kpt #: 244 total cpu time spent up to now is 230.1 secs Computing kpt #: 245 total cpu time spent up to now is 231.1 secs Computing kpt #: 246 total cpu time spent up to now is 232.1 secs Computing kpt #: 247 total cpu time spent up to now is 233.0 secs Computing kpt #: 248 total cpu time spent up to now is 233.9 secs Computing kpt #: 249 total cpu time spent up to now is 234.8 secs Computing kpt #: 250 total cpu time spent up to now is 235.6 secs Computing kpt #: 251 total cpu time spent up to now is 236.5 secs Computing kpt #: 252 total cpu time spent up to now is 237.5 secs Computing kpt #: 253 total cpu time spent up to now is 238.5 secs Computing kpt #: 254 total cpu time spent up to now is 239.5 secs Computing kpt #: 255 total cpu time spent up to now is 240.5 secs Computing kpt #: 256 total cpu time spent up to now is 241.5 secs Computing kpt #: 257 total cpu time spent up to now is 242.4 secs Computing kpt #: 258 total cpu time spent up to now is 243.2 secs Computing kpt #: 259 total cpu time spent up to now is 244.1 secs Computing kpt #: 260 total cpu time spent up to now is 245.0 secs Computing kpt #: 261 total cpu time spent up to now is 245.8 secs Computing kpt #: 262 total cpu time spent up to now is 246.8 secs Computing kpt #: 263 total cpu time spent up to now is 247.7 secs Computing kpt #: 264 total cpu time spent up to now is 248.7 secs Computing kpt #: 265 total cpu time spent up to now is 249.6 secs Computing kpt #: 266 total cpu time spent up to now is 250.6 secs Computing kpt #: 267 total cpu time spent up to now is 251.5 secs Computing kpt #: 268 total cpu time spent up to now is 252.4 secs Computing kpt #: 269 total cpu time spent up to now is 253.3 secs Computing kpt #: 270 total cpu time spent up to now is 254.2 secs Computing kpt #: 271 total cpu time spent up to now is 255.0 secs Computing kpt #: 272 total cpu time spent up to now is 255.9 secs Computing kpt #: 273 total cpu time spent up to now is 256.8 secs Computing kpt #: 274 total cpu time spent up to now is 257.7 secs Computing kpt #: 275 total cpu time spent up to now is 258.5 secs Computing kpt #: 276 total cpu time spent up to now is 259.4 secs Computing kpt #: 277 total cpu time spent up to now is 260.2 secs Computing kpt #: 278 total cpu time spent up to now is 261.1 secs Computing kpt #: 279 total cpu time spent up to now is 261.9 secs Computing kpt #: 280 total cpu time spent up to now is 262.7 secs ethr = 1.56E-08, avg # of iterations = 20.4 total cpu time spent up to now is 262.7 secs End of band structure calculation k = 0.0000 0.0000 0.0000 ( 5673 PWs) bands (ev): -20.8367 -20.8367 -20.6492 -20.6492 -19.7398 -19.7398 -18.7167 -18.7167 -18.7078 -18.7078 -18.6466 -18.6466 -18.1085 -18.1085 -18.1085 -18.1085 -5.6799 -5.6799 -5.3254 -5.3254 -5.1193 -5.1193 -4.8939 -4.8939 -4.4765 -4.4765 -4.4645 -4.4645 -4.4402 -4.4402 -2.0699 -2.0699 -1.9864 -1.9864 -1.9549 -1.9549 -0.6375 -0.6375 -0.1720 -0.1720 -0.1384 -0.1384 0.3692 0.3692 0.3757 0.3757 0.6953 0.6953 0.6995 0.6995 0.7869 0.7869 1.0116 1.0116 1.0759 1.0759 1.2559 1.2559 1.5094 1.5094 1.5600 1.5600 1.5814 1.5814 8.1606 8.1606 11.5028 11.5028 12.1057 12.1057 12.4588 12.4588 12.4746 12.4746 12.7641 12.7641 k = 0.0156 0.0090-0.0000 ( 5661 PWs) bands (ev): -20.8365 -20.8365 -20.6492 -20.6492 -19.7400 -19.7400 -18.7167 -18.7167 -18.7078 -18.7078 -18.6465 -18.6465 -18.1085 -18.1085 -18.1085 -18.1085 -5.6797 -5.6797 -5.3258 -5.3258 -5.1187 -5.1187 -4.8934 -4.8934 -4.4782 -4.4782 -4.4631 -4.4631 -4.4398 -4.4398 -2.0694 -2.0694 -1.9863 -1.9863 -1.9549 -1.9549 -0.6375 -0.6375 -0.1723 -0.1723 -0.1388 -0.1388 0.3689 0.3689 0.3754 0.3754 0.6952 0.6952 0.6994 0.6994 0.7865 0.7865 1.0109 1.0109 1.0751 1.0751 1.2558 1.2558 1.5092 1.5092 1.5598 1.5598 1.5811 1.5811 8.1633 8.1633 11.5038 11.5038 12.1023 12.1023 12.4588 12.4588 12.4747 12.4747 12.7666 12.7666 k = 0.0312 0.0180-0.0000 ( 5671 PWs) bands (ev): -20.8359 -20.8359 -20.6494 -20.6494 -19.7406 -19.7406 -18.7167 -18.7167 -18.7078 -18.7078 -18.6464 -18.6464 -18.1087 -18.1087 -18.1085 -18.1085 -5.6788 -5.6788 -5.3271 -5.3271 -5.1167 -5.1167 -4.8918 -4.8918 -4.4818 -4.4818 -4.4603 -4.4603 -4.4385 -4.4385 -2.0681 -2.0681 -1.9861 -1.9861 -1.9547 -1.9547 -0.6373 -0.6373 -0.1732 -0.1732 -0.1399 -0.1399 0.3679 0.3679 0.3746 0.3746 0.6947 0.6947 0.6992 0.6992 0.7855 0.7855 1.0088 1.0088 1.0729 1.0729 1.2556 1.2556 1.5084 1.5084 1.5590 1.5590 1.5804 1.5804 8.1712 8.1712 11.5068 11.5068 12.0923 12.0923 12.4589 12.4589 12.4749 12.4749 12.7742 12.7742 k = 0.0469 0.0271-0.0000 ( 5665 PWs) bands (ev): -20.8350 -20.8350 -20.6496 -20.6496 -19.7417 -19.7417 -18.7167 -18.7167 -18.7078 -18.7078 -18.6462 -18.6462 -18.1090 -18.1090 -18.1084 -18.1084 -5.6773 -5.6773 -5.3293 -5.3293 -5.1135 -5.1135 -4.8893 -4.8893 -4.4862 -4.4862 -4.4575 -4.4575 -4.4363 -4.4363 -2.0658 -2.0658 -1.9856 -1.9856 -1.9544 -1.9544 -0.6370 -0.6370 -0.1747 -0.1747 -0.1417 -0.1417 0.3660 0.3660 0.3735 0.3735 0.6936 0.6936 0.6991 0.6991 0.7838 0.7838 1.0053 1.0053 1.0694 1.0694 1.2552 1.2552 1.5072 1.5072 1.5578 1.5578 1.5792 1.5792 8.1843 8.1843 11.5118 11.5118 12.0762 12.0762 12.4588 12.4588 12.4757 12.4757 12.7865 12.7865 k = 0.0625 0.0361-0.0000 ( 5673 PWs) bands (ev): -20.8336 -20.8336 -20.6498 -20.6498 -19.7432 -19.7432 -18.7167 -18.7167 -18.7078 -18.7078 -18.6458 -18.6458 -18.1094 -18.1094 -18.1084 -18.1084 -5.6753 -5.6753 -5.3321 -5.3321 -5.1091 -5.1091 -4.8858 -4.8858 -4.4908 -4.4908 -4.4553 -4.4553 -4.4328 -4.4328 -2.0628 -2.0628 -1.9849 -1.9849 -1.9540 -1.9540 -0.6365 -0.6365 -0.1770 -0.1770 -0.1440 -0.1440 0.3630 0.3630 0.3724 0.3724 0.6918 0.6918 0.6991 0.6991 0.7816 0.7816 1.0000 1.0000 1.0649 1.0649 1.2547 1.2547 1.5055 1.5055 1.5559 1.5559 1.5776 1.5776 8.2026 8.2026 11.5186 11.5186 12.0546 12.0546 12.4582 12.4582 12.4774 12.4774 12.8029 12.8029 k = 0.0781 0.0451-0.0000 ( 5677 PWs) bands (ev): -20.8319 -20.8319 -20.6502 -20.6502 -19.7452 -19.7452 -18.7167 -18.7167 -18.7078 -18.7078 -18.6454 -18.6454 -18.1100 -18.1100 -18.1083 -18.1083 -5.6728 -5.6728 -5.3355 -5.3355 -5.1038 -5.1038 -4.8814 -4.8814 -4.4956 -4.4956 -4.4539 -4.4539 -4.4283 -4.4283 -2.0589 -2.0589 -1.9840 -1.9840 -1.9535 -1.9535 -0.6360 -0.6360 -0.1802 -0.1802 -0.1467 -0.1467 0.3589 0.3589 0.3713 0.3713 0.6894 0.6894 0.6991 0.6991 0.7789 0.7789 0.9928 0.9928 1.0598 1.0598 1.2541 1.2541 1.5033 1.5033 1.5535 1.5535 1.5758 1.5758 8.2260 8.2260 11.5272 11.5272 12.0282 12.0282 12.4569 12.4569 12.4805 12.4805 12.8233 12.8233 k = 0.0938 0.0541-0.0000 ( 5661 PWs) bands (ev): -20.8298 -20.8298 -20.6506 -20.6506 -19.7475 -19.7475 -18.7167 -18.7167 -18.7078 -18.7078 -18.6449 -18.6449 -18.1106 -18.1106 -18.1082 -18.1082 -5.6697 -5.6697 -5.3395 -5.3395 -5.0976 -5.0976 -4.8760 -4.8760 -4.5004 -4.5004 -4.4531 -4.4531 -4.4228 -4.4228 -2.0543 -2.0543 -1.9828 -1.9828 -1.9528 -1.9528 -0.6354 -0.6354 -0.1846 -0.1846 -0.1496 -0.1496 0.3538 0.3538 0.3701 0.3701 0.6863 0.6863 0.6991 0.6991 0.7759 0.7759 0.9834 0.9834 1.0544 1.0544 1.2534 1.2534 1.5006 1.5006 1.5503 1.5503 1.5738 1.5738 8.2543 8.2543 11.5376 11.5376 11.9978 11.9978 12.4551 12.4551 12.4848 12.4848 12.8471 12.8471 k = 0.1094 0.0631-0.0000 ( 5663 PWs) bands (ev): -20.8274 -20.8274 -20.6511 -20.6511 -19.7502 -19.7502 -18.7168 -18.7168 -18.7078 -18.7078 -18.6443 -18.6443 -18.1113 -18.1113 -18.1081 -18.1081 -5.6661 -5.6661 -5.3438 -5.3438 -5.0906 -5.0906 -4.8697 -4.8697 -4.5053 -4.5053 -4.4526 -4.4526 -4.4167 -4.4167 -2.0491 -2.0491 -1.9814 -1.9814 -1.9519 -1.9519 -0.6347 -0.6347 -0.1902 -0.1902 -0.1524 -0.1524 0.3478 0.3478 0.3689 0.3689 0.6827 0.6827 0.6987 0.6987 0.7727 0.7727 0.9717 0.9717 1.0490 1.0490 1.2525 1.2525 1.4975 1.4975 1.5464 1.5464 1.5719 1.5719 8.2873 8.2873 11.5494 11.5494 11.9640 11.9640 12.4529 12.4529 12.4904 12.4904 12.8741 12.8741 k = 0.1250 0.0722-0.0000 ( 5655 PWs) bands (ev): -20.8246 -20.8246 -20.6517 -20.6517 -19.7533 -19.7533 -18.7168 -18.7168 -18.7078 -18.7078 -18.6436 -18.6436 -18.1121 -18.1121 -18.1080 -18.1080 -5.6621 -5.6621 -5.3484 -5.3484 -5.0830 -5.0830 -4.8626 -4.8626 -4.5102 -4.5102 -4.4524 -4.4524 -4.4101 -4.4101 -2.0434 -2.0434 -1.9795 -1.9795 -1.9507 -1.9507 -0.6341 -0.6341 -0.1973 -0.1973 -0.1551 -0.1551 0.3409 0.3409 0.3676 0.3676 0.6787 0.6787 0.6979 0.6979 0.7697 0.7697 0.9577 0.9577 1.0438 1.0438 1.2516 1.2516 1.4940 1.4940 1.5419 1.5419 1.5699 1.5699 8.3249 8.3249 11.5626 11.5626 11.9274 11.9274 12.4507 12.4507 12.4971 12.4971 12.9039 12.9039 k = 0.1406 0.0812-0.0000 ( 5643 PWs) bands (ev): -20.8215 -20.8215 -20.6524 -20.6524 -19.7567 -19.7567 -18.7168 -18.7168 -18.7078 -18.7078 -18.6428 -18.6428 -18.1131 -18.1131 -18.1078 -18.1078 -5.6576 -5.6576 -5.3532 -5.3532 -5.0749 -5.0749 -4.8547 -4.8547 -4.5151 -4.5151 -4.4524 -4.4524 -4.4032 -4.4032 -2.0374 -2.0374 -1.9773 -1.9773 -1.9491 -1.9491 -0.6334 -0.6334 -0.2058 -0.2058 -0.1576 -0.1576 0.3333 0.3333 0.3662 0.3662 0.6741 0.6741 0.6963 0.6963 0.7670 0.7670 0.9417 0.9417 1.0388 1.0388 1.2505 1.2505 1.4900 1.4900 1.5367 1.5367 1.5680 1.5680 8.3668 8.3668 11.5768 11.5768 11.8886 11.8886 12.4486 12.4486 12.5048 12.5048 12.9358 12.9358 k = 0.1562 0.0902-0.0000 ( 5645 PWs) bands (ev): -20.8180 -20.8180 -20.6532 -20.6532 -19.7604 -19.7604 -18.7169 -18.7169 -18.7077 -18.7077 -18.6420 -18.6420 -18.1141 -18.1141 -18.1077 -18.1077 -5.6526 -5.6526 -5.3582 -5.3582 -5.0665 -5.0665 -4.8461 -4.8461 -4.5200 -4.5200 -4.4525 -4.4525 -4.3960 -4.3960 -2.0313 -2.0313 -1.9747 -1.9747 -1.9470 -1.9470 -0.6327 -0.6327 -0.2157 -0.2157 -0.1599 -0.1599 0.3250 0.3250 0.3647 0.3647 0.6692 0.6692 0.6938 0.6938 0.7649 0.7649 0.9239 0.9239 1.0341 1.0341 1.2494 1.2494 1.4857 1.4857 1.5309 1.5309 1.5662 1.5662 8.4129 8.4129 11.5917 11.5917 11.8480 11.8480 12.4470 12.4470 12.5134 12.5134 12.9693 12.9693 k = 0.1719 0.0992-0.0000 ( 5649 PWs) bands (ev): -20.8143 -20.8143 -20.6541 -20.6541 -19.7644 -19.7644 -18.7170 -18.7170 -18.7077 -18.7077 -18.6411 -18.6411 -18.1151 -18.1151 -18.1075 -18.1075 -5.6473 -5.6473 -5.3633 -5.3633 -5.0577 -5.0577 -4.8370 -4.8370 -4.5248 -4.5248 -4.4527 -4.4527 -4.3886 -4.3886 -2.0253 -2.0253 -1.9718 -1.9718 -1.9443 -1.9443 -0.6322 -0.6322 -0.2268 -0.2268 -0.1621 -0.1621 0.3161 0.3161 0.3632 0.3632 0.6638 0.6638 0.6902 0.6902 0.7635 0.7635 0.9046 0.9046 1.0295 1.0295 1.2483 1.2483 1.4811 1.4811 1.5248 1.5248 1.5645 1.5645 8.4628 8.4628 11.6065 11.6065 11.8065 11.8065 12.4461 12.4461 12.5229 12.5229 13.0034 13.0034 k = 0.1875 0.1083-0.0000 ( 5645 PWs) bands (ev): -20.8103 -20.8103 -20.6550 -20.6550 -19.7686 -19.7686 -18.7171 -18.7171 -18.7077 -18.7077 -18.6401 -18.6401 -18.1163 -18.1163 -18.1074 -18.1074 -5.6416 -5.6416 -5.3684 -5.3684 -5.0488 -5.0488 -4.8273 -4.8273 -4.5294 -4.5294 -4.4529 -4.4529 -4.3811 -4.3811 -2.0196 -2.0196 -1.9686 -1.9686 -1.9406 -1.9406 -0.6317 -0.6317 -0.2390 -0.2390 -0.1641 -0.1641 0.3067 0.3067 0.3615 0.3615 0.6582 0.6582 0.6854 0.6854 0.7630 0.7630 0.8840 0.8840 1.0251 1.0251 1.2470 1.2470 1.4761 1.4761 1.5183 1.5183 1.5627 1.5627 8.5164 8.5164 11.6195 11.6195 11.7657 11.7657 12.4463 12.4463 12.5329 12.5329 13.0380 13.0380 k = 0.2031 0.1173-0.0000 ( 5645 PWs) bands (ev): -20.8061 -20.8061 -20.6561 -20.6561 -19.7730 -19.7730 -18.7172 -18.7172 -18.7076 -18.7076 -18.6391 -18.6391 -18.1175 -18.1175 -18.1072 -18.1072 -5.6356 -5.6356 -5.3735 -5.3735 -5.0397 -5.0397 -4.8173 -4.8173 -4.5339 -4.5339 -4.4531 -4.4531 -4.3736 -4.3736 -2.0143 -2.0143 -1.9654 -1.9654 -1.9356 -1.9356 -0.6314 -0.6314 -0.2522 -0.2522 -0.1660 -0.1660 0.2969 0.2969 0.3598 0.3598 0.6522 0.6522 0.6796 0.6796 0.7634 0.7634 0.8626 0.8626 1.0208 1.0208 1.2458 1.2458 1.4710 1.4710 1.5116 1.5116 1.5611 1.5611 8.5733 8.5733 11.6262 11.6262 11.7299 11.7299 12.4477 12.4477 12.5435 12.5435 13.0727 13.0727 k = 0.2188 0.1263-0.0000 ( 5655 PWs) bands (ev): -20.8017 -20.8017 -20.6572 -20.6572 -19.7776 -19.7776 -18.7173 -18.7173 -18.7076 -18.7076 -18.6380 -18.6380 -18.1187 -18.1187 -18.1070 -18.1070 -5.6292 -5.6292 -5.3787 -5.3787 -5.0305 -5.0305 -4.8072 -4.8072 -4.5380 -4.5380 -4.4534 -4.4534 -4.3661 -4.3661 -2.0096 -2.0096 -1.9625 -1.9625 -1.9292 -1.9292 -0.6312 -0.6312 -0.2663 -0.2663 -0.1679 -0.1679 0.2867 0.2867 0.3580 0.3580 0.6460 0.6460 0.6728 0.6728 0.7645 0.7645 0.8405 0.8405 1.0167 1.0167 1.2445 1.2445 1.4656 1.4656 1.5048 1.5048 1.5594 1.5594 8.6332 8.6332 11.6154 11.6154 11.7103 11.7103 12.4509 12.4509 12.5543 12.5543 13.1076 13.1076 k = 0.2344 0.1353-0.0000 ( 5651 PWs) bands (ev): -20.7970 -20.7970 -20.6585 -20.6585 -19.7823 -19.7823 -18.7175 -18.7175 -18.7075 -18.7075 -18.6369 -18.6369 -18.1200 -18.1200 -18.1068 -18.1068 -5.6226 -5.6226 -5.3839 -5.3839 -5.0213 -5.0213 -4.7971 -4.7971 -4.5416 -4.5416 -4.4537 -4.4537 -4.3588 -4.3588 -2.0053 -2.0053 -1.9598 -1.9598 -1.9214 -1.9214 -0.6312 -0.6312 -0.2810 -0.2810 -0.1698 -0.1698 0.2763 0.2763 0.3561 0.3561 0.6396 0.6396 0.6654 0.6654 0.7661 0.7661 0.8183 0.8183 1.0126 1.0126 1.2432 1.2432 1.4601 1.4601 1.4979 1.4979 1.5578 1.5578 8.6958 8.6958 11.5820 11.5820 11.7117 11.7117 12.4561 12.4561 12.5654 12.5654 13.1422 13.1422 k = 0.2500 0.1443-0.0000 ( 5653 PWs) bands (ev): -20.7922 -20.7922 -20.6598 -20.6598 -19.7871 -19.7871 -18.7177 -18.7177 -18.7075 -18.7075 -18.6358 -18.6358 -18.1212 -18.1212 -18.1067 -18.1067 -5.6157 -5.6157 -5.3891 -5.3891 -5.0121 -5.0121 -4.7872 -4.7872 -4.5446 -4.5446 -4.4540 -4.4540 -4.3517 -4.3517 -2.0015 -2.0015 -1.9575 -1.9575 -1.9122 -1.9122 -0.6315 -0.6315 -0.2962 -0.2962 -0.1715 -0.1715 0.2657 0.2657 0.3543 0.3543 0.6329 0.6329 0.6574 0.6574 0.7679 0.7679 0.7963 0.7963 1.0086 1.0086 1.2419 1.2419 1.4545 1.4545 1.4912 1.4912 1.5562 1.5562 8.7608 8.7608 11.5369 11.5369 11.7231 11.7231 12.4636 12.4636 12.5765 12.5765 13.1753 13.1753 k = 0.2656 0.1534-0.0000 ( 5649 PWs) bands (ev): -20.7873 -20.7873 -20.6613 -20.6613 -19.7919 -19.7919 -18.7178 -18.7178 -18.7074 -18.7074 -18.6346 -18.6346 -18.1225 -18.1225 -18.1065 -18.1065 -5.6086 -5.6086 -5.3943 -5.3943 -5.0030 -5.0030 -4.7778 -4.7778 -4.5469 -4.5469 -4.4543 -4.4543 -4.3450 -4.3450 -1.9981 -1.9981 -1.9554 -1.9554 -1.9021 -1.9021 -0.6321 -0.6321 -0.3118 -0.3118 -0.1733 -0.1733 0.2551 0.2551 0.3524 0.3524 0.6260 0.6260 0.6491 0.6491 0.7678 0.7678 0.7768 0.7768 1.0048 1.0048 1.2406 1.2406 1.4489 1.4489 1.4845 1.4845 1.5547 1.5547 8.8278 8.8278 11.4870 11.4870 11.7374 11.7374 12.4737 12.4737 12.5874 12.5874 13.2034 13.2034 k = 0.2812 0.1624-0.0000 ( 5634 PWs) bands (ev): -20.7822 -20.7822 -20.6629 -20.6629 -19.7966 -19.7966 -18.7180 -18.7180 -18.7074 -18.7074 -18.6334 -18.6334 -18.1238 -18.1238 -18.1063 -18.1063 -5.6013 -5.6013 -5.3996 -5.3996 -4.9940 -4.9940 -4.7692 -4.7692 -4.5482 -4.5482 -4.4546 -4.4546 -4.3386 -4.3386 -1.9950 -1.9950 -1.9535 -1.9535 -1.8911 -1.8911 -0.6329 -0.6329 -0.3275 -0.3275 -0.1749 -0.1749 0.2445 0.2445 0.3505 0.3505 0.6190 0.6190 0.6406 0.6406 0.7512 0.7512 0.7747 0.7747 1.0011 1.0011 1.2394 1.2394 1.4433 1.4433 1.4781 1.4781 1.5532 1.5532 8.8964 8.8964 11.4344 11.4344 11.7523 11.7523 12.4867 12.4867 12.5981 12.5981 13.2260 13.2260 k = 0.2969 0.1714-0.0000 ( 5650 PWs) bands (ev): -20.7771 -20.7771 -20.6646 -20.6646 -19.8014 -19.8014 -18.7182 -18.7182 -18.7073 -18.7073 -18.6323 -18.6323 -18.1251 -18.1251 -18.1061 -18.1061 -5.5938 -5.5938 -5.4050 -5.4050 -4.9851 -4.9851 -4.7616 -4.7616 -4.5484 -4.5484 -4.4548 -4.4548 -4.3326 -4.3326 -1.9922 -1.9922 -1.9518 -1.9518 -1.8798 -1.8798 -0.6341 -0.6341 -0.3430 -0.3430 -0.1766 -0.1766 0.2340 0.2340 0.3487 0.3487 0.6117 0.6117 0.6320 0.6320 0.7310 0.7310 0.7772 0.7772 0.9975 0.9975 1.2382 1.2382 1.4378 1.4378 1.4719 1.4719 1.5517 1.5517 8.9663 8.9663 11.3801 11.3801 11.7669 11.7669 12.5029 12.5029 12.6084 12.6084 13.2457 13.2457 k = 0.3125 0.1804-0.0000 ( 5648 PWs) bands (ev): -20.7719 -20.7719 -20.6664 -20.6664 -19.8060 -19.8060 -18.7184 -18.7184 -18.7073 -18.7073 -18.6312 -18.6312 -18.1264 -18.1264 -18.1060 -18.1060 -5.5862 -5.5862 -5.4104 -5.4104 -4.9764 -4.9764 -4.7553 -4.7553 -4.5473 -4.5473 -4.4550 -4.4550 -4.3272 -4.3272 -1.9896 -1.9896 -1.9502 -1.9502 -1.8682 -1.8682 -0.6356 -0.6356 -0.3583 -0.3583 -0.1781 -0.1781 0.2237 0.2237 0.3469 0.3469 0.6043 0.6043 0.6235 0.6235 0.7117 0.7117 0.7800 0.7800 0.9941 0.9941 1.2371 1.2371 1.4325 1.4325 1.4660 1.4660 1.5503 1.5503 9.0369 9.0369 11.3247 11.3247 11.7805 11.7805 12.5223 12.5223 12.6182 12.6182 13.2633 13.2633 k = 0.3281 0.1894-0.0000 ( 5646 PWs) bands (ev): -20.7668 -20.7668 -20.6683 -20.6683 -19.8105 -19.8105 -18.7186 -18.7186 -18.7072 -18.7072 -18.6300 -18.6300 -18.1276 -18.1276 -18.1058 -18.1058 -5.5784 -5.5784 -5.4160 -5.4160 -4.9680 -4.9680 -4.7503 -4.7503 -4.5450 -4.5450 -4.4552 -4.4552 -4.3223 -4.3223 -1.9871 -1.9871 -1.9487 -1.9487 -1.8565 -1.8565 -0.6375 -0.6375 -0.3730 -0.3730 -0.1796 -0.1796 0.2137 0.2137 0.3451 0.3451 0.5966 0.5966 0.6151 0.6151 0.6938 0.6938 0.7828 0.7828 0.9910 0.9910 1.2360 1.2360 1.4273 1.4273 1.4604 1.4604 1.5490 1.5490 9.1077 9.1077 11.2685 11.2685 11.7929 11.7929 12.5450 12.5450 12.6275 12.6275 13.2794 13.2794 k = 0.3438 0.1985-0.0000 ( 5650 PWs) bands (ev): -20.7616 -20.7616 -20.6703 -20.6703 -19.8147 -19.8147 -18.7188 -18.7188 -18.7072 -18.7072 -18.6290 -18.6290 -18.1287 -18.1287 -18.1057 -18.1057 -5.5705 -5.5705 -5.4217 -5.4217 -4.9598 -4.9598 -4.7468 -4.7468 -4.5413 -4.5413 -4.4554 -4.4554 -4.3181 -4.3181 -1.9849 -1.9849 -1.9473 -1.9473 -1.8451 -1.8451 -0.6397 -0.6397 -0.3871 -0.3871 -0.1810 -0.1810 0.2042 0.2042 0.3434 0.3434 0.5887 0.5887 0.6069 0.6069 0.6775 0.6775 0.7856 0.7856 0.9880 0.9880 1.2351 1.2351 1.4225 1.4225 1.4553 1.4553 1.5477 1.5477 9.1783 9.1783 11.2120 11.2120 11.8041 11.8041 12.5710 12.5710 12.6361 12.6361 13.2941 13.2941 k = 0.3594 0.2075-0.0000 ( 5646 PWs) bands (ev): -20.7565 -20.7565 -20.6724 -20.6724 -19.8188 -19.8188 -18.7189 -18.7189 -18.7071 -18.7071 -18.6280 -18.6280 -18.1298 -18.1298 -18.1055 -18.1055 -5.5626 -5.5626 -5.4275 -5.4275 -4.9520 -4.9520 -4.7447 -4.7447 -4.5365 -4.5365 -4.4556 -4.4556 -4.3144 -4.3144 -1.9828 -1.9828 -1.9460 -1.9460 -1.8341 -1.8341 -0.6422 -0.6422 -0.4002 -0.4002 -0.1823 -0.1823 0.1952 0.1952 0.3419 0.3419 0.5806 0.5806 0.5991 0.5991 0.6632 0.6632 0.7883 0.7883 0.9853 0.9853 1.2342 1.2342 1.4179 1.4179 1.4505 1.4505 1.5465 1.5465 9.2478 9.2478 11.1558 11.1558 11.8139 11.8139 12.6002 12.6002 12.6440 12.6440 13.3072 13.3072 k = 0.3750 0.2165-0.0000 ( 5654 PWs) bands (ev): -20.7516 -20.7516 -20.6746 -20.6746 -19.8225 -19.8225 -18.7191 -18.7191 -18.7071 -18.7071 -18.6271 -18.6271 -18.1308 -18.1308 -18.1054 -18.1054 -5.5546 -5.5546 -5.4335 -5.4335 -4.9446 -4.9446 -4.7439 -4.7439 -4.5309 -4.5309 -4.4557 -4.4557 -4.3114 -4.3114 -1.9808 -1.9808 -1.9447 -1.9447 -1.8236 -1.8236 -0.6449 -0.6449 -0.4122 -0.4122 -0.1835 -0.1835 0.1869 0.1869 0.3404 0.3404 0.5723 0.5723 0.5918 0.5918 0.6510 0.6510 0.7908 0.7908 0.9828 0.9828 1.2334 1.2334 1.4138 1.4138 1.4462 1.4462 1.5454 1.5454 9.3157 9.3157 11.1003 11.1003 11.8223 11.8223 12.6322 12.6322 12.6514 12.6514 13.3167 13.3167 k = 0.3906 0.2255-0.0000 ( 5644 PWs) bands (ev): -20.7468 -20.7468 -20.6769 -20.6769 -19.8259 -19.8259 -18.7192 -18.7192 -18.7070 -18.7070 -18.6262 -18.6262 -18.1317 -18.1317 -18.1053 -18.1053 -5.5466 -5.5466 -5.4396 -5.4396 -4.9377 -4.9377 -4.7441 -4.7441 -4.5247 -4.5247 -4.4558 -4.4558 -4.3090 -4.3090 -1.9791 -1.9791 -1.9436 -1.9436 -1.8139 -1.8139 -0.6477 -0.6477 -0.4230 -0.4230 -0.1846 -0.1846 0.1793 0.1793 0.3391 0.3391 0.5640 0.5640 0.5851 0.5851 0.6407 0.6407 0.7932 0.7932 0.9805 0.9805 1.2327 1.2327 1.4100 1.4100 1.4423 1.4423 1.5444 1.5444 9.3808 9.3808 11.0464 11.0464 11.8295 11.8295 12.6560 12.6560 12.6693 12.6693 13.3051 13.3051 k = 0.4062 0.2345-0.0000 ( 5648 PWs) bands (ev): -20.7422 -20.7422 -20.6792 -20.6792 -19.8289 -19.8289 -18.7194 -18.7194 -18.7070 -18.7070 -18.6254 -18.6254 -18.1326 -18.1326 -18.1052 -18.1052 -5.5387 -5.5387 -5.4458 -5.4458 -4.9313 -4.9313 -4.7451 -4.7451 -4.5184 -4.5184 -4.4559 -4.4559 -4.3071 -4.3071 -1.9776 -1.9776 -1.9425 -1.9425 -1.8051 -1.8051 -0.6506 -0.6506 -0.4324 -0.4324 -0.1856 -0.1856 0.1725 0.1725 0.3379 0.3379 0.5559 0.5559 0.5791 0.5791 0.6323 0.6323 0.7952 0.7952 0.9786 0.9786 1.2321 1.2321 1.4066 1.4066 1.4389 1.4389 1.5435 1.5435 9.4423 9.4423 10.9950 10.9950 11.8354 11.8354 12.6621 12.6621 12.7066 12.7066 13.2713 13.2713 k = 0.4219 0.2436-0.0000 ( 5644 PWs) bands (ev): -20.7380 -20.7380 -20.6815 -20.6815 -19.8315 -19.8315 -18.7195 -18.7195 -18.7069 -18.7069 -18.6248 -18.6248 -18.1333 -18.1333 -18.1051 -18.1051 -5.5308 -5.5308 -5.4522 -5.4522 -4.9256 -4.9256 -4.7465 -4.7465 -4.5122 -4.5122 -4.4560 -4.4560 -4.3058 -4.3058 -1.9762 -1.9762 -1.9416 -1.9416 -1.7974 -1.7974 -0.6533 -0.6533 -0.4405 -0.4405 -0.1864 -0.1864 0.1666 0.1666 0.3368 0.3368 0.5484 0.5484 0.5741 0.5741 0.6256 0.6256 0.7970 0.7970 0.9769 0.9769 1.2316 1.2316 1.4038 1.4038 1.4360 1.4360 1.5428 1.5428 9.4986 9.4986 10.9473 10.9473 11.8402 11.8402 12.6669 12.6669 12.7469 12.7469 13.2297 13.2297 k = 0.4375 0.2526-0.0000 ( 5648 PWs) bands (ev): -20.7341 -20.7341 -20.6837 -20.6837 -19.8337 -19.8337 -18.7196 -18.7196 -18.7069 -18.7069 -18.6242 -18.6242 -18.1339 -18.1339 -18.1050 -18.1050 -5.5230 -5.5230 -5.4587 -5.4587 -4.9207 -4.9207 -4.7482 -4.7482 -4.5065 -4.5065 -4.4561 -4.4561 -4.3049 -4.3049 -1.9751 -1.9751 -1.9409 -1.9409 -1.7909 -1.7909 -0.6559 -0.6559 -0.4471 -0.4471 -0.1871 -0.1871 0.1616 0.1616 0.3360 0.3360 0.5418 0.5418 0.5698 0.5698 0.6204 0.6204 0.7985 0.7985 0.9755 0.9755 1.2312 1.2312 1.4014 1.4014 1.4337 1.4337 1.5421 1.5421 9.5485 9.5485 10.9047 10.9047 11.8440 11.8440 12.6707 12.6707 12.7893 12.7893 13.1841 13.1841 k = 0.4531 0.2616-0.0000 ( 5652 PWs) bands (ev): -20.7308 -20.7308 -20.6858 -20.6858 -19.8355 -19.8355 -18.7197 -18.7197 -18.7069 -18.7069 -18.6238 -18.6238 -18.1343 -18.1343 -18.1049 -18.1049 -5.5156 -5.5156 -5.4652 -5.4652 -4.9168 -4.9168 -4.7498 -4.7498 -4.5018 -4.5018 -4.4562 -4.4562 -4.3043 -4.3043 -1.9742 -1.9742 -1.9403 -1.9403 -1.7857 -1.7857 -0.6580 -0.6580 -0.4523 -0.4523 -0.1876 -0.1876 0.1577 0.1577 0.3353 0.3353 0.5363 0.5363 0.5665 0.5665 0.6165 0.6165 0.7997 0.7997 0.9744 0.9744 1.2309 1.2309 1.3995 1.3995 1.4318 1.4318 1.5416 1.5416 9.5900 9.5900 10.8689 10.8689 11.8468 11.8468 12.6736 12.6736 12.8333 12.8333 13.1367 13.1367 k = 0.4688 0.2706-0.0000 ( 5660 PWs) bands (ev): -20.7282 -20.7282 -20.6874 -20.6874 -19.8367 -19.8367 -18.7197 -18.7197 -18.7069 -18.7069 -18.6235 -18.6235 -18.1347 -18.1347 -18.1049 -18.1049 -5.5086 -5.5086 -5.4714 -5.4714 -4.9138 -4.9138 -4.7511 -4.7511 -4.4981 -4.4981 -4.4562 -4.4562 -4.3039 -4.3039 -1.9736 -1.9736 -1.9398 -1.9398 -1.7819 -1.7819 -0.6597 -0.6597 -0.4559 -0.4559 -0.1880 -0.1880 0.1549 0.1549 0.3348 0.3348 0.5322 0.5322 0.5641 0.5641 0.6138 0.6138 0.8006 0.8006 0.9737 0.9737 1.2307 1.2307 1.3981 1.3981 1.4304 1.4304 1.5413 1.5413 9.6215 9.6215 10.8416 10.8416 11.8488 11.8488 12.6757 12.6757 12.8780 12.8780 13.0891 13.0891 k = 0.4844 0.2797-0.0000 ( 5660 PWs) bands (ev): -20.7265 -20.7265 -20.6886 -20.6886 -19.8375 -19.8375 -18.7198 -18.7198 -18.7069 -18.7069 -18.6233 -18.6233 -18.1349 -18.1349 -18.1049 -18.1049 -5.5029 -5.5029 -5.4767 -5.4767 -4.9120 -4.9120 -4.7520 -4.7520 -4.4959 -4.4959 -4.4562 -4.4562 -4.3038 -4.3038 -1.9732 -1.9732 -1.9395 -1.9395 -1.7796 -1.7796 -0.6607 -0.6607 -0.4581 -0.4581 -0.1883 -0.1883 0.1532 0.1532 0.3345 0.3345 0.5297 0.5297 0.5627 0.5627 0.6122 0.6122 0.8011 0.8011 0.9732 0.9732 1.2306 1.2306 1.3973 1.3973 1.4296 1.4296 1.5410 1.5410 9.6411 9.6411 10.8244 10.8244 11.8500 11.8500 12.6770 12.6770 12.9206 12.9206 13.0447 13.0447 k = 0.5000 0.2887-0.0000 ( 5654 PWs) bands (ev): -20.7259 -20.7259 -20.6890 -20.6890 -19.8377 -19.8377 -18.7198 -18.7198 -18.7069 -18.7069 -18.6232 -18.6232 -18.1349 -18.1349 -18.1049 -18.1049 -5.5004 -5.5004 -5.4791 -5.4791 -4.9114 -4.9114 -4.7523 -4.7523 -4.4951 -4.4951 -4.4563 -4.4563 -4.3037 -4.3037 -1.9731 -1.9731 -1.9394 -1.9394 -1.7788 -1.7788 -0.6610 -0.6610 -0.4589 -0.4589 -0.1883 -0.1883 0.1526 0.1526 0.3344 0.3344 0.5289 0.5289 0.5622 0.5622 0.6117 0.6117 0.8013 0.8013 0.9730 0.9730 1.2305 1.2305 1.3971 1.3971 1.4293 1.4293 1.5410 1.5410 9.6478 9.6478 10.8185 10.8185 11.8503 11.8503 12.6774 12.6774 12.9450 12.9450 13.0196 13.0196 k = 0.5000 0.2887-0.0000 ( 5654 PWs) bands (ev): -20.7259 -20.7259 -20.6890 -20.6890 -19.8377 -19.8377 -18.7198 -18.7198 -18.7069 -18.7069 -18.6232 -18.6232 -18.1349 -18.1349 -18.1049 -18.1049 -5.5004 -5.5004 -5.4791 -5.4791 -4.9114 -4.9114 -4.7523 -4.7523 -4.4951 -4.4951 -4.4563 -4.4563 -4.3037 -4.3037 -1.9731 -1.9731 -1.9394 -1.9394 -1.7788 -1.7788 -0.6610 -0.6610 -0.4589 -0.4589 -0.1883 -0.1883 0.1526 0.1526 0.3344 0.3344 0.5289 0.5289 0.5622 0.5622 0.6117 0.6117 0.8013 0.8013 0.9730 0.9730 1.2305 1.2305 1.3971 1.3971 1.4293 1.4293 1.5410 1.5410 9.6478 9.6478 10.8185 10.8185 11.8503 11.8503 12.6774 12.6774 12.9450 12.9450 13.0196 13.0196 k = 0.4907 0.3047-0.0000 ( 5660 PWs) bands (ev): -20.7259 -20.7259 -20.6890 -20.6890 -19.8378 -19.8378 -18.7197 -18.7197 -18.7069 -18.7069 -18.6232 -18.6232 -18.1349 -18.1349 -18.1049 -18.1049 -5.5013 -5.5013 -5.4781 -5.4781 -4.9119 -4.9119 -4.7512 -4.7512 -4.4958 -4.4958 -4.4556 -4.4556 -4.3040 -4.3040 -1.9729 -1.9729 -1.9393 -1.9393 -1.7789 -1.7789 -0.6607 -0.6607 -0.4588 -0.4588 -0.1895 -0.1895 0.1526 0.1526 0.3333 0.3333 0.5298 0.5298 0.5626 0.5626 0.6126 0.6126 0.8007 0.8007 0.9722 0.9722 1.2305 1.2305 1.3971 1.3971 1.4294 1.4294 1.5406 1.5406 9.6489 9.6489 10.8205 10.8205 11.8489 11.8489 12.6736 12.6736 12.9471 12.9471 13.0205 13.0205 k = 0.4815 0.3208-0.0000 ( 5658 PWs) bands (ev): -20.7256 -20.7256 -20.6890 -20.6890 -19.8381 -19.8381 -18.7197 -18.7197 -18.7069 -18.7069 -18.6232 -18.6232 -18.1347 -18.1347 -18.1051 -18.1051 -5.5035 -5.5035 -5.4757 -5.4757 -4.9133 -4.9133 -4.7478 -4.7478 -4.4978 -4.4978 -4.4539 -4.4539 -4.3046 -4.3046 -1.9722 -1.9722 -1.9388 -1.9388 -1.7794 -1.7794 -0.6599 -0.6599 -0.4587 -0.4587 -0.1928 -0.1928 0.1526 0.1526 0.3300 0.3300 0.5325 0.5325 0.5638 0.5638 0.6154 0.6154 0.7989 0.7989 0.9698 0.9698 1.2304 1.2304 1.3971 1.3971 1.4296 1.4296 1.5395 1.5395 9.6522 9.6522 10.8263 10.8263 11.8445 11.8445 12.6626 12.6626 12.9527 12.9527 13.0230 13.0230 k = 0.4722 0.3368-0.0000 ( 5652 PWs) bands (ev): -20.7252 -20.7252 -20.6891 -20.6891 -19.8386 -19.8386 -18.7196 -18.7196 -18.7069 -18.7069 -18.6232 -18.6232 -18.1344 -18.1344 -18.1055 -18.1055 -5.5064 -5.5064 -5.4723 -5.4723 -4.9155 -4.9155 -4.7425 -4.7425 -4.5009 -4.5009 -4.4513 -4.4513 -4.3057 -4.3057 -1.9711 -1.9711 -1.9379 -1.9379 -1.7802 -1.7802 -0.6584 -0.6584 -0.4586 -0.4586 -0.1982 -0.1982 0.1526 0.1526 0.3248 0.3248 0.5369 0.5369 0.5656 0.5656 0.6198 0.6198 0.7959 0.7959 0.9659 0.9659 1.2303 1.2303 1.3971 1.3971 1.4300 1.4300 1.5376 1.5376 9.6576 9.6576 10.8359 10.8359 11.8371 11.8371 12.6461 12.6461 12.9605 12.9605 13.0272 13.0272 k = 0.4630 0.3528-0.0000 ( 5652 PWs) bands (ev): -20.7246 -20.7246 -20.6891 -20.6891 -19.8393 -19.8393 -18.7194 -18.7194 -18.7069 -18.7069 -18.6232 -18.6232 -18.1340 -18.1340 -18.1060 -18.1060 -5.5095 -5.5095 -5.4686 -5.4686 -4.9182 -4.9182 -4.7353 -4.7353 -4.5046 -4.5046 -4.4482 -4.4482 -4.3072 -4.3072 -1.9696 -1.9696 -1.9367 -1.9367 -1.7813 -1.7813 -0.6565 -0.6565 -0.4582 -0.4582 -0.2056 -0.2056 0.1526 0.1526 0.3178 0.3178 0.5428 0.5428 0.5682 0.5682 0.6258 0.6258 0.7918 0.7918 0.9603 0.9603 1.2301 1.2301 1.3972 1.3972 1.4305 1.4305 1.5351 1.5351 9.6651 9.6651 10.8492 10.8492 11.8264 11.8264 12.6257 12.6257 12.9687 12.9687 13.0329 13.0329 k = 0.4537 0.3689-0.0000 ( 5656 PWs) bands (ev): -20.7238 -20.7238 -20.6893 -20.6893 -19.8402 -19.8402 -18.7193 -18.7193 -18.7070 -18.7070 -18.6232 -18.6232 -18.1335 -18.1335 -18.1066 -18.1066 -5.5126 -5.5126 -5.4648 -5.4648 -4.9213 -4.9213 -4.7266 -4.7266 -4.5088 -4.5088 -4.4450 -4.4450 -4.3090 -4.3090 -1.9678 -1.9678 -1.9352 -1.9352 -1.7826 -1.7826 -0.6542 -0.6542 -0.4577 -0.4577 -0.2148 -0.2148 0.1527 0.1527 0.3095 0.3095 0.5499 0.5499 0.5715 0.5715 0.6331 0.6331 0.7866 0.7866 0.9534 0.9534 1.2299 1.2299 1.3971 1.3971 1.4313 1.4313 1.5319 1.5319 9.6745 9.6745 10.8662 10.8662 11.8122 11.8122 12.6032 12.6032 12.9761 12.9761 13.0397 13.0397 k = 0.4444 0.3849-0.0000 ( 5660 PWs) bands (ev): -20.7229 -20.7229 -20.6895 -20.6895 -19.8412 -19.8412 -18.7191 -18.7191 -18.7071 -18.7071 -18.6232 -18.6232 -18.1330 -18.1330 -18.1073 -18.1073 -5.5156 -5.5156 -5.4610 -5.4610 -4.9246 -4.9246 -4.7167 -4.7167 -4.5134 -4.5134 -4.4416 -4.4416 -4.3110 -4.3110 -1.9657 -1.9657 -1.9334 -1.9334 -1.7841 -1.7841 -0.6514 -0.6514 -0.4570 -0.4570 -0.2255 -0.2255 0.1530 0.1530 0.3001 0.3001 0.5579 0.5579 0.5754 0.5754 0.6415 0.6415 0.7804 0.7804 0.9450 0.9450 1.2296 1.2296 1.3971 1.3971 1.4323 1.4323 1.5281 1.5281 9.6857 9.6857 10.8866 10.8866 11.7943 11.7943 12.5796 12.5796 12.9819 12.9819 13.0474 13.0474 k = 0.4352 0.4009-0.0000 ( 5664 PWs) bands (ev): -20.7218 -20.7218 -20.6897 -20.6897 -19.8423 -19.8423 -18.7188 -18.7188 -18.7071 -18.7071 -18.6231 -18.6231 -18.1323 -18.1323 -18.1081 -18.1081 -5.5183 -5.5183 -5.4574 -5.4574 -4.9279 -4.9279 -4.7059 -4.7059 -4.5181 -4.5181 -4.4384 -4.4384 -4.3134 -4.3134 -1.9634 -1.9634 -1.9313 -1.9313 -1.7858 -1.7858 -0.6485 -0.6485 -0.4558 -0.4558 -0.2377 -0.2377 0.1534 0.1534 0.2899 0.2899 0.5666 0.5666 0.5800 0.5800 0.6508 0.6508 0.7733 0.7733 0.9354 0.9354 1.2293 1.2293 1.3969 1.3969 1.4335 1.4335 1.5238 1.5238 9.6985 9.6985 10.9104 10.9104 11.7723 11.7723 12.5563 12.5563 12.9858 12.9858 13.0557 13.0557 k = 0.4259 0.4170-0.0000 ( 5656 PWs) bands (ev): -20.7206 -20.7206 -20.6901 -20.6901 -19.8435 -19.8435 -18.7186 -18.7186 -18.7072 -18.7072 -18.6231 -18.6231 -18.1315 -18.1315 -18.1091 -18.1091 -5.5207 -5.5207 -5.4541 -5.4541 -4.9310 -4.9310 -4.6942 -4.6942 -4.5231 -4.5231 -4.4354 -4.4354 -4.3158 -4.3158 -1.9609 -1.9609 -1.9290 -1.9290 -1.7876 -1.7876 -0.6454 -0.6454 -0.4542 -0.4542 -0.2509 -0.2509 0.1540 0.1540 0.2792 0.2792 0.5755 0.5755 0.5854 0.5854 0.6609 0.6609 0.7653 0.7653 0.9246 0.9246 1.2290 1.2290 1.3967 1.3967 1.4350 1.4350 1.5190 1.5190 9.7127 9.7127 10.9373 10.9373 11.7461 11.7461 12.5338 12.5338 12.9881 12.9881 13.0642 13.0642 k = 0.4167 0.4330-0.0000 ( 5666 PWs) bands (ev): -20.7192 -20.7192 -20.6905 -20.6905 -19.8448 -19.8448 -18.7183 -18.7183 -18.7073 -18.7073 -18.6231 -18.6231 -18.1307 -18.1307 -18.1101 -18.1101 -5.5228 -5.5228 -5.4510 -5.4510 -4.9339 -4.9339 -4.6821 -4.6821 -4.5281 -4.5281 -4.4327 -4.4327 -4.3183 -4.3183 -1.9584 -1.9584 -1.9265 -1.9265 -1.7894 -1.7894 -0.6422 -0.6422 -0.4521 -0.4521 -0.2649 -0.2649 0.1550 0.1550 0.2681 0.2681 0.5837 0.5837 0.5920 0.5920 0.6717 0.6717 0.7565 0.7565 0.9127 0.9127 1.2287 1.2287 1.3964 1.3964 1.4369 1.4369 1.5139 1.5139 9.7279 9.7279 10.9671 10.9671 11.7155 11.7155 12.5130 12.5130 12.9892 12.9892 13.0723 13.0723 k = 0.4074 0.4491-0.0000 ( 5662 PWs) bands (ev): -20.7177 -20.7177 -20.6910 -20.6910 -19.8461 -19.8461 -18.7181 -18.7181 -18.7074 -18.7074 -18.6230 -18.6230 -18.1297 -18.1297 -18.1112 -18.1112 -5.5245 -5.5245 -5.4482 -5.4482 -4.9365 -4.9365 -4.6698 -4.6698 -4.5333 -4.5333 -4.4304 -4.4304 -4.3209 -4.3209 -1.9559 -1.9559 -1.9239 -1.9239 -1.7911 -1.7911 -0.6392 -0.6392 -0.4492 -0.4492 -0.2796 -0.2796 0.1563 0.1563 0.2571 0.2571 0.5907 0.5907 0.6003 0.6003 0.6829 0.6829 0.7471 0.7471 0.9000 0.9000 1.2283 1.2283 1.3961 1.3961 1.4390 1.4390 1.5085 1.5085 9.7439 9.7439 10.9996 10.9996 11.6807 11.6807 12.4942 12.4942 12.9898 12.9898 13.0796 13.0796 k = 0.3981 0.4651-0.0000 ( 5662 PWs) bands (ev): -20.7160 -20.7160 -20.6917 -20.6917 -19.8474 -19.8474 -18.7178 -18.7178 -18.7075 -18.7075 -18.6229 -18.6229 -18.1288 -18.1288 -18.1124 -18.1124 -5.5259 -5.5259 -5.4459 -5.4459 -4.9388 -4.9388 -4.6573 -4.6573 -4.5386 -4.5386 -4.4284 -4.4284 -4.3232 -4.3232 -1.9535 -1.9535 -1.9214 -1.9214 -1.7928 -1.7928 -0.6364 -0.6364 -0.4456 -0.4456 -0.2945 -0.2945 0.1580 0.1580 0.2462 0.2462 0.5969 0.5969 0.6095 0.6095 0.6944 0.6944 0.7373 0.7373 0.8865 0.8865 1.2280 1.2280 1.3957 1.3957 1.4414 1.4414 1.5030 1.5030 9.7604 9.7604 11.0345 11.0345 11.6418 11.6418 12.4777 12.4777 12.9907 12.9907 13.0857 13.0857 k = 0.3889 0.4811-0.0000 ( 5664 PWs) bands (ev): -20.7143 -20.7143 -20.6925 -20.6925 -19.8486 -19.8486 -18.7175 -18.7175 -18.7077 -18.7077 -18.6229 -18.6229 -18.1277 -18.1277 -18.1136 -18.1136 -5.5269 -5.5269 -5.4439 -5.4439 -4.9407 -4.9407 -4.6451 -4.6451 -4.5440 -4.5440 -4.4268 -4.4268 -4.3255 -4.3255 -1.9512 -1.9512 -1.9190 -1.9190 -1.7942 -1.7942 -0.6339 -0.6339 -0.4411 -0.4411 -0.3095 -0.3095 0.1601 0.1601 0.2355 0.2355 0.6027 0.6027 0.6188 0.6188 0.7061 0.7061 0.7274 0.7274 0.8725 0.8725 1.2278 1.2278 1.3952 1.3952 1.4440 1.4440 1.4974 1.4974 9.7767 9.7767 11.0714 11.0714 11.5994 11.5994 12.4638 12.4638 12.9926 12.9926 13.0898 13.0898 k = 0.3796 0.4972-0.0000 ( 5672 PWs) bands (ev): -20.7124 -20.7124 -20.6936 -20.6936 -19.8498 -19.8498 -18.7173 -18.7173 -18.7078 -18.7078 -18.6228 -18.6228 -18.1267 -18.1267 -18.1149 -18.1149 -5.5276 -5.5276 -5.4423 -5.4423 -4.9422 -4.9422 -4.6333 -4.6333 -4.5494 -4.5494 -4.4257 -4.4257 -4.3274 -4.3274 -1.9492 -1.9492 -1.9168 -1.9168 -1.7954 -1.7954 -0.6317 -0.6317 -0.4357 -0.4357 -0.3244 -0.3244 0.1626 0.1626 0.2253 0.2253 0.6083 0.6083 0.6278 0.6278 0.7133 0.7133 0.7220 0.7220 0.8581 0.8581 1.2275 1.2275 1.3948 1.3948 1.4469 1.4469 1.4918 1.4918 9.7925 9.7925 11.1102 11.1102 11.5541 11.5541 12.4525 12.4525 12.9962 12.9962 13.0916 13.0916 k = 0.3704 0.5132-0.0000 ( 5674 PWs) bands (ev): -20.7105 -20.7105 -20.6948 -20.6948 -19.8508 -19.8508 -18.7171 -18.7171 -18.7079 -18.7079 -18.6227 -18.6227 -18.1256 -18.1256 -18.1161 -18.1161 -5.5281 -5.5281 -5.4411 -5.4411 -4.9434 -4.9434 -4.6222 -4.6222 -4.5548 -4.5548 -4.4248 -4.4248 -4.3291 -4.3291 -1.9474 -1.9474 -1.9150 -1.9150 -1.7963 -1.7963 -0.6300 -0.6300 -0.4295 -0.4295 -0.3388 -0.3388 0.1656 0.1656 0.2158 0.2158 0.6136 0.6136 0.6363 0.6363 0.7050 0.7050 0.7324 0.7324 0.8436 0.8436 1.2273 1.2273 1.3943 1.3943 1.4499 1.4499 1.4863 1.4863 9.8072 9.8072 11.1504 11.1504 11.5068 11.5068 12.4437 12.4437 13.0018 13.0018 13.0905 13.0905 k = 0.3611 0.5292-0.0000 ( 5678 PWs) bands (ev): -20.7084 -20.7084 -20.6962 -20.6962 -19.8517 -19.8517 -18.7169 -18.7169 -18.7080 -18.7080 -18.6226 -18.6226 -18.1244 -18.1244 -18.1174 -18.1174 -5.5283 -5.5283 -5.4402 -5.4402 -4.9442 -4.9442 -4.6122 -4.6122 -4.5602 -4.5602 -4.4243 -4.4243 -4.3305 -4.3305 -1.9458 -1.9458 -1.9135 -1.9135 -1.7969 -1.7969 -0.6288 -0.6288 -0.4224 -0.4224 -0.3524 -0.3524 0.1691 0.1691 0.2070 0.2070 0.6186 0.6186 0.6439 0.6439 0.6952 0.6952 0.7448 0.7448 0.8292 0.8292 1.2271 1.2271 1.3940 1.3940 1.4531 1.4531 1.4812 1.4812 9.8200 9.8200 11.1917 11.1917 11.4585 11.4585 12.4372 12.4372 13.0099 13.0099 13.0861 13.0861 k = 0.3519 0.5453-0.0000 ( 5670 PWs) bands (ev): -20.7063 -20.7063 -20.6978 -20.6978 -19.8523 -19.8523 -18.7168 -18.7168 -18.7081 -18.7081 -18.6226 -18.6226 -18.1233 -18.1233 -18.1186 -18.1186 -5.5284 -5.5284 -5.4397 -5.4397 -4.9448 -4.9448 -4.6036 -4.6036 -4.5652 -4.5652 -4.4239 -4.4239 -4.3315 -4.3315 -1.9447 -1.9447 -1.9125 -1.9125 -1.7972 -1.7972 -0.6279 -0.6279 -0.4149 -0.4149 -0.3647 -0.3647 0.1731 0.1731 0.1992 0.1992 0.6230 0.6230 0.6504 0.6504 0.6862 0.6862 0.7572 0.7572 0.8152 0.8152 1.2269 1.2269 1.3937 1.3937 1.4563 1.4563 1.4766 1.4766 9.8303 9.8303 11.2338 11.2338 11.4103 11.4103 12.4328 12.4328 13.0205 13.0205 13.0782 13.0782 k = 0.3426 0.5613-0.0000 ( 5668 PWs) bands (ev): -20.7041 -20.7041 -20.6997 -20.6997 -19.8527 -19.8527 -18.7167 -18.7167 -18.7081 -18.7081 -18.6225 -18.6225 -18.1221 -18.1221 -18.1199 -18.1199 -5.5283 -5.5283 -5.4394 -5.4394 -4.9451 -4.9451 -4.5974 -4.5974 -4.5692 -4.5692 -4.4237 -4.4237 -4.3321 -4.3321 -1.9440 -1.9440 -1.9119 -1.9119 -1.7972 -1.7972 -0.6274 -0.6274 -0.4078 -0.4078 -0.3747 -0.3747 0.1770 0.1770 0.1929 0.1929 0.6263 0.6263 0.6548 0.6548 0.6795 0.6795 0.7688 0.7688 0.8026 0.8026 1.2269 1.2269 1.3935 1.3935 1.4590 1.4590 1.4730 1.4730 9.8371 9.8371 11.2762 11.2762 11.3637 11.3637 12.4304 12.4304 13.0337 13.0337 13.0667 13.0667 k = 0.3333 0.5774-0.0000 ( 5664 PWs) bands (ev): -20.7019 -20.7019 -20.7018 -20.7018 -19.8529 -19.8529 -18.7166 -18.7166 -18.7081 -18.7081 -18.6225 -18.6225 -18.1210 -18.1210 -18.1210 -18.1210 -5.5283 -5.5283 -5.4394 -5.4394 -4.9451 -4.9451 -4.5951 -4.5951 -4.5708 -4.5708 -4.4237 -4.4237 -4.3323 -4.3323 -1.9437 -1.9437 -1.9117 -1.9117 -1.7973 -1.7973 -0.6273 -0.6273 -0.4044 -0.4044 -0.3792 -0.3792 0.1792 0.1792 0.1899 0.1899 0.6277 0.6277 0.6562 0.6562 0.6771 0.6771 0.7753 0.7753 0.7957 0.7957 1.2268 1.2268 1.3934 1.3934 1.4602 1.4602 1.4715 1.4715 9.8395 9.8395 11.3138 11.3138 11.3244 11.3244 12.4296 12.4296 13.0461 13.0461 13.0549 13.0549 k = 0.3333 0.5774-0.0000 ( 5664 PWs) bands (ev): -20.7019 -20.7019 -20.7018 -20.7018 -19.8529 -19.8529 -18.7166 -18.7166 -18.7081 -18.7081 -18.6225 -18.6225 -18.1210 -18.1210 -18.1210 -18.1210 -5.5283 -5.5283 -5.4394 -5.4394 -4.9451 -4.9451 -4.5951 -4.5951 -4.5708 -4.5708 -4.4237 -4.4237 -4.3323 -4.3323 -1.9437 -1.9437 -1.9117 -1.9117 -1.7973 -1.7973 -0.6273 -0.6273 -0.4044 -0.4044 -0.3792 -0.3792 0.1792 0.1792 0.1899 0.1899 0.6277 0.6277 0.6562 0.6562 0.6771 0.6771 0.7753 0.7753 0.7957 0.7957 1.2268 1.2268 1.3934 1.3934 1.4602 1.4602 1.4715 1.4715 9.8395 9.8395 11.3138 11.3138 11.3244 11.3244 12.4296 12.4296 13.0461 13.0461 13.0549 13.0549 k = 0.3241 0.5613-0.0000 ( 5668 PWs) bands (ev): -20.7043 -20.7043 -20.6995 -20.6995 -19.8527 -19.8527 -18.7167 -18.7167 -18.7081 -18.7081 -18.6225 -18.6225 -18.1221 -18.1221 -18.1199 -18.1199 -5.5284 -5.5284 -5.4394 -5.4394 -4.9451 -4.9451 -4.5972 -4.5972 -4.5695 -4.5695 -4.4237 -4.4237 -4.3321 -4.3321 -1.9440 -1.9440 -1.9119 -1.9119 -1.7973 -1.7973 -0.6274 -0.6274 -0.4077 -0.4077 -0.3749 -0.3749 0.1772 0.1772 0.1927 0.1927 0.6260 0.6260 0.6559 0.6559 0.6787 0.6787 0.7692 0.7692 0.8023 0.8023 1.2269 1.2269 1.3935 1.3935 1.4591 1.4591 1.4729 1.4729 9.8368 9.8368 11.2784 11.2784 11.3617 11.3617 12.4303 12.4303 13.0307 13.0307 13.0697 13.0697 k = 0.3148 0.5453-0.0000 ( 5682 PWs) bands (ev): -20.7069 -20.7069 -20.6972 -20.6972 -19.8523 -19.8523 -18.7168 -18.7168 -18.7081 -18.7081 -18.6226 -18.6226 -18.1231 -18.1231 -18.1188 -18.1188 -5.5286 -5.5286 -5.4395 -5.4395 -4.9450 -4.9450 -4.6021 -4.6021 -4.5668 -4.5668 -4.4240 -4.4240 -4.3314 -4.3314 -1.9448 -1.9448 -1.9124 -1.9124 -1.7975 -1.7975 -0.6277 -0.6277 -0.4138 -0.4138 -0.3657 -0.3657 0.1739 0.1739 0.1985 0.1985 0.6213 0.6213 0.6564 0.6564 0.6820 0.6820 0.7590 0.7590 0.8138 0.8138 1.2269 1.2269 1.3937 1.3937 1.4569 1.4569 1.4761 1.4761 9.8279 9.8279 11.2434 11.2434 11.4031 11.4031 12.4322 12.4322 13.0081 13.0081 13.0905 13.0905 k = 0.3056 0.5292-0.0000 ( 5674 PWs) bands (ev): -20.7099 -20.7099 -20.6949 -20.6949 -19.8514 -19.8514 -18.7169 -18.7169 -18.7080 -18.7080 -18.6227 -18.6227 -18.1240 -18.1240 -18.1177 -18.1177 -5.5293 -5.5293 -5.4394 -5.4394 -4.9449 -4.9449 -4.6085 -4.6085 -4.5642 -4.5642 -4.4245 -4.4245 -4.3304 -4.3304 -1.9461 -1.9461 -1.9130 -1.9130 -1.7982 -1.7982 -0.6281 -0.6281 -0.4198 -0.4198 -0.3546 -0.3546 0.1713 0.1713 0.2053 0.2053 0.6148 0.6148 0.6580 0.6580 0.6855 0.6855 0.7492 0.7492 0.8262 0.8262 1.2271 1.2271 1.3942 1.3942 1.4548 1.4548 1.4799 1.4799 9.8122 9.8122 11.2144 11.2144 11.4434 11.4434 12.4352 12.4352 12.9822 12.9822 13.1135 13.1135 k = 0.2963 0.5132-0.0000 ( 5678 PWs) bands (ev): -20.7132 -20.7132 -20.6925 -20.6925 -19.8502 -19.8502 -18.7170 -18.7170 -18.7079 -18.7079 -18.6229 -18.6229 -18.1249 -18.1249 -18.1167 -18.1167 -5.5303 -5.5303 -5.4392 -5.4392 -4.9448 -4.9448 -4.6156 -4.6156 -4.5622 -4.5622 -4.4254 -4.4254 -4.3290 -4.3290 -1.9479 -1.9479 -1.9139 -1.9139 -1.7993 -1.7993 -0.6286 -0.6286 -0.4245 -0.4245 -0.3427 -0.3427 0.1697 0.1697 0.2129 0.2129 0.6077 0.6077 0.6600 0.6600 0.6887 0.6887 0.7407 0.7407 0.8387 0.8387 1.2273 1.2273 1.3948 1.3948 1.4531 1.4531 1.4840 1.4840 9.7891 9.7891 11.1923 11.1923 11.4824 11.4824 12.4389 12.4389 12.9534 12.9534 13.1378 13.1378 k = 0.2870 0.4972-0.0000 ( 5666 PWs) bands (ev): -20.7167 -20.7167 -20.6901 -20.6901 -19.8487 -19.8487 -18.7172 -18.7172 -18.7078 -18.7078 -18.6231 -18.6231 -18.1256 -18.1256 -18.1157 -18.1157 -5.5319 -5.5319 -5.4386 -5.4386 -4.9450 -4.9450 -4.6232 -4.6232 -4.5609 -4.5609 -4.4266 -4.4266 -4.3274 -4.3274 -1.9501 -1.9501 -1.9149 -1.9149 -1.8011 -1.8011 -0.6291 -0.6291 -0.4276 -0.4276 -0.3304 -0.3304 0.1691 0.1691 0.2210 0.2210 0.6008 0.6008 0.6617 0.6617 0.6915 0.6915 0.7339 0.7339 0.8511 0.8511 1.2276 1.2276 1.3957 1.3957 1.4519 1.4519 1.4883 1.4883 9.7585 9.7585 11.1776 11.1776 11.5196 11.5196 12.4434 12.4434 12.9224 12.9224 13.1625 13.1625 k = 0.2778 0.4811-0.0000 ( 5670 PWs) bands (ev): -20.7205 -20.7205 -20.6878 -20.6878 -19.8468 -19.8468 -18.7174 -18.7174 -18.7077 -18.7077 -18.6234 -18.6234 -18.1261 -18.1261 -18.1147 -18.1147 -5.5340 -5.5340 -5.4377 -5.4377 -4.9454 -4.9454 -4.6312 -4.6312 -4.5603 -4.5603 -4.4282 -4.4282 -4.3256 -4.3256 -1.9526 -1.9526 -1.9161 -1.9161 -1.8036 -1.8036 -0.6295 -0.6295 -0.4291 -0.4291 -0.3179 -0.3179 0.1697 0.1697 0.2297 0.2297 0.5945 0.5945 0.6631 0.6631 0.6937 0.6937 0.7291 0.7291 0.8632 0.8632 1.2280 1.2280 1.3968 1.3968 1.4514 1.4514 1.4926 1.4926 9.7203 9.7203 11.1704 11.1704 11.5545 11.5545 12.4483 12.4483 12.8895 12.8895 13.1860 13.1860 k = 0.2685 0.4651-0.0000 ( 5680 PWs) bands (ev): -20.7245 -20.7245 -20.6854 -20.6854 -19.8445 -19.8445 -18.7176 -18.7176 -18.7075 -18.7075 -18.6238 -18.6238 -18.1266 -18.1266 -18.1139 -18.1139 -5.5369 -5.5369 -5.4364 -5.4364 -4.9462 -4.9462 -4.6394 -4.6394 -4.5602 -4.5602 -4.4301 -4.4301 -4.3238 -4.3238 -1.9555 -1.9555 -1.9175 -1.9175 -1.8070 -1.8070 -0.6299 -0.6299 -0.4288 -0.4288 -0.3054 -0.3054 0.1714 0.1714 0.2387 0.2387 0.5890 0.5890 0.6641 0.6641 0.6955 0.6955 0.7263 0.7263 0.8751 0.8751 1.2284 1.2284 1.3982 1.3982 1.4515 1.4515 1.4970 1.4970 9.6751 9.6751 11.1706 11.1706 11.5870 11.5870 12.4536 12.4536 12.8553 12.8553 13.2063 13.2063 k = 0.2593 0.4491-0.0000 ( 5688 PWs) bands (ev): -20.7288 -20.7288 -20.6831 -20.6831 -19.8418 -19.8418 -18.7178 -18.7178 -18.7074 -18.7074 -18.6243 -18.6243 -18.1269 -18.1269 -18.1130 -18.1130 -5.5404 -5.5404 -5.4346 -5.4346 -4.9475 -4.9475 -4.6480 -4.6480 -4.5605 -4.5605 -4.4324 -4.4324 -4.3222 -4.3222 -1.9585 -1.9585 -1.9191 -1.9191 -1.8114 -1.8114 -0.6301 -0.6301 -0.4266 -0.4266 -0.2929 -0.2929 0.1741 0.1741 0.2480 0.2480 0.5844 0.5844 0.6649 0.6649 0.6970 0.6970 0.7252 0.7252 0.8867 0.8867 1.2290 1.2290 1.3999 1.3999 1.4521 1.4521 1.5014 1.5014 9.6235 9.6235 11.1777 11.1777 11.6167 11.6167 12.4590 12.4590 12.8204 12.8204 13.2212 13.2212 k = 0.2500 0.4330-0.0000 ( 5684 PWs) bands (ev): -20.7333 -20.7333 -20.6809 -20.6809 -19.8388 -19.8388 -18.7179 -18.7179 -18.7073 -18.7073 -18.6249 -18.6249 -18.1271 -18.1271 -18.1122 -18.1122 -5.5445 -5.5445 -5.4324 -5.4324 -4.9493 -4.9493 -4.6568 -4.6568 -4.5611 -4.5611 -4.4348 -4.4348 -4.3210 -4.3210 -1.9617 -1.9617 -1.9209 -1.9209 -1.8166 -1.8166 -0.6303 -0.6303 -0.4227 -0.4227 -0.2808 -0.2808 0.1779 0.1779 0.2575 0.2575 0.5810 0.5810 0.6660 0.6660 0.6983 0.6983 0.7256 0.7256 0.8979 0.8979 1.2296 1.2296 1.4020 1.4020 1.4534 1.4534 1.5058 1.5058 9.5662 9.5662 11.1911 11.1911 11.6432 11.6432 12.4646 12.4646 12.7852 12.7852 13.2301 13.2301 k = 0.2407 0.4170-0.0000 ( 5672 PWs) bands (ev): -20.7380 -20.7380 -20.6786 -20.6786 -19.8354 -19.8354 -18.7180 -18.7180 -18.7072 -18.7072 -18.6255 -18.6255 -18.1271 -18.1271 -18.1115 -18.1115 -5.5492 -5.5492 -5.4298 -5.4298 -4.9517 -4.9517 -4.6660 -4.6660 -4.5617 -4.5617 -4.4372 -4.4372 -4.3202 -4.3202 -1.9650 -1.9650 -1.9229 -1.9229 -1.8228 -1.8228 -0.6304 -0.6304 -0.4170 -0.4170 -0.2690 -0.2690 0.1827 0.1827 0.2670 0.2670 0.5787 0.5787 0.6677 0.6677 0.6995 0.6995 0.7271 0.7271 0.9087 0.9087 1.2302 1.2302 1.4045 1.4045 1.4553 1.4553 1.5101 1.5101 9.5041 9.5041 11.2100 11.2100 11.6664 11.6664 12.4701 12.4701 12.7504 12.7504 13.2340 13.2340 k = 0.2315 0.4009-0.0000 ( 5680 PWs) bands (ev): -20.7429 -20.7429 -20.6765 -20.6765 -19.8318 -19.8318 -18.7182 -18.7182 -18.7072 -18.7072 -18.6262 -18.6262 -18.1269 -18.1269 -18.1109 -18.1109 -5.5544 -5.5544 -5.4268 -5.4268 -4.9547 -4.9547 -4.6755 -4.6755 -4.5623 -4.5623 -4.4396 -4.4396 -4.3200 -4.3200 -1.9683 -1.9683 -1.9250 -1.9250 -1.8300 -1.8300 -0.6304 -0.6304 -0.4098 -0.4098 -0.2576 -0.2576 0.1884 0.1884 0.2766 0.2766 0.5776 0.5776 0.6704 0.6704 0.7008 0.7008 0.7294 0.7294 0.9191 0.9191 1.2310 1.2310 1.4074 1.4074 1.4576 1.4576 1.5144 1.5144 9.4382 9.4382 11.2339 11.2339 11.6860 11.6860 12.4755 12.4755 12.7163 12.7163 13.2345 13.2345 k = 0.2222 0.3849-0.0000 ( 5678 PWs) bands (ev): -20.7480 -20.7480 -20.6744 -20.6744 -19.8278 -19.8278 -18.7182 -18.7182 -18.7071 -18.7071 -18.6270 -18.6270 -18.1267 -18.1267 -18.1103 -18.1103 -5.5601 -5.5601 -5.4235 -5.4235 -4.9584 -4.9584 -4.6854 -4.6854 -4.5627 -4.5627 -4.4420 -4.4420 -4.3205 -4.3205 -1.9716 -1.9716 -1.9273 -1.9273 -1.8379 -1.8379 -0.6303 -0.6303 -0.4009 -0.4009 -0.2468 -0.2468 0.1949 0.1949 0.2859 0.2859 0.5777 0.5777 0.6744 0.6744 0.7020 0.7020 0.7323 0.7323 0.9292 0.9292 1.2318 1.2318 1.4107 1.4107 1.4604 1.4604 1.5186 1.5186 9.3692 9.3692 11.2619 11.2619 11.7018 11.7018 12.4807 12.4807 12.6836 12.6836 13.2325 13.2325 k = 0.2130 0.3689-0.0000 ( 5674 PWs) bands (ev): -20.7532 -20.7532 -20.6723 -20.6723 -19.8236 -19.8236 -18.7183 -18.7183 -18.7071 -18.7071 -18.6279 -18.6279 -18.1263 -18.1263 -18.1098 -18.1098 -5.5662 -5.5662 -5.4199 -5.4199 -4.9628 -4.9628 -4.6957 -4.6957 -4.5627 -4.5627 -4.4441 -4.4441 -4.3217 -4.3217 -1.9749 -1.9749 -1.9298 -1.9298 -1.8466 -1.8466 -0.6301 -0.6301 -0.3907 -0.3907 -0.2367 -0.2367 0.2021 0.2021 0.2949 0.2949 0.5789 0.5789 0.6797 0.6797 0.7032 0.7032 0.7358 0.7358 0.9388 0.9388 1.2328 1.2328 1.4144 1.4144 1.4637 1.4637 1.5228 1.5228 9.2979 9.2979 11.2935 11.2935 11.7137 11.7137 12.4855 12.4855 12.6526 12.6526 13.2286 13.2286 k = 0.2037 0.3528-0.0000 ( 5666 PWs) bands (ev): -20.7584 -20.7584 -20.6703 -20.6703 -19.8191 -19.8191 -18.7182 -18.7182 -18.7071 -18.7071 -18.6289 -18.6289 -18.1258 -18.1258 -18.1093 -18.1093 -5.5726 -5.5726 -5.4160 -5.4160 -4.9679 -4.9679 -4.7064 -4.7064 -4.5623 -4.5623 -4.4460 -4.4460 -4.3237 -4.3237 -1.9782 -1.9782 -1.9324 -1.9324 -1.8559 -1.8559 -0.6300 -0.6300 -0.3793 -0.3793 -0.2272 -0.2272 0.2100 0.2100 0.3036 0.3036 0.5814 0.5814 0.6862 0.6862 0.7046 0.7046 0.7400 0.7400 0.9480 0.9480 1.2338 1.2338 1.4186 1.4186 1.4674 1.4674 1.5268 1.5268 9.2252 9.2252 11.3281 11.3281 11.7216 11.7216 12.4899 12.4899 12.6236 12.6236 13.2233 13.2233 k = 0.1944 0.3368-0.0000 ( 5662 PWs) bands (ev): -20.7637 -20.7637 -20.6684 -20.6684 -19.8144 -19.8144 -18.7182 -18.7182 -18.7071 -18.7071 -18.6299 -18.6299 -18.1251 -18.1251 -18.1089 -18.1089 -5.5793 -5.5793 -5.4120 -5.4120 -4.9737 -4.9737 -4.7175 -4.7175 -4.5614 -4.5614 -4.4476 -4.4476 -4.3265 -4.3265 -1.9815 -1.9815 -1.9351 -1.9351 -1.8658 -1.8658 -0.6298 -0.6298 -0.3668 -0.3668 -0.2184 -0.2184 0.2185 0.2185 0.3117 0.3117 0.5849 0.5849 0.6933 0.6933 0.7065 0.7065 0.7453 0.7453 0.9569 0.9569 1.2349 1.2349 1.4231 1.4231 1.4714 1.4714 1.5307 1.5307 9.1516 9.1516 11.3652 11.3652 11.7256 11.7256 12.4939 12.4939 12.5970 12.5970 13.2165 13.2165 k = 0.1852 0.3208-0.0000 ( 5657 PWs) bands (ev): -20.7691 -20.7691 -20.6666 -20.6666 -19.8096 -19.8096 -18.7181 -18.7181 -18.7071 -18.7071 -18.6309 -18.6309 -18.1244 -18.1244 -18.1086 -18.1086 -5.5861 -5.5861 -5.4078 -5.4078 -4.9801 -4.9801 -4.7290 -4.7290 -4.5599 -4.5599 -4.4490 -4.4490 -4.3301 -4.3301 -1.9848 -1.9848 -1.9379 -1.9379 -1.8759 -1.8759 -0.6296 -0.6296 -0.3535 -0.3535 -0.2104 -0.2104 0.2274 0.2274 0.3193 0.3193 0.5894 0.5894 0.6991 0.6991 0.7102 0.7102 0.7521 0.7521 0.9653 0.9653 1.2360 1.2360 1.4281 1.4281 1.4758 1.4758 1.5344 1.5344 9.0777 9.0777 11.4043 11.4043 11.7258 11.7258 12.4973 12.4973 12.5730 12.5730 13.2083 13.2083 k = 0.1759 0.3047-0.0000 ( 5651 PWs) bands (ev): -20.7745 -20.7745 -20.6649 -20.6649 -19.8046 -19.8046 -18.7181 -18.7181 -18.7071 -18.7071 -18.6320 -18.6320 -18.1235 -18.1235 -18.1083 -18.1083 -5.5930 -5.5930 -5.4034 -5.4034 -4.9871 -4.9871 -4.7408 -4.7408 -4.5578 -4.5578 -4.4501 -4.4501 -4.3344 -4.3344 -1.9880 -1.9880 -1.9408 -1.9408 -1.8862 -1.8862 -0.6295 -0.6295 -0.3395 -0.3395 -0.2031 -0.2031 0.2368 0.2368 0.3262 0.3262 0.5949 0.5949 0.7022 0.7022 0.7163 0.7163 0.7610 0.7610 0.9733 0.9733 1.2372 1.2372 1.4333 1.4333 1.4805 1.4805 1.5381 1.5381 9.0041 9.0041 11.4451 11.4451 11.7224 11.7224 12.5000 12.5000 12.5517 12.5517 13.1985 13.1985 k = 0.1667 0.2887-0.0000 ( 5649 PWs) bands (ev): -20.7798 -20.7798 -20.6632 -20.6632 -19.7996 -19.7996 -18.7179 -18.7179 -18.7072 -18.7072 -18.6331 -18.6331 -18.1226 -18.1226 -18.1081 -18.1081 -5.6000 -5.6000 -5.3989 -5.3989 -4.9946 -4.9946 -4.7527 -4.7527 -4.5553 -4.5553 -4.4509 -4.4509 -4.3394 -4.3394 -1.9914 -1.9914 -1.9438 -1.9438 -1.8965 -1.8965 -0.6295 -0.6295 -0.3251 -0.3251 -0.1965 -0.1965 0.2464 0.2464 0.3324 0.3324 0.6012 0.6012 0.7035 0.7035 0.7231 0.7231 0.7726 0.7726 0.9810 0.9810 1.2385 1.2385 1.4389 1.4389 1.4855 1.4855 1.5416 1.5416 8.9313 8.9313 11.4872 11.4872 11.7158 11.7158 12.5019 12.5019 12.5333 12.5333 13.1867 13.1867 k = 0.1574 0.2726-0.0000 ( 5653 PWs) bands (ev): -20.7850 -20.7850 -20.6617 -20.6617 -19.7945 -19.7945 -18.7178 -18.7178 -18.7073 -18.7073 -18.6343 -18.6343 -18.1216 -18.1216 -18.1079 -18.1079 -5.6070 -5.6070 -5.3943 -5.3943 -5.0025 -5.0025 -4.7648 -4.7648 -4.5522 -4.5522 -4.4516 -4.4516 -4.3450 -4.3450 -1.9949 -1.9949 -1.9469 -1.9469 -1.9064 -1.9064 -0.6295 -0.6295 -0.3104 -0.3104 -0.1905 -0.1905 0.2563 0.2563 0.3381 0.3381 0.6082 0.6082 0.7042 0.7042 0.7294 0.7294 0.7869 0.7869 0.9883 0.9883 1.2398 1.2398 1.4447 1.4447 1.4907 1.4907 1.5449 1.5449 8.8597 8.8597 11.5303 11.5303 11.7062 11.7062 12.5022 12.5022 12.5183 12.5183 13.1727 13.1727 k = 0.1481 0.2566-0.0000 ( 5657 PWs) bands (ev): -20.7901 -20.7901 -20.6602 -20.6602 -19.7894 -19.7894 -18.7177 -18.7177 -18.7073 -18.7073 -18.6354 -18.6354 -18.1206 -18.1206 -18.1078 -18.1078 -5.6139 -5.6139 -5.3895 -5.3895 -5.0109 -5.0109 -4.7769 -4.7769 -4.5486 -4.5486 -4.4520 -4.4520 -4.3512 -4.3512 -1.9986 -1.9986 -1.9502 -1.9502 -1.9157 -1.9157 -0.6296 -0.6296 -0.2957 -0.2957 -0.1851 -0.1851 0.2662 0.2662 0.3431 0.3431 0.6157 0.6157 0.7045 0.7045 0.7347 0.7347 0.8036 0.8036 0.9952 0.9952 1.2412 1.2412 1.4506 1.4506 1.4961 1.4961 1.5481 1.5481 8.7898 8.7898 11.5740 11.5740 11.6943 11.6943 12.4981 12.4981 12.5096 12.5096 13.1559 13.1559 k = 0.1389 0.2406-0.0000 ( 5653 PWs) bands (ev): -20.7951 -20.7951 -20.6589 -20.6589 -19.7844 -19.7844 -18.7175 -18.7175 -18.7074 -18.7074 -18.6366 -18.6366 -18.1195 -18.1195 -18.1077 -18.1077 -5.6207 -5.6207 -5.3847 -5.3847 -5.0195 -5.0195 -4.7889 -4.7889 -4.5447 -4.5447 -4.4523 -4.4523 -4.3578 -4.3578 -2.0026 -2.0026 -1.9538 -1.9538 -1.9240 -1.9240 -0.6299 -0.6299 -0.2812 -0.2812 -0.1804 -0.1804 0.2762 0.2762 0.3476 0.3476 0.6236 0.6236 0.7046 0.7046 0.7395 0.7395 0.8220 0.8220 1.0018 1.0018 1.2425 1.2425 1.4565 1.4565 1.5017 1.5017 1.5512 1.5512 8.7219 8.7219 11.6180 11.6180 11.6807 11.6807 12.4890 12.4890 12.5074 12.5074 13.1357 13.1357 k = 0.1296 0.2245-0.0000 ( 5653 PWs) bands (ev): -20.8000 -20.8000 -20.6576 -20.6576 -19.7795 -19.7795 -18.7174 -18.7174 -18.7075 -18.7075 -18.6377 -18.6377 -18.1184 -18.1184 -18.1077 -18.1077 -5.6274 -5.6274 -5.3797 -5.3797 -5.0284 -5.0284 -4.8007 -4.8007 -4.5404 -4.5404 -4.4524 -4.4524 -4.3647 -4.3647 -2.0070 -2.0070 -1.9577 -1.9577 -1.9310 -1.9310 -0.6302 -0.6302 -0.2670 -0.2670 -0.1760 -0.1760 0.2862 0.2862 0.3515 0.3515 0.6317 0.6317 0.7045 0.7045 0.7439 0.7439 0.8415 0.8415 1.0082 1.0082 1.2439 1.2439 1.4625 1.4625 1.5075 1.5075 1.5541 1.5541 8.6564 8.6564 11.6567 11.6567 11.6711 11.6711 12.4802 12.4802 12.5062 12.5062 13.1118 13.1118 k = 0.1204 0.2085-0.0000 ( 5651 PWs) bands (ev): -20.8046 -20.8046 -20.6564 -20.6564 -19.7747 -19.7747 -18.7173 -18.7173 -18.7076 -18.7076 -18.6388 -18.6388 -18.1173 -18.1173 -18.1077 -18.1077 -5.6338 -5.6338 -5.3747 -5.3747 -5.0374 -5.0374 -4.8121 -4.8121 -4.5359 -4.5359 -4.4525 -4.4525 -4.3720 -4.3720 -2.0119 -2.0119 -1.9619 -1.9619 -1.9367 -1.9367 -0.6307 -0.6307 -0.2533 -0.2533 -0.1722 -0.1722 0.2960 0.2960 0.3549 0.3549 0.6398 0.6398 0.7042 0.7042 0.7480 0.7480 0.8616 0.8616 1.0142 1.0142 1.2453 1.2453 1.4683 1.4683 1.5134 1.5134 1.5569 1.5569 8.5938 8.5938 11.6471 11.6471 11.7089 11.7089 12.4729 12.4729 12.5048 12.5048 13.0838 13.0838 k = 0.1111 0.1925-0.0000 ( 5647 PWs) bands (ev): -20.8090 -20.8090 -20.6553 -20.6553 -19.7700 -19.7700 -18.7171 -18.7171 -18.7076 -18.7076 -18.6398 -18.6398 -18.1162 -18.1162 -18.1077 -18.1077 -5.6400 -5.6400 -5.3696 -5.3696 -5.0465 -5.0465 -4.8231 -4.8231 -4.5312 -4.5312 -4.4524 -4.4524 -4.3794 -4.3794 -2.0174 -2.0174 -1.9662 -1.9662 -1.9411 -1.9411 -0.6312 -0.6312 -0.2404 -0.2404 -0.1686 -0.1686 0.3056 0.3056 0.3580 0.3580 0.6478 0.6478 0.7038 0.7038 0.7520 0.7520 0.8819 0.8819 1.0200 1.0200 1.2466 1.2466 1.4739 1.4739 1.5193 1.5193 1.5595 1.5595 8.5342 8.5342 11.6305 11.6305 11.7527 11.7527 12.4672 12.4672 12.5027 12.5027 13.0512 13.0512 k = 0.1019 0.1764-0.0000 ( 5651 PWs) bands (ev): -20.8132 -20.8132 -20.6543 -20.6543 -19.7656 -19.7656 -18.7170 -18.7170 -18.7077 -18.7077 -18.6408 -18.6408 -18.1152 -18.1152 -18.1078 -18.1078 -5.6458 -5.6458 -5.3645 -5.3645 -5.0555 -5.0555 -4.8336 -4.8336 -4.5263 -4.5263 -4.4524 -4.4524 -4.3869 -4.3869 -2.0233 -2.0233 -1.9701 -1.9701 -1.9444 -1.9444 -0.6318 -0.6318 -0.2282 -0.2282 -0.1654 -0.1654 0.3149 0.3149 0.3606 0.3606 0.6555 0.6555 0.7033 0.7033 0.7560 0.7560 0.9018 0.9018 1.0256 1.0256 1.2479 1.2479 1.4792 1.4792 1.5252 1.5252 1.5620 1.5620 8.4781 8.4781 11.6136 11.6136 11.7962 11.7962 12.4629 12.4629 12.5001 12.5001 13.0144 13.0144 k = 0.0926 0.1604-0.0000 ( 5649 PWs) bands (ev): -20.8171 -20.8171 -20.6534 -20.6534 -19.7614 -19.7614 -18.7169 -18.7169 -18.7077 -18.7077 -18.6418 -18.6418 -18.1141 -18.1141 -18.1078 -18.1078 -5.6514 -5.6514 -5.3594 -5.3594 -5.0644 -5.0644 -4.8434 -4.8434 -4.5213 -4.5213 -4.4523 -4.4523 -4.3943 -4.3943 -2.0295 -2.0295 -1.9736 -1.9736 -1.9469 -1.9469 -0.6325 -0.6325 -0.2171 -0.2171 -0.1623 -0.1623 0.3238 0.3238 0.3630 0.3630 0.6627 0.6627 0.7027 0.7027 0.7600 0.7600 0.9209 0.9209 1.0311 1.0311 1.2491 1.2491 1.4842 1.4842 1.5309 1.5309 1.5644 1.5644 8.4257 8.4257 11.5969 11.5969 11.8389 11.8389 12.4599 12.4599 12.4971 12.4971 12.9771 12.9771 k = 0.0833 0.1443-0.0000 ( 5651 PWs) bands (ev): -20.8207 -20.8207 -20.6526 -20.6526 -19.7576 -19.7576 -18.7169 -18.7169 -18.7077 -18.7077 -18.6427 -18.6427 -18.1132 -18.1132 -18.1079 -18.1079 -5.6565 -5.6565 -5.3543 -5.3543 -5.0731 -5.0731 -4.8525 -4.8525 -4.5163 -4.5163 -4.4523 -4.4523 -4.4017 -4.4017 -2.0359 -2.0359 -1.9766 -1.9766 -1.9489 -1.9489 -0.6332 -0.6332 -0.2072 -0.2072 -0.1593 -0.1593 0.3321 0.3321 0.3650 0.3650 0.6694 0.6694 0.7020 0.7020 0.7639 0.7639 0.9389 0.9389 1.0366 1.0366 1.2503 1.2503 1.4889 1.4889 1.5363 1.5363 1.5668 1.5668 8.3774 8.3774 11.5809 11.5809 11.8804 11.8804 12.4580 12.4580 12.4937 12.4937 12.9416 12.9416 k = 0.0741 0.1283-0.0000 ( 5651 PWs) bands (ev): -20.8239 -20.8239 -20.6519 -20.6519 -19.7540 -19.7540 -18.7168 -18.7168 -18.7078 -18.7078 -18.6435 -18.6435 -18.1122 -18.1122 -18.1080 -18.1080 -5.6612 -5.6612 -5.3494 -5.3494 -5.0814 -5.0814 -4.8609 -4.8609 -4.5113 -4.5113 -4.4523 -4.4523 -4.4088 -4.4088 -2.0421 -2.0421 -1.9790 -1.9790 -1.9505 -1.9505 -0.6339 -0.6339 -0.1985 -0.1985 -0.1563 -0.1563 0.3398 0.3398 0.3668 0.3668 0.6753 0.6753 0.7014 0.7014 0.7678 0.7678 0.9552 0.9552 1.0421 1.0421 1.2513 1.2513 1.4931 1.4931 1.5414 1.5414 1.5690 1.5690 8.3334 8.3334 11.5658 11.5658 11.9202 11.9202 12.4570 12.4570 12.4900 12.4900 12.9084 12.9084 k = 0.0648 0.1123-0.0000 ( 5665 PWs) bands (ev): -20.8269 -20.8269 -20.6512 -20.6512 -19.7508 -19.7508 -18.7168 -18.7168 -18.7078 -18.7078 -18.6442 -18.6442 -18.1114 -18.1114 -18.1081 -18.1081 -5.6654 -5.6654 -5.3446 -5.3446 -5.0893 -5.0893 -4.8684 -4.8684 -4.5062 -4.5062 -4.4525 -4.4525 -4.4156 -4.4156 -2.0481 -2.0481 -1.9810 -1.9810 -1.9517 -1.9517 -0.6346 -0.6346 -0.1912 -0.1912 -0.1533 -0.1533 0.3469 0.3469 0.3684 0.3684 0.6806 0.6806 0.7007 0.7007 0.7716 0.7716 0.9696 0.9696 1.0477 1.0477 1.2523 1.2523 1.4968 1.4968 1.5459 1.5459 1.5712 1.5712 8.2939 8.2939 11.5518 11.5518 11.9579 11.9579 12.4568 12.4568 12.4863 12.4863 12.8778 12.8778 k = 0.0556 0.0962-0.0000 ( 5667 PWs) bands (ev): -20.8294 -20.8294 -20.6507 -20.6507 -19.7479 -19.7479 -18.7167 -18.7167 -18.7078 -18.7078 -18.6448 -18.6448 -18.1107 -18.1107 -18.1082 -18.1082 -5.6692 -5.6692 -5.3401 -5.3401 -5.0965 -5.0965 -4.8750 -4.8750 -4.5012 -4.5012 -4.4529 -4.4529 -4.4219 -4.4219 -2.0535 -2.0535 -1.9826 -1.9826 -1.9527 -1.9527 -0.6353 -0.6353 -0.1853 -0.1853 -0.1502 -0.1502 0.3531 0.3531 0.3698 0.3698 0.6850 0.6850 0.7001 0.7001 0.7752 0.7752 0.9818 0.9818 1.0534 1.0534 1.2532 1.2532 1.5001 1.5001 1.5499 1.5499 1.5734 1.5734 8.2592 8.2592 11.5394 11.5394 11.9929 11.9929 12.4572 12.4572 12.4828 12.4828 12.8502 12.8502 k = 0.0463 0.0802-0.0000 ( 5671 PWs) bands (ev): -20.8316 -20.8316 -20.6502 -20.6502 -19.7455 -19.7455 -18.7167 -18.7167 -18.7078 -18.7078 -18.6453 -18.6453 -18.1100 -18.1100 -18.1083 -18.1083 -5.6724 -5.6724 -5.3360 -5.3360 -5.1030 -5.1030 -4.8807 -4.8807 -4.4962 -4.4962 -4.4537 -4.4537 -4.4276 -4.4276 -2.0583 -2.0583 -1.9839 -1.9839 -1.9534 -1.9534 -0.6359 -0.6359 -0.1807 -0.1807 -0.1472 -0.1472 0.3584 0.3584 0.3710 0.3710 0.6886 0.6886 0.6996 0.6996 0.7784 0.7784 0.9917 0.9917 1.0590 1.0590 1.2540 1.2540 1.5029 1.5029 1.5531 1.5531 1.5755 1.5755 8.2295 8.2295 11.5285 11.5285 12.0245 12.0245 12.4578 12.4578 12.4797 12.4797 12.8258 12.8258 k = 0.0370 0.0642-0.0000 ( 5671 PWs) bands (ev): -20.8335 -20.8335 -20.6499 -20.6499 -19.7434 -19.7434 -18.7167 -18.7167 -18.7078 -18.7078 -18.6458 -18.6458 -18.1095 -18.1095 -18.1084 -18.1084 -5.6751 -5.6751 -5.3324 -5.3324 -5.1086 -5.1086 -4.8854 -4.8854 -4.4913 -4.4913 -4.4551 -4.4551 -4.4324 -4.4324 -2.0624 -2.0624 -1.9848 -1.9848 -1.9540 -1.9540 -0.6365 -0.6365 -0.1772 -0.1772 -0.1443 -0.1443 0.3626 0.3626 0.3722 0.3722 0.6915 0.6915 0.6992 0.6992 0.7813 0.7813 0.9993 0.9993 1.0644 1.0644 1.2547 1.2547 1.5053 1.5053 1.5557 1.5557 1.5774 1.5774 8.2049 8.2049 11.5194 11.5194 12.0520 12.0520 12.4585 12.4585 12.4773 12.4773 12.8047 12.8047 k = 0.0278 0.0481-0.0000 ( 5667 PWs) bands (ev): -20.8349 -20.8349 -20.6496 -20.6496 -19.7418 -19.7418 -18.7167 -18.7167 -18.7078 -18.7078 -18.6461 -18.6461 -18.1091 -18.1091 -18.1084 -18.1084 -5.6772 -5.6772 -5.3295 -5.3295 -5.1132 -5.1132 -4.8891 -4.8891 -4.4866 -4.4866 -4.4573 -4.4573 -4.4360 -4.4360 -2.0656 -2.0656 -1.9855 -1.9855 -1.9544 -1.9544 -0.6369 -0.6369 -0.1748 -0.1748 -0.1419 -0.1419 0.3658 0.3658 0.3734 0.3734 0.6935 0.6935 0.6991 0.6991 0.7837 0.7837 1.0049 1.0049 1.0691 1.0691 1.2552 1.2552 1.5071 1.5071 1.5577 1.5577 1.5790 1.5790 8.1856 8.1856 11.5122 11.5122 12.0747 12.0747 12.4589 12.4589 12.4757 12.4757 12.7876 12.7876 k = 0.0185 0.0321-0.0000 ( 5667 PWs) bands (ev): -20.8359 -20.8359 -20.6494 -20.6494 -19.7407 -19.7407 -18.7167 -18.7167 -18.7078 -18.7078 -18.6464 -18.6464 -18.1087 -18.1087 -18.1085 -18.1085 -5.6787 -5.6787 -5.3272 -5.3272 -5.1165 -5.1165 -4.8917 -4.8917 -4.4821 -4.4821 -4.4601 -4.4601 -4.4384 -4.4384 -2.0680 -2.0680 -1.9860 -1.9860 -1.9547 -1.9547 -0.6373 -0.6373 -0.1732 -0.1732 -0.1400 -0.1400 0.3678 0.3678 0.3745 0.3745 0.6947 0.6947 0.6992 0.6992 0.7854 0.7854 1.0087 1.0087 1.0727 1.0727 1.2556 1.2556 1.5084 1.5084 1.5590 1.5590 1.5803 1.5803 8.1717 8.1717 11.5070 11.5070 12.0916 12.0916 12.4589 12.4589 12.4749 12.4749 12.7748 12.7748 k = 0.0093 0.0160-0.0000 ( 5659 PWs) bands (ev): -20.8365 -20.8365 -20.6492 -20.6492 -19.7400 -19.7400 -18.7167 -18.7167 -18.7078 -18.7078 -18.6465 -18.6465 -18.1086 -18.1086 -18.1085 -18.1085 -5.6796 -5.6796 -5.3258 -5.3258 -5.1186 -5.1186 -4.8933 -4.8933 -4.4783 -4.4783 -4.4630 -4.4630 -4.4397 -4.4397 -2.0694 -2.0694 -1.9863 -1.9863 -1.9548 -1.9548 -0.6375 -0.6375 -0.1723 -0.1723 -0.1388 -0.1388 0.3688 0.3688 0.3754 0.3754 0.6952 0.6952 0.6994 0.6994 0.7865 0.7865 1.0109 1.0109 1.0751 1.0751 1.2558 1.2558 1.5092 1.5092 1.5598 1.5598 1.5811 1.5811 8.1634 8.1634 11.5039 11.5039 12.1021 12.1021 12.4588 12.4588 12.4747 12.4747 12.7668 12.7668 k = 0.0000 0.0000 0.0000 ( 5673 PWs) bands (ev): -20.8367 -20.8367 -20.6492 -20.6492 -19.7398 -19.7398 -18.7167 -18.7167 -18.7078 -18.7078 -18.6466 -18.6466 -18.1085 -18.1085 -18.1085 -18.1085 -5.6799 -5.6799 -5.3254 -5.3254 -5.1193 -5.1193 -4.8939 -4.8939 -4.4765 -4.4765 -4.4645 -4.4645 -4.4402 -4.4402 -2.0699 -2.0699 -1.9864 -1.9864 -1.9549 -1.9549 -0.6375 -0.6375 -0.1720 -0.1720 -0.1384 -0.1384 0.3692 0.3692 0.3757 0.3757 0.6953 0.6953 0.6995 0.6995 0.7869 0.7869 1.0116 1.0116 1.0759 1.0759 1.2559 1.2559 1.5094 1.5094 1.5600 1.5600 1.5814 1.5814 8.1606 8.1606 11.5028 11.5028 12.1057 12.1057 12.4588 12.4588 12.4746 12.4746 12.7641 12.7641 k = 0.0000 0.0000 0.0000 ( 5673 PWs) bands (ev): -20.8367 -20.8367 -20.6492 -20.6492 -19.7398 -19.7398 -18.7167 -18.7167 -18.7078 -18.7078 -18.6466 -18.6466 -18.1085 -18.1085 -18.1085 -18.1085 -5.6799 -5.6799 -5.3254 -5.3254 -5.1193 -5.1193 -4.8939 -4.8939 -4.4765 -4.4765 -4.4645 -4.4645 -4.4402 -4.4402 -2.0699 -2.0699 -1.9864 -1.9864 -1.9549 -1.9549 -0.6375 -0.6375 -0.1720 -0.1720 -0.1384 -0.1384 0.3692 0.3692 0.3757 0.3757 0.6953 0.6953 0.6995 0.6995 0.7869 0.7869 1.0116 1.0116 1.0759 1.0759 1.2559 1.2559 1.5094 1.5094 1.5600 1.5600 1.5814 1.5814 8.1606 8.1606 11.5028 11.5028 12.1057 12.1057 12.4588 12.4588 12.4746 12.4746 12.7641 12.7641 k = 0.0000 0.0000 0.0184 ( 5655 PWs) bands (ev): -20.8365 -20.8365 -20.6492 -20.6492 -19.7398 -19.7398 -18.7166 -18.7166 -18.7077 -18.7077 -18.6467 -18.6467 -18.1086 -18.1086 -18.1086 -18.1086 -5.6798 -5.6798 -5.3261 -5.3261 -5.1187 -5.1187 -4.8939 -4.8939 -4.4768 -4.4768 -4.4740 -4.4740 -4.4311 -4.4311 -2.0698 -2.0698 -1.9860 -1.9860 -1.9544 -1.9544 -0.6365 -0.6365 -0.1725 -0.1725 -0.1389 -0.1389 0.3688 0.3688 0.3753 0.3753 0.6963 0.6963 0.7005 0.7005 0.7871 0.7871 1.0114 1.0114 1.0757 1.0757 1.2543 1.2543 1.5092 1.5092 1.5601 1.5601 1.5815 1.5815 8.1633 8.1633 11.5013 11.5013 12.1090 12.1090 12.4506 12.4506 12.4668 12.4668 12.7647 12.7647 k = 0.0000 0.0000 0.0368 ( 5655 PWs) bands (ev): -20.8361 -20.8361 -20.6494 -20.6494 -19.7400 -19.7400 -18.7164 -18.7164 -18.7075 -18.7075 -18.6470 -18.6470 -18.1088 -18.1088 -18.1088 -18.1088 -5.6794 -5.6794 -5.3282 -5.3282 -5.1168 -5.1168 -4.8939 -4.8939 -4.4904 -4.4904 -4.4777 -4.4777 -4.4160 -4.4160 -2.0694 -2.0694 -1.9848 -1.9848 -1.9530 -1.9530 -0.6335 -0.6335 -0.1739 -0.1739 -0.1403 -0.1403 0.3677 0.3677 0.3742 0.3742 0.6992 0.6992 0.7033 0.7033 0.7877 0.7877 1.0110 1.0110 1.0753 1.0753 1.2495 1.2495 1.5087 1.5087 1.5603 1.5603 1.5817 1.5817 8.1714 8.1714 11.4967 11.4967 12.1190 12.1190 12.4276 12.4276 12.4447 12.4447 12.7657 12.7657 k = 0.0000 0.0000 0.0552 ( 5655 PWs) bands (ev): -20.8352 -20.8352 -20.6496 -20.6496 -19.7402 -19.7402 -18.7160 -18.7160 -18.7071 -18.7071 -18.6476 -18.6476 -18.1092 -18.1092 -18.1092 -18.1092 -5.6787 -5.6787 -5.3315 -5.3315 -5.1138 -5.1138 -4.8940 -4.8940 -4.5081 -4.5081 -4.4792 -4.4792 -4.4004 -4.4004 -2.0688 -2.0688 -1.9829 -1.9829 -1.9507 -1.9507 -0.6285 -0.6285 -0.1763 -0.1763 -0.1426 -0.1426 0.3660 0.3660 0.3724 0.3724 0.7040 0.7040 0.7079 0.7079 0.7886 0.7886 1.0102 1.0102 1.0746 1.0746 1.2416 1.2416 1.5078 1.5078 1.5606 1.5606 1.5821 1.5821 8.1848 8.1848 11.4893 11.4893 12.1352 12.1352 12.3932 12.3932 12.4114 12.4114 12.7652 12.7652 k = 0.0000 0.0000 0.0736 ( 5637 PWs) bands (ev): -20.8341 -20.8341 -20.6499 -20.6499 -19.7406 -19.7406 -18.7155 -18.7155 -18.7066 -18.7066 -18.6484 -18.6484 -18.1097 -18.1097 -18.1097 -18.1097 -5.6777 -5.6777 -5.3361 -5.3361 -5.1097 -5.1097 -4.8940 -4.8940 -4.5263 -4.5263 -4.4812 -4.4812 -4.3851 -4.3851 -2.0679 -2.0679 -1.9801 -1.9801 -1.9475 -1.9475 -0.6216 -0.6216 -0.1795 -0.1795 -0.1458 -0.1458 0.3636 0.3636 0.3700 0.3700 0.7105 0.7105 0.7142 0.7142 0.7900 0.7900 1.0092 1.0092 1.0736 1.0736 1.2306 1.2306 1.5066 1.5066 1.5610 1.5610 1.5827 1.5827 8.2035 8.2035 11.4797 11.4797 12.1571 12.1571 12.3514 12.3514 12.3703 12.3703 12.7621 12.7621 k = 0.0000 0.0000 0.0920 ( 5649 PWs) bands (ev): -20.8326 -20.8326 -20.6503 -20.6503 -19.7410 -19.7410 -18.7148 -18.7148 -18.7059 -18.7059 -18.6495 -18.6495 -18.1104 -18.1104 -18.1104 -18.1104 -5.6765 -5.6765 -5.3418 -5.3418 -5.1047 -5.1047 -4.8941 -4.8941 -4.5447 -4.5447 -4.4839 -4.4839 -4.3704 -4.3704 -2.0667 -2.0667 -1.9766 -1.9766 -1.9434 -1.9434 -0.6128 -0.6128 -0.1836 -0.1836 -0.1498 -0.1498 0.3607 0.3607 0.3670 0.3670 0.7186 0.7186 0.7221 0.7221 0.7918 0.7918 1.0078 1.0078 1.0724 1.0724 1.2167 1.2167 1.5050 1.5050 1.5615 1.5615 1.5833 1.5833 8.2273 8.2273 11.4684 11.4684 12.1839 12.1839 12.3053 12.3053 12.3243 12.3243 12.7555 12.7555 k = 0.0000 0.0000 0.1105 ( 5655 PWs) bands (ev): -20.8309 -20.8309 -20.6507 -20.6507 -19.7416 -19.7416 -18.7140 -18.7140 -18.7051 -18.7051 -18.6507 -18.6507 -18.1113 -18.1113 -18.1112 -18.1112 -5.6750 -5.6750 -5.3484 -5.3484 -5.0990 -5.0990 -4.8942 -4.8942 -4.5630 -4.5630 -4.4870 -4.4870 -4.3565 -4.3565 -2.0652 -2.0652 -1.9724 -1.9724 -1.9385 -1.9385 -0.6022 -0.6022 -0.1885 -0.1885 -0.1545 -0.1545 0.3573 0.3573 0.3636 0.3636 0.7282 0.7282 0.7313 0.7313 0.7940 0.7940 1.0062 1.0062 1.0709 1.0709 1.1999 1.1999 1.5030 1.5030 1.5622 1.5622 1.5840 1.5840 8.2561 8.2561 11.4557 11.4557 12.2132 12.2132 12.2590 12.2590 12.2758 12.2758 12.7456 12.7456 k = 0.0000 0.0000 0.1289 ( 5655 PWs) bands (ev): -20.8288 -20.8288 -20.6513 -20.6513 -19.7422 -19.7422 -18.7131 -18.7131 -18.7041 -18.7041 -18.6522 -18.6522 -18.1122 -18.1122 -18.1122 -18.1122 -5.6733 -5.6733 -5.3557 -5.3557 -5.0925 -5.0925 -4.8942 -4.8942 -4.5813 -4.5813 -4.4907 -4.4907 -4.3435 -4.3435 -2.0634 -2.0634 -1.9676 -1.9676 -1.9328 -1.9328 -0.5899 -0.5899 -0.1940 -0.1940 -0.1599 -0.1599 0.3535 0.3535 0.3597 0.3597 0.7391 0.7391 0.7417 0.7417 0.7967 0.7967 1.0042 1.0042 1.0692 1.0692 1.1805 1.1805 1.5007 1.5007 1.5628 1.5628 1.5849 1.5849 8.2897 8.2897 11.4423 11.4423 12.2012 12.2012 12.2262 12.2262 12.2574 12.2574 12.7325 12.7325 k = 0.0000 0.0000 0.1473 ( 5655 PWs) bands (ev): -20.8264 -20.8264 -20.6520 -20.6520 -19.7429 -19.7429 -18.7121 -18.7121 -18.7031 -18.7031 -18.6538 -18.6538 -18.1133 -18.1133 -18.1133 -18.1133 -5.6714 -5.6714 -5.3638 -5.3638 -5.0856 -5.0856 -4.8942 -4.8942 -4.5992 -4.5992 -4.4950 -4.4950 -4.3313 -4.3313 -2.0612 -2.0612 -1.9621 -1.9621 -1.9263 -1.9263 -0.5760 -0.5760 -0.2002 -0.2002 -0.1659 -0.1659 0.3495 0.3495 0.3555 0.3555 0.7512 0.7512 0.7530 0.7530 0.7998 0.7998 1.0018 1.0018 1.0672 1.0672 1.1587 1.1587 1.4980 1.4980 1.5636 1.5636 1.5857 1.5857 8.3278 8.3278 11.4284 11.4284 12.1536 12.1536 12.1767 12.1767 12.2953 12.2953 12.7165 12.7165 k = 0.0000 0.0000 0.1657 ( 5679 PWs) bands (ev): -20.8238 -20.8238 -20.6527 -20.6527 -19.7437 -19.7437 -18.7109 -18.7109 -18.7019 -18.7019 -18.6556 -18.6556 -18.1145 -18.1145 -18.1145 -18.1145 -5.6693 -5.6693 -5.3724 -5.3724 -5.0783 -5.0783 -4.8942 -4.8942 -4.6168 -4.6168 -4.4997 -4.4997 -4.3201 -4.3201 -2.0586 -2.0586 -1.9559 -1.9559 -1.9191 -1.9191 -0.5606 -0.5606 -0.2068 -0.2068 -0.1723 -0.1723 0.3452 0.3452 0.3510 0.3510 0.7642 0.7642 0.7649 0.7649 0.8036 0.8036 0.9989 0.9989 1.0651 1.0651 1.1349 1.1349 1.4950 1.4950 1.5643 1.5643 1.5866 1.5866 8.3702 8.3702 11.4144 11.4144 12.1052 12.1052 12.1281 12.1281 12.3381 12.3381 12.6977 12.6977 k = 0.0000 0.0000 0.1841 ( 5685 PWs) bands (ev): -20.8209 -20.8209 -20.6536 -20.6536 -19.7446 -19.7446 -18.7097 -18.7097 -18.7006 -18.7006 -18.6576 -18.6576 -18.1159 -18.1159 -18.1158 -18.1158 -5.6670 -5.6670 -5.3814 -5.3814 -5.0708 -5.0708 -4.8941 -4.8941 -4.6339 -4.6339 -4.5048 -4.5048 -4.3098 -4.3098 -2.0556 -2.0556 -1.9493 -1.9493 -1.9114 -1.9114 -0.5438 -0.5438 -0.2139 -0.2139 -0.1792 -0.1792 0.3407 0.3407 0.3464 0.3464 0.7769 0.7769 0.7781 0.7781 0.8084 0.8084 0.9953 0.9953 1.0628 1.0628 1.1093 1.1093 1.4917 1.4917 1.5651 1.5651 1.5874 1.5874 8.4167 8.4167 11.4007 11.4007 12.0582 12.0582 12.0810 12.0810 12.3839 12.3839 12.6765 12.6765 k = 0.0000 0.0000 0.2025 ( 5685 PWs) bands (ev): -20.8177 -20.8177 -20.6545 -20.6545 -19.7455 -19.7455 -18.7083 -18.7083 -18.6992 -18.6992 -18.6597 -18.6597 -18.1173 -18.1173 -18.1173 -18.1173 -5.6645 -5.6645 -5.3908 -5.3908 -5.0631 -5.0631 -4.8940 -4.8940 -4.6504 -4.6504 -4.5104 -4.5104 -4.3005 -4.3005 -2.0523 -2.0523 -1.9421 -1.9421 -1.9030 -1.9030 -0.5258 -0.5258 -0.2213 -0.2213 -0.1864 -0.1864 0.3361 0.3361 0.3416 0.3416 0.7883 0.7883 0.7927 0.7927 0.8148 0.8148 0.9905 0.9905 1.0603 1.0603 1.0829 1.0829 1.4881 1.4881 1.5658 1.5658 1.5882 1.5882 8.4669 8.4669 11.3873 11.3873 12.0131 12.0131 12.0359 12.0359 12.4322 12.4322 12.6531 12.6531 k = 0.0000 0.0000 0.2209 ( 5685 PWs) bands (ev): -20.8143 -20.8143 -20.6556 -20.6556 -19.7466 -19.7466 -18.7069 -18.7069 -18.6977 -18.6977 -18.6618 -18.6618 -18.1188 -18.1188 -18.1188 -18.1188 -5.6620 -5.6620 -5.4004 -5.4004 -5.0554 -5.0554 -4.8937 -4.8937 -4.6662 -4.6662 -4.5164 -4.5164 -4.2922 -4.2922 -2.0485 -2.0485 -1.9345 -1.9345 -1.8942 -1.8942 -0.5066 -0.5066 -0.2289 -0.2289 -0.1938 -0.1938 0.3315 0.3315 0.3366 0.3366 0.7980 0.7980 0.8079 0.8079 0.8235 0.8235 0.9833 0.9833 1.0570 1.0570 1.0577 1.0577 1.4842 1.4842 1.5665 1.5665 1.5889 1.5889 8.5205 8.5205 11.3745 11.3745 11.9702 11.9702 11.9930 11.9930 12.4824 12.4824 12.6278 12.6278 k = 0.0000 0.0000 0.2393 ( 5684 PWs) bands (ev): -20.8107 -20.8107 -20.6568 -20.6568 -19.7476 -19.7476 -18.7054 -18.7054 -18.6962 -18.6962 -18.6641 -18.6641 -18.1204 -18.1204 -18.1204 -18.1204 -5.6593 -5.6593 -5.4102 -5.4102 -5.0478 -5.0478 -4.8933 -4.8933 -4.6812 -4.6812 -4.5227 -4.5227 -4.2848 -4.2848 -2.0443 -2.0443 -1.9265 -1.9265 -1.8849 -1.8849 -0.4864 -0.4864 -0.2367 -0.2367 -0.2013 -0.2013 0.3268 0.3268 0.3317 0.3317 0.8055 0.8055 0.8235 0.8235 0.8349 0.8349 0.9713 0.9713 1.0343 1.0343 1.0551 1.0551 1.4800 1.4800 1.5670 1.5670 1.5895 1.5895 8.5772 8.5772 11.3624 11.3624 11.9298 11.9298 11.9527 11.9527 12.5338 12.5338 12.6007 12.6007 k = 0.0000 0.0000 0.2577 ( 5672 PWs) bands (ev): -20.8069 -20.8069 -20.6581 -20.6581 -19.7487 -19.7487 -18.7039 -18.7039 -18.6945 -18.6945 -18.6664 -18.6664 -18.1220 -18.1220 -18.1220 -18.1220 -5.6566 -5.6566 -5.4200 -5.4200 -5.0405 -5.0405 -4.8929 -4.8929 -4.6952 -4.6952 -4.5294 -4.5294 -4.2784 -4.2784 -2.0398 -2.0398 -1.9182 -1.9182 -1.8753 -1.8753 -0.4653 -0.4653 -0.2445 -0.2445 -0.2089 -0.2089 0.3222 0.3222 0.3267 0.3267 0.8116 0.8116 0.8394 0.8394 0.8479 0.8479 0.9515 0.9515 1.0182 1.0182 1.0523 1.0523 1.4757 1.4757 1.5674 1.5674 1.5899 1.5899 8.6365 8.6365 11.3511 11.3511 11.8922 11.8922 11.9152 11.9152 12.5701 12.5701 12.5741 12.5741 k = 0.0000 0.0000 0.2761 ( 5690 PWs) bands (ev): -20.8029 -20.8029 -20.6595 -20.6595 -19.7499 -19.7499 -18.7024 -18.7024 -18.6929 -18.6929 -18.6688 -18.6688 -18.1237 -18.1237 -18.1237 -18.1237 -5.6537 -5.6537 -5.4299 -5.4299 -5.0337 -5.0337 -4.8923 -4.8923 -4.7081 -4.7081 -4.5363 -4.5363 -4.2729 -4.2729 -2.0349 -2.0349 -1.9097 -1.9097 -1.8655 -1.8655 -0.4434 -0.4434 -0.2524 -0.2524 -0.2165 -0.2165 0.3176 0.3176 0.3217 0.3217 0.8170 0.8170 0.8554 0.8554 0.8613 0.8613 0.9248 0.9248 1.0085 1.0085 1.0495 1.0495 1.4711 1.4711 1.5676 1.5676 1.5901 1.5901 8.6981 8.6981 11.3406 11.3406 11.8574 11.8574 11.8805 11.8805 12.5412 12.5412 12.5439 12.5439 k = 0.0000 0.0000 0.2946 ( 5678 PWs) bands (ev): -20.7987 -20.7987 -20.6610 -20.6610 -19.7510 -19.7510 -18.7008 -18.7008 -18.6912 -18.6912 -18.6712 -18.6712 -18.1255 -18.1255 -18.1254 -18.1254 -5.6509 -5.6509 -5.4397 -5.4397 -5.0273 -5.0273 -4.8915 -4.8915 -4.7199 -4.7199 -4.5434 -4.5434 -4.2683 -4.2683 -2.0298 -2.0298 -1.9011 -1.9011 -1.8554 -1.8554 -0.4209 -0.4209 -0.2600 -0.2600 -0.2240 -0.2240 0.3130 0.3130 0.3168 0.3168 0.8220 0.8220 0.8715 0.8715 0.8715 0.8715 0.8971 0.8971 1.0027 1.0027 1.0467 1.0467 1.4665 1.4665 1.5676 1.5676 1.5902 1.5902 8.7616 8.7616 11.3312 11.3312 11.8256 11.8256 11.8489 11.8489 12.5100 12.5100 12.5125 12.5125 k = 0.0000 0.0000 0.3130 ( 5678 PWs) bands (ev): -20.7944 -20.7944 -20.6627 -20.6627 -19.7522 -19.7522 -18.6993 -18.6993 -18.6895 -18.6895 -18.6735 -18.6735 -18.1272 -18.1272 -18.1272 -18.1272 -5.6480 -5.6480 -5.4494 -5.4494 -5.0216 -5.0216 -4.8906 -4.8906 -4.7303 -4.7303 -4.5507 -4.5507 -4.2645 -4.2645 -2.0244 -2.0244 -1.8923 -1.8923 -1.8454 -1.8454 -0.3978 -0.3978 -0.2675 -0.2675 -0.2314 -0.2314 0.3086 0.3086 0.3120 0.3120 0.8266 0.8266 0.8529 0.8529 0.8875 0.8875 0.8956 0.8956 0.9989 0.9989 1.0439 1.0439 1.4617 1.4617 1.5673 1.5673 1.5900 1.5900 8.8264 8.8264 11.3227 11.3227 11.7968 11.7968 11.8203 11.8203 12.4778 12.4778 12.4803 12.4803 k = 0.0000 0.0000 0.3314 ( 5678 PWs) bands (ev): -20.7899 -20.7899 -20.6644 -20.6644 -19.7534 -19.7534 -18.6978 -18.6978 -18.6878 -18.6878 -18.6757 -18.6757 -18.1290 -18.1290 -18.1289 -18.1289 -5.6452 -5.6452 -5.4589 -5.4589 -5.0167 -5.0167 -4.8896 -4.8896 -4.7394 -4.7394 -4.5580 -4.5580 -4.2614 -4.2614 -2.0188 -2.0188 -1.8835 -1.8835 -1.8353 -1.8353 -0.3745 -0.3745 -0.2746 -0.2746 -0.2386 -0.2386 0.3042 0.3042 0.3073 0.3073 0.8176 0.8176 0.8323 0.8323 0.9033 0.9033 0.9079 0.9079 0.9965 0.9965 1.0411 1.0411 1.4569 1.4569 1.5669 1.5669 1.5896 1.5896 8.8920 8.8920 11.3153 11.3153 11.7711 11.7711 11.7948 11.7948 12.4450 12.4450 12.4473 12.4473 k = 0.0000 0.0000 0.3498 ( 5660 PWs) bands (ev): -20.7854 -20.7854 -20.6663 -20.6663 -19.7546 -19.7546 -18.6965 -18.6965 -18.6860 -18.6860 -18.6778 -18.6778 -18.1307 -18.1307 -18.1307 -18.1307 -5.6423 -5.6423 -5.4681 -5.4681 -5.0126 -5.0126 -4.8884 -4.8884 -4.7471 -4.7471 -4.5655 -4.5655 -4.2590 -4.2590 -2.0131 -2.0131 -1.8748 -1.8748 -1.8253 -1.8253 -0.3510 -0.3510 -0.2811 -0.2811 -0.2456 -0.2456 0.3001 0.3001 0.3027 0.3027 0.7818 0.7818 0.8365 0.8365 0.9188 0.9188 0.9206 0.9206 0.9955 0.9955 1.0384 1.0384 1.4520 1.4520 1.5662 1.5662 1.5890 1.5890 8.9580 8.9580 11.3089 11.3089 11.7484 11.7484 11.7724 11.7724 12.4117 12.4117 12.4138 12.4138 k = 0.0000 0.0000 0.3682 ( 5672 PWs) bands (ev): -20.7807 -20.7807 -20.6684 -20.6684 -19.7558 -19.7558 -18.6954 -18.6954 -18.6844 -18.6844 -18.6797 -18.6797 -18.1324 -18.1324 -18.1324 -18.1324 -5.6395 -5.6395 -5.4769 -5.4769 -5.0095 -5.0095 -4.8871 -4.8871 -4.7532 -4.7532 -4.5729 -4.5729 -4.2572 -4.2572 -2.0074 -2.0074 -1.8663 -1.8663 -1.8156 -1.8156 -0.3284 -0.3284 -0.2863 -0.2863 -0.2523 -0.2523 0.2960 0.2960 0.2983 0.2983 0.7450 0.7450 0.8410 0.8410 0.9320 0.9320 0.9339 0.9339 0.9959 0.9959 1.0359 1.0359 1.4472 1.4472 1.5652 1.5652 1.5882 1.5882 9.0238 9.0238 11.3037 11.3037 11.7288 11.7288 11.7531 11.7531 12.3783 12.3783 12.3802 12.3802 k = 0.0000 0.0000 0.3866 ( 5660 PWs) bands (ev): -20.7761 -20.7761 -20.6705 -20.6705 -19.7569 -19.7569 -18.6946 -18.6946 -18.6827 -18.6827 -18.6812 -18.6812 -18.1341 -18.1341 -18.1340 -18.1340 -5.6368 -5.6368 -5.4854 -5.4854 -5.0074 -5.0074 -4.8857 -4.8857 -4.7580 -4.7580 -4.5802 -4.5802 -4.2560 -4.2560 -2.0017 -2.0017 -1.8580 -1.8580 -1.8061 -1.8061 -0.3110 -0.3110 -0.2858 -0.2858 -0.2586 -0.2586 0.2922 0.2922 0.2941 0.2941 0.7081 0.7081 0.8454 0.8454 0.9414 0.9414 0.9484 0.9484 0.9983 0.9983 1.0335 1.0335 1.4425 1.4425 1.5640 1.5640 1.5872 1.5872 9.0887 9.0887 11.2995 11.2995 11.7122 11.7122 11.7368 11.7368 12.3449 12.3449 12.3466 12.3466 k = 0.0000 0.0000 0.4050 ( 5666 PWs) bands (ev): -20.7714 -20.7714 -20.6728 -20.6728 -19.7580 -19.7580 -18.6942 -18.6942 -18.6822 -18.6822 -18.6812 -18.6812 -18.1357 -18.1357 -18.1357 -18.1357 -5.6342 -5.6342 -5.4935 -5.4935 -5.0062 -5.0062 -4.8842 -4.8842 -4.7613 -4.7613 -4.5873 -4.5873 -4.2552 -4.2552 -1.9961 -1.9961 -1.8500 -1.8500 -1.7970 -1.7970 -0.3080 -0.3080 -0.2704 -0.2704 -0.2646 -0.2646 0.2886 0.2886 0.2902 0.2902 0.6715 0.6715 0.8497 0.8497 0.9482 0.9482 0.9621 0.9621 1.0031 1.0031 1.0313 1.0313 1.4379 1.4379 1.5627 1.5627 1.5859 1.5859 9.1522 9.1522 11.2963 11.2963 11.6984 11.6984 11.7234 11.7234 12.3120 12.3120 12.3133 12.3133 k = 0.0000 0.0000 0.4234 ( 5666 PWs) bands (ev): -20.7667 -20.7667 -20.6752 -20.6752 -19.7591 -19.7591 -18.6944 -18.6944 -18.6827 -18.6827 -18.6797 -18.6797 -18.1372 -18.1372 -18.1372 -18.1372 -5.6317 -5.6317 -5.5011 -5.5011 -5.0058 -5.0058 -4.8826 -4.8826 -4.7635 -4.7635 -4.5942 -4.5942 -4.2548 -4.2548 -1.9908 -1.9908 -1.8424 -1.8424 -1.7883 -1.7883 -0.3115 -0.3115 -0.2702 -0.2702 -0.2482 -0.2482 0.2852 0.2852 0.2864 0.2864 0.6355 0.6355 0.8538 0.8538 0.9524 0.9524 0.9750 0.9750 1.0100 1.0100 1.0294 1.0294 1.4335 1.4335 1.5611 1.5611 1.5846 1.5846 9.2136 9.2136 11.2942 11.2942 11.6874 11.6874 11.7128 11.7128 12.2798 12.2798 12.2807 12.2807 k = 0.0000 0.0000 0.4418 ( 5696 PWs) bands (ev): -20.7621 -20.7621 -20.6777 -20.6777 -19.7601 -19.7601 -18.6950 -18.6950 -18.6826 -18.6826 -18.6783 -18.6783 -18.1386 -18.1386 -18.1386 -18.1386 -5.6293 -5.6293 -5.5081 -5.5081 -5.0062 -5.0062 -4.8810 -4.8810 -4.7645 -4.7645 -4.6008 -4.6008 -4.2548 -4.2548 -1.9856 -1.9856 -1.8352 -1.8352 -1.7803 -1.7803 -0.3160 -0.3160 -0.2753 -0.2753 -0.2250 -0.2250 0.2821 0.2821 0.2830 0.2830 0.6005 0.6005 0.8576 0.8576 0.9545 0.9545 0.9867 0.9867 1.0184 1.0184 1.0281 1.0281 1.4293 1.4293 1.5594 1.5594 1.5830 1.5830 9.2721 9.2721 11.2930 11.2930 11.6789 11.6789 11.7049 11.7049 12.2487 12.2487 12.2490 12.2490 k = 0.0000 0.0000 0.4602 ( 5696 PWs) bands (ev): -20.7575 -20.7575 -20.6802 -20.6802 -19.7610 -19.7610 -18.6959 -18.6959 -18.6822 -18.6822 -18.6770 -18.6770 -18.1400 -18.1400 -18.1400 -18.1400 -5.6271 -5.6271 -5.5146 -5.5146 -5.0071 -5.0071 -4.8794 -4.8794 -4.7647 -4.7647 -4.6071 -4.6071 -4.2549 -4.2549 -1.9808 -1.9808 -1.8286 -1.8286 -1.7728 -1.7728 -0.3204 -0.3204 -0.2800 -0.2800 -0.2019 -0.2019 0.2792 0.2792 0.2798 0.2798 0.5669 0.5669 0.8612 0.8612 0.9554 0.9554 0.9968 0.9968 1.0274 1.0274 1.0276 1.0276 1.4254 1.4254 1.5577 1.5577 1.5815 1.5815 9.3272 9.3272 11.2927 11.2927 11.6728 11.6728 11.6993 11.6993 12.2187 12.2187 12.2190 12.2190 k = 0.0000 0.0000 0.4786 ( 5696 PWs) bands (ev): -20.7531 -20.7531 -20.6829 -20.6829 -19.7618 -19.7618 -18.6970 -18.6970 -18.6816 -18.6816 -18.6758 -18.6758 -18.1412 -18.1412 -18.1412 -18.1412 -5.6251 -5.6251 -5.5204 -5.5204 -5.0083 -5.0083 -4.8778 -4.8778 -4.7643 -4.7643 -4.6128 -4.6128 -4.2553 -4.2553 -1.9764 -1.9764 -1.8226 -1.8226 -1.7660 -1.7660 -0.3245 -0.3245 -0.2842 -0.2842 -0.1795 -0.1795 0.2767 0.2767 0.2770 0.2770 0.5350 0.5350 0.8645 0.8645 0.9555 0.9555 1.0045 1.0045 1.0286 1.0286 1.0363 1.0363 1.4218 1.4218 1.5559 1.5559 1.5799 1.5799 9.3780 9.3780 11.2931 11.2931 11.6687 11.6687 11.6959 11.6959 12.1902 12.1902 12.1911 12.1911 k = 0.0000 0.0000 0.4971 ( 5708 PWs) bands (ev): -20.7488 -20.7488 -20.6855 -20.6855 -19.7626 -19.7626 -18.6981 -18.6981 -18.6809 -18.6809 -18.6748 -18.6748 -18.1422 -18.1422 -18.1422 -18.1422 -5.6232 -5.6232 -5.5255 -5.5255 -5.0098 -5.0098 -4.8762 -4.8762 -4.7635 -4.7635 -4.6180 -4.6180 -4.2557 -4.2557 -1.9724 -1.9724 -1.8173 -1.8173 -1.7600 -1.7600 -0.3281 -0.3281 -0.2878 -0.2878 -0.1582 -0.1582 0.2744 0.2744 0.2745 0.2745 0.5053 0.5053 0.8674 0.8674 0.9553 0.9553 1.0091 1.0091 1.0318 1.0318 1.0447 1.0447 1.4186 1.4186 1.5541 1.5541 1.5784 1.5784 9.4238 9.4238 11.2942 11.2942 11.6665 11.6665 11.6943 11.6943 12.1638 12.1638 12.1655 12.1655 k = 0.0000 0.0000 0.5155 ( 5720 PWs) bands (ev): -20.7448 -20.7448 -20.6881 -20.6881 -19.7632 -19.7632 -18.6991 -18.6991 -18.6803 -18.6803 -18.6739 -18.6739 -18.1432 -18.1432 -18.1432 -18.1432 -5.6216 -5.6216 -5.5299 -5.5299 -5.0114 -5.0114 -4.8748 -4.8748 -4.7624 -4.7624 -4.6226 -4.6226 -4.2562 -4.2562 -1.9690 -1.9690 -1.8127 -1.8127 -1.7548 -1.7548 -0.3312 -0.3312 -0.2910 -0.2910 -0.1385 -0.1385 0.2724 0.2724 0.2725 0.2725 0.4783 0.4783 0.8700 0.8700 0.9548 0.9548 1.0110 1.0110 1.0367 1.0367 1.0522 1.0522 1.4158 1.4158 1.5525 1.5525 1.5770 1.5770 9.4640 9.4640 11.2956 11.2956 11.6656 11.6656 11.6942 11.6942 12.1402 12.1402 12.1426 12.1426 k = 0.0000 0.0000 0.5339 ( 5720 PWs) bands (ev): -20.7412 -20.7412 -20.6906 -20.6906 -19.7638 -19.7638 -18.7000 -18.7000 -18.6797 -18.6797 -18.6731 -18.6731 -18.1439 -18.1439 -18.1439 -18.1439 -5.6202 -5.6202 -5.5336 -5.5336 -5.0129 -5.0129 -4.8736 -4.8736 -4.7612 -4.7612 -4.6264 -4.6264 -4.2567 -4.2567 -1.9661 -1.9661 -1.8088 -1.8088 -1.7504 -1.7504 -0.3338 -0.3338 -0.2936 -0.2936 -0.1209 -0.1209 0.2706 0.2706 0.2710 0.2710 0.4548 0.4548 0.8722 0.8722 0.9544 0.9544 1.0115 1.0115 1.0418 1.0418 1.0586 1.0586 1.4134 1.4134 1.5511 1.5511 1.5757 1.5757 9.4978 9.4978 11.2972 11.2972 11.6658 11.6658 11.6950 11.6950 12.1197 12.1197 12.1229 12.1229 k = 0.0000 0.0000 0.5523 ( 5696 PWs) bands (ev): -20.7380 -20.7380 -20.6929 -20.6929 -19.7642 -19.7642 -18.7006 -18.7006 -18.6792 -18.6792 -18.6725 -18.6725 -18.1445 -18.1445 -18.1445 -18.1445 -5.6191 -5.6191 -5.5365 -5.5365 -5.0141 -5.0141 -4.8726 -4.8726 -4.7602 -4.7602 -4.6295 -4.6295 -4.2571 -4.2571 -1.9638 -1.9638 -1.8058 -1.8058 -1.7470 -1.7470 -0.3358 -0.3358 -0.2956 -0.2956 -0.1062 -0.1062 0.2693 0.2693 0.2697 0.2697 0.4353 0.4353 0.8739 0.8739 0.9540 0.9540 1.0114 1.0114 1.0464 1.0464 1.0638 1.0638 1.4116 1.4116 1.5499 1.5499 1.5747 1.5747 9.5248 9.5248 11.2987 11.2987 11.6665 11.6665 11.6964 11.6964 12.1030 12.1030 12.1069 12.1069 k = 0.0000 0.0000 0.5707 ( 5714 PWs) bands (ev): -20.7355 -20.7355 -20.6947 -20.6947 -19.7645 -19.7645 -18.7012 -18.7012 -18.6789 -18.6789 -18.6721 -18.6721 -18.1450 -18.1450 -18.1450 -18.1450 -5.6184 -5.6184 -5.5386 -5.5386 -5.0151 -5.0151 -4.8718 -4.8718 -4.7594 -4.7594 -4.6317 -4.6317 -4.2574 -4.2574 -1.9622 -1.9622 -1.8036 -1.8036 -1.7446 -1.7446 -0.3373 -0.3373 -0.2971 -0.2971 -0.0950 -0.0950 0.2683 0.2683 0.2689 0.2689 0.4206 0.4206 0.8751 0.8751 0.9536 0.9536 1.0112 1.0112 1.0498 1.0498 1.0675 1.0675 1.4102 1.4102 1.5490 1.5490 1.5739 1.5739 9.5445 9.5445 11.3000 11.3000 11.6674 11.6674 11.6978 11.6978 12.0906 12.0906 12.0951 12.0951 k = 0.0000 0.0000 0.5891 ( 5714 PWs) bands (ev): -20.7338 -20.7338 -20.6960 -20.6960 -19.7647 -19.7647 -18.7015 -18.7015 -18.6787 -18.6787 -18.6718 -18.6718 -18.1453 -18.1453 -18.1453 -18.1453 -5.6179 -5.6179 -5.5399 -5.5399 -5.0157 -5.0157 -4.8713 -4.8713 -4.7588 -4.7588 -4.6331 -4.6331 -4.2576 -4.2576 -1.9611 -1.9611 -1.8023 -1.8023 -1.7431 -1.7431 -0.3382 -0.3382 -0.2980 -0.2980 -0.0879 -0.0879 0.2677 0.2677 0.2683 0.2683 0.4115 0.4115 0.8759 0.8759 0.9534 0.9534 1.0111 1.0111 1.0520 1.0520 1.0698 1.0698 1.4094 1.4094 1.5484 1.5484 1.5734 1.5734 9.5564 9.5564 11.3008 11.3008 11.6681 11.6681 11.6989 11.6989 12.0830 12.0830 12.0878 12.0878 k = 0.0000 0.0000 0.6075 ( 5708 PWs) bands (ev): -20.7333 -20.7333 -20.6964 -20.6964 -19.7647 -19.7647 -18.7016 -18.7016 -18.6786 -18.6786 -18.6717 -18.6717 -18.1453 -18.1453 -18.1453 -18.1453 -5.6177 -5.6177 -5.5403 -5.5403 -5.0159 -5.0159 -4.8712 -4.8712 -4.7586 -4.7586 -4.6336 -4.6336 -4.2577 -4.2577 -1.9608 -1.9608 -1.8018 -1.8018 -1.7426 -1.7426 -0.3384 -0.3384 -0.2982 -0.2982 -0.0855 -0.0855 0.2675 0.2675 0.2682 0.2682 0.4084 0.4084 0.8761 0.8761 0.9533 0.9533 1.0110 1.0110 1.0527 1.0527 1.0706 1.0706 1.4091 1.4091 1.5482 1.5482 1.5732 1.5732 9.5604 9.5604 11.3011 11.3011 11.6684 11.6684 11.6992 11.6992 12.0804 12.0804 12.0854 12.0854 k = 0.0000 0.0000 0.6075 ( 5708 PWs) bands (ev): -20.7333 -20.7333 -20.6964 -20.6964 -19.7647 -19.7647 -18.7016 -18.7016 -18.6786 -18.6786 -18.6717 -18.6717 -18.1453 -18.1453 -18.1453 -18.1453 -5.6177 -5.6177 -5.5403 -5.5403 -5.0159 -5.0159 -4.8712 -4.8712 -4.7586 -4.7586 -4.6336 -4.6336 -4.2577 -4.2577 -1.9608 -1.9608 -1.8018 -1.8018 -1.7426 -1.7426 -0.3384 -0.3384 -0.2982 -0.2982 -0.0855 -0.0855 0.2675 0.2675 0.2682 0.2682 0.4084 0.4084 0.8761 0.8761 0.9533 0.9533 1.0110 1.0110 1.0527 1.0527 1.0706 1.0706 1.4091 1.4091 1.5482 1.5482 1.5732 1.5732 9.5604 9.5604 11.3011 11.3011 11.6684 11.6684 11.6992 11.6992 12.0804 12.0804 12.0854 12.0854 k = 0.0156 0.0090 0.6075 ( 5712 PWs) bands (ev): -20.7332 -20.7332 -20.6964 -20.6964 -19.7648 -19.7648 -18.7016 -18.7016 -18.6786 -18.6786 -18.6718 -18.6718 -18.1454 -18.1454 -18.1453 -18.1453 -5.6175 -5.6175 -5.5401 -5.5401 -5.0157 -5.0157 -4.8707 -4.8707 -4.7587 -4.7587 -4.6329 -4.6329 -4.2580 -4.2580 -1.9607 -1.9607 -1.8022 -1.8022 -1.7431 -1.7431 -0.3389 -0.3389 -0.2988 -0.2988 -0.0853 -0.0853 0.2674 0.2674 0.2681 0.2681 0.4090 0.4090 0.8758 0.8758 0.9528 0.9528 1.0105 1.0105 1.0526 1.0526 1.0705 1.0705 1.4089 1.4089 1.5480 1.5480 1.5730 1.5730 9.5613 9.5613 11.3030 11.3030 11.6690 11.6690 11.6998 11.6998 12.0821 12.0821 12.0872 12.0872 k = 0.0312 0.0180 0.6075 ( 5706 PWs) bands (ev): -20.7330 -20.7330 -20.6962 -20.6962 -19.7649 -19.7649 -18.7017 -18.7017 -18.6788 -18.6788 -18.6719 -18.6719 -18.1456 -18.1456 -18.1453 -18.1453 -5.6167 -5.6167 -5.5394 -5.5394 -5.0148 -5.0148 -4.8691 -4.8691 -4.7588 -4.7588 -4.6310 -4.6310 -4.2588 -4.2588 -1.9605 -1.9605 -1.8033 -1.8033 -1.7445 -1.7445 -0.3404 -0.3404 -0.3005 -0.3005 -0.0848 -0.0848 0.2669 0.2669 0.2683 0.2683 0.4108 0.4108 0.8749 0.8749 0.9514 0.9514 1.0089 1.0089 1.0523 1.0523 1.0703 1.0703 1.4082 1.4082 1.5474 1.5474 1.5723 1.5723 9.5637 9.5637 11.3085 11.3085 11.6709 11.6709 11.7015 11.7015 12.0873 12.0873 12.0927 12.0927 k = 0.0469 0.0271 0.6075 ( 5702 PWs) bands (ev): -20.7327 -20.7327 -20.6960 -20.6960 -19.7651 -19.7651 -18.7018 -18.7018 -18.6790 -18.6790 -18.6721 -18.6721 -18.1458 -18.1458 -18.1453 -18.1453 -5.6155 -5.6155 -5.5383 -5.5383 -5.0134 -5.0134 -4.8665 -4.8665 -4.7589 -4.7589 -4.6278 -4.6278 -4.2603 -4.2603 -1.9601 -1.9601 -1.8052 -1.8052 -1.7469 -1.7469 -0.3431 -0.3431 -0.3030 -0.3030 -0.0840 -0.0840 0.2660 0.2660 0.2686 0.2686 0.4137 0.4137 0.8733 0.8733 0.9489 0.9489 1.0064 1.0064 1.0517 1.0517 1.0699 1.0699 1.4071 1.4071 1.5462 1.5462 1.5713 1.5713 9.5679 9.5679 11.3175 11.3175 11.6741 11.6741 11.7045 11.7045 12.0954 12.0954 12.1018 12.1018 k = 0.0625 0.0361 0.6075 ( 5706 PWs) bands (ev): -20.7322 -20.7322 -20.6957 -20.6957 -19.7654 -19.7654 -18.7019 -18.7019 -18.6792 -18.6792 -18.6723 -18.6723 -18.1462 -18.1462 -18.1453 -18.1453 -5.6138 -5.6138 -5.5367 -5.5367 -5.0114 -5.0114 -4.8630 -4.8630 -4.7590 -4.7590 -4.6235 -4.6235 -4.2624 -4.2624 -1.9595 -1.9595 -1.8078 -1.8078 -1.7502 -1.7502 -0.3474 -0.3474 -0.3059 -0.3059 -0.0828 -0.0828 0.2646 0.2646 0.2691 0.2691 0.4177 0.4177 0.8711 0.8711 0.9454 0.9454 1.0029 1.0029 1.0509 1.0509 1.0694 1.0694 1.4055 1.4055 1.5446 1.5446 1.5699 1.5699 9.5736 9.5736 11.3300 11.3300 11.6786 11.6786 11.7092 11.7092 12.1062 12.1062 12.1145 12.1145 k = 0.0781 0.0451 0.6075 ( 5692 PWs) bands (ev): -20.7316 -20.7316 -20.6953 -20.6953 -19.7658 -19.7658 -18.7022 -18.7022 -18.6796 -18.6796 -18.6726 -18.6726 -18.1467 -18.1467 -18.1453 -18.1453 -5.6117 -5.6117 -5.5347 -5.5347 -5.0088 -5.0088 -4.8585 -4.8585 -4.7589 -4.7589 -4.6182 -4.6182 -4.2650 -4.2650 -1.9588 -1.9588 -1.8112 -1.8112 -1.7542 -1.7542 -0.3536 -0.3536 -0.3086 -0.3086 -0.0813 -0.0813 0.2630 0.2630 0.2697 0.2697 0.4225 0.4225 0.8683 0.8683 0.9407 0.9407 0.9986 0.9986 1.0498 1.0498 1.0689 1.0689 1.4035 1.4035 1.5424 1.5424 1.5683 1.5683 9.5808 9.5808 11.3459 11.3459 11.6844 11.6844 11.7160 11.7160 12.1190 12.1190 12.1308 12.1308 k = 0.0938 0.0541 0.6075 ( 5690 PWs) bands (ev): -20.7309 -20.7309 -20.6948 -20.6948 -19.7663 -19.7663 -18.7024 -18.7024 -18.6801 -18.6801 -18.6729 -18.6729 -18.1473 -18.1473 -18.1453 -18.1453 -5.6091 -5.6091 -5.5324 -5.5324 -5.0057 -5.0057 -4.8533 -4.8533 -4.7586 -4.7586 -4.6119 -4.6119 -4.2682 -4.2682 -1.9580 -1.9580 -1.8155 -1.8155 -1.7590 -1.7590 -0.3619 -0.3619 -0.3109 -0.3109 -0.0795 -0.0795 0.2610 0.2610 0.2705 0.2705 0.4281 0.4281 0.8648 0.8648 0.9349 0.9349 0.9936 0.9936 1.0483 1.0483 1.0686 1.0686 1.4011 1.4011 1.5395 1.5395 1.5666 1.5666 9.5896 9.5896 11.3649 11.3649 11.6917 11.6917 11.7249 11.7249 12.1334 12.1334 12.1502 12.1502 k = 0.1094 0.0631 0.6075 ( 5682 PWs) bands (ev): -20.7301 -20.7301 -20.6942 -20.6942 -19.7668 -19.7668 -18.7028 -18.7028 -18.6806 -18.6806 -18.6733 -18.6733 -18.1480 -18.1480 -18.1453 -18.1453 -5.6061 -5.6061 -5.5296 -5.5296 -5.0019 -5.0019 -4.8472 -4.8472 -4.7580 -4.7580 -4.6049 -4.6049 -4.2720 -4.2720 -1.9572 -1.9572 -1.8205 -1.8205 -1.7643 -1.7643 -0.3722 -0.3722 -0.3127 -0.3127 -0.0773 -0.0773 0.2587 0.2587 0.2715 0.2715 0.4344 0.4344 0.8607 0.8607 0.9278 0.9278 0.9881 0.9881 1.0465 1.0465 1.0684 1.0684 1.3983 1.3983 1.5360 1.5360 1.5648 1.5648 9.5999 9.5999 11.3867 11.3867 11.7008 11.7008 11.7363 11.7363 12.1489 12.1489 12.1726 12.1726 k = 0.1250 0.0722 0.6075 ( 5682 PWs) bands (ev): -20.7292 -20.7292 -20.6936 -20.6936 -19.7674 -19.7674 -18.7032 -18.7032 -18.6813 -18.6813 -18.6736 -18.6736 -18.1488 -18.1488 -18.1453 -18.1453 -5.6026 -5.6026 -5.5265 -5.5265 -4.9974 -4.9974 -4.8406 -4.8406 -4.7570 -4.7570 -4.5973 -4.5973 -4.2763 -4.2763 -1.9563 -1.9563 -1.8264 -1.8264 -1.7701 -1.7701 -0.3842 -0.3842 -0.3141 -0.3141 -0.0748 -0.0748 0.2561 0.2561 0.2727 0.2727 0.4411 0.4411 0.8560 0.8560 0.9194 0.9194 0.9822 0.9822 1.0443 1.0443 1.0685 1.0685 1.3950 1.3950 1.5319 1.5319 1.5631 1.5631 9.6115 9.6115 11.4112 11.4112 11.7121 11.7121 11.7502 11.7502 12.1650 12.1650 12.1975 12.1975 k = 0.1406 0.0812 0.6075 ( 5672 PWs) bands (ev): -20.7281 -20.7281 -20.6929 -20.6929 -19.7681 -19.7681 -18.7036 -18.7036 -18.6820 -18.6820 -18.6739 -18.6739 -18.1496 -18.1496 -18.1453 -18.1453 -5.5989 -5.5989 -5.5231 -5.5231 -4.9923 -4.9923 -4.8334 -4.8334 -4.7556 -4.7556 -4.5891 -4.5891 -4.2811 -4.2811 -1.9554 -1.9554 -1.8330 -1.8330 -1.7761 -1.7761 -0.3977 -0.3977 -0.3150 -0.3150 -0.0719 -0.0719 0.2533 0.2533 0.2740 0.2740 0.4482 0.4482 0.8507 0.8507 0.9097 0.9097 0.9761 0.9761 1.0417 1.0417 1.0689 1.0689 1.3914 1.3914 1.5271 1.5271 1.5615 1.5615 9.6244 9.6244 11.4379 11.4379 11.7259 11.7259 11.7666 11.7666 12.1813 12.1813 12.2247 12.2247 k = 0.1562 0.0902 0.6075 ( 5672 PWs) bands (ev): -20.7270 -20.7270 -20.6922 -20.6922 -19.7688 -19.7688 -18.7042 -18.7042 -18.6828 -18.6828 -18.6743 -18.6743 -18.1506 -18.1506 -18.1453 -18.1453 -5.5947 -5.5947 -5.5194 -5.5194 -4.9866 -4.9866 -4.8258 -4.8258 -4.7535 -4.7535 -4.5805 -4.5805 -4.2865 -4.2865 -1.9547 -1.9547 -1.8404 -1.8404 -1.7824 -1.7824 -0.4123 -0.4123 -0.3157 -0.3157 -0.0687 -0.0687 0.2502 0.2502 0.2756 0.2756 0.4555 0.4555 0.8448 0.8448 0.8986 0.8986 0.9699 0.9699 1.0388 1.0388 1.0695 1.0695 1.3875 1.3875 1.5217 1.5217 1.5599 1.5599 9.6386 9.6386 11.4665 11.4665 11.7425 11.7425 11.7855 11.7855 12.1972 12.1972 12.2538 12.2538 k = 0.1719 0.0992 0.6075 ( 5668 PWs) bands (ev): -20.7257 -20.7257 -20.6914 -20.6914 -19.7696 -19.7696 -18.7048 -18.7048 -18.6836 -18.6836 -18.6746 -18.6746 -18.1515 -18.1515 -18.1452 -18.1452 -5.5903 -5.5903 -5.5155 -5.5155 -4.9803 -4.9803 -4.8179 -4.8179 -4.7508 -4.7508 -4.5715 -4.5715 -4.2923 -4.2923 -1.9543 -1.9543 -1.8483 -1.8483 -1.7887 -1.7887 -0.4278 -0.4278 -0.3162 -0.3162 -0.0652 -0.0652 0.2470 0.2470 0.2773 0.2773 0.4628 0.4628 0.8383 0.8383 0.8863 0.8863 0.9637 0.9637 1.0356 1.0356 1.0704 1.0704 1.3832 1.3832 1.5158 1.5158 1.5584 1.5584 9.6538 9.6538 11.4965 11.4965 11.7622 11.7622 11.8068 11.8068 12.2126 12.2126 12.2844 12.2844 k = 0.1875 0.1083 0.6075 ( 5660 PWs) bands (ev): -20.7244 -20.7244 -20.6906 -20.6906 -19.7704 -19.7704 -18.7056 -18.7056 -18.6845 -18.6845 -18.6748 -18.6748 -18.1526 -18.1526 -18.1452 -18.1452 -5.5856 -5.5856 -5.5114 -5.5114 -4.9734 -4.9734 -4.8101 -4.8101 -4.7474 -4.7474 -4.5624 -4.5624 -4.2986 -4.2986 -1.9543 -1.9543 -1.8565 -1.8565 -1.7951 -1.7951 -0.4439 -0.4439 -0.3166 -0.3166 -0.0615 -0.0615 0.2435 0.2435 0.2792 0.2792 0.4702 0.4702 0.8312 0.8312 0.8729 0.8729 0.9576 0.9576 1.0321 1.0321 1.0716 1.0716 1.3786 1.3786 1.5096 1.5096 1.5571 1.5571 9.6700 9.6700 11.5276 11.5276 11.7852 11.7852 11.8305 11.8305 12.2271 12.2271 12.3162 12.3162 k = 0.2031 0.1173 0.6075 ( 5664 PWs) bands (ev): -20.7230 -20.7230 -20.6898 -20.6898 -19.7713 -19.7713 -18.7064 -18.7064 -18.6854 -18.6854 -18.6751 -18.6751 -18.1537 -18.1537 -18.1452 -18.1452 -5.5807 -5.5807 -5.5071 -5.5071 -4.9658 -4.9658 -4.8023 -4.8023 -4.7431 -4.7431 -4.5532 -4.5532 -4.3053 -4.3053 -1.9551 -1.9551 -1.8648 -1.8648 -1.8014 -1.8014 -0.4605 -0.4605 -0.3170 -0.3170 -0.0574 -0.0574 0.2399 0.2399 0.2812 0.2812 0.4773 0.4773 0.8236 0.8236 0.8585 0.8585 0.9515 0.9515 1.0285 1.0285 1.0730 1.0730 1.3738 1.3738 1.5030 1.5030 1.5558 1.5558 9.6871 9.6871 11.5594 11.5594 11.8115 11.8115 11.8565 11.8565 12.2406 12.2406 12.3486 12.3486 k = 0.2188 0.1263 0.6075 ( 5668 PWs) bands (ev): -20.7216 -20.7216 -20.6889 -20.6889 -19.7722 -19.7722 -18.7074 -18.7074 -18.6862 -18.6862 -18.6754 -18.6754 -18.1548 -18.1548 -18.1452 -18.1452 -5.5756 -5.5756 -5.5027 -5.5027 -4.9578 -4.9578 -4.7947 -4.7947 -4.7380 -4.7380 -4.5441 -4.5441 -4.3124 -4.3124 -1.9569 -1.9569 -1.8726 -1.8726 -1.8076 -1.8076 -0.4773 -0.4773 -0.3172 -0.3172 -0.0531 -0.0531 0.2361 0.2361 0.2835 0.2835 0.4843 0.4843 0.8156 0.8156 0.8433 0.8433 0.9456 0.9456 1.0248 1.0248 1.0746 1.0746 1.3687 1.3687 1.4961 1.4961 1.5545 1.5545 9.7048 9.7048 11.5916 11.5916 11.8410 11.8410 11.8848 11.8848 12.2530 12.2530 12.3814 12.3814 k = 0.2344 0.1353 0.6075 ( 5672 PWs) bands (ev): -20.7201 -20.7201 -20.6881 -20.6881 -19.7731 -19.7731 -18.7084 -18.7084 -18.6870 -18.6870 -18.6756 -18.6756 -18.1559 -18.1559 -18.1452 -18.1452 -5.5704 -5.5704 -5.4983 -5.4983 -4.9492 -4.9492 -4.7876 -4.7876 -4.7320 -4.7320 -4.5350 -4.5350 -4.3198 -4.3198 -1.9602 -1.9602 -1.8794 -1.8794 -1.8136 -1.8136 -0.4941 -0.4941 -0.3175 -0.3175 -0.0485 -0.0485 0.2322 0.2322 0.2859 0.2859 0.4909 0.4909 0.8071 0.8071 0.8275 0.8275 0.9399 0.9399 1.0210 1.0210 1.0764 1.0764 1.3635 1.3635 1.4891 1.4891 1.5534 1.5534 9.7232 9.7232 11.6240 11.6240 11.8732 11.8732 11.9151 11.9151 12.2645 12.2645 12.4140 12.4140 k = 0.2500 0.1443 0.6075 ( 5672 PWs) bands (ev): -20.7186 -20.7186 -20.6873 -20.6873 -19.7740 -19.7740 -18.7095 -18.7095 -18.6877 -18.6877 -18.6758 -18.6758 -18.1571 -18.1571 -18.1452 -18.1452 -5.5651 -5.5651 -5.4938 -5.4938 -4.9402 -4.9402 -4.7808 -4.7808 -4.7252 -4.7252 -4.5262 -4.5262 -4.3275 -4.3275 -1.9653 -1.9653 -1.8848 -1.8848 -1.8195 -1.8195 -0.5108 -0.5108 -0.3177 -0.3177 -0.0437 -0.0437 0.2283 0.2283 0.2885 0.2885 0.4972 0.4972 0.7980 0.7980 0.8116 0.8116 0.9343 0.9343 1.0172 1.0172 1.0784 1.0784 1.3581 1.3581 1.4821 1.4821 1.5522 1.5522 9.7419 9.7419 11.6566 11.6566 11.9076 11.9076 11.9474 11.9474 12.2753 12.2753 12.4461 12.4461 k = 0.2656 0.1534 0.6075 ( 5676 PWs) bands (ev): -20.7170 -20.7170 -20.6865 -20.6865 -19.7749 -19.7749 -18.7107 -18.7107 -18.6884 -18.6884 -18.6761 -18.6761 -18.1582 -18.1582 -18.1452 -18.1452 -5.5598 -5.5598 -5.4893 -5.4893 -4.9309 -4.9309 -4.7744 -4.7744 -4.7178 -4.7178 -4.5177 -4.5177 -4.3354 -4.3354 -1.9723 -1.9723 -1.8886 -1.8886 -1.8251 -1.8251 -0.5272 -0.5272 -0.3179 -0.3179 -0.0386 -0.0386 0.2244 0.2244 0.2912 0.2912 0.5029 0.5029 0.7878 0.7878 0.7962 0.7962 0.9289 0.9289 1.0134 1.0134 1.0805 1.0805 1.3527 1.3527 1.4751 1.4751 1.5512 1.5512 9.7609 9.7609 11.6892 11.6892 11.9433 11.9433 11.9815 11.9815 12.2857 12.2857 12.4771 12.4771 k = 0.2812 0.1624 0.6075 ( 5672 PWs) bands (ev): -20.7154 -20.7154 -20.6857 -20.6857 -19.7758 -19.7758 -18.7120 -18.7120 -18.6890 -18.6890 -18.6763 -18.6763 -18.1594 -18.1594 -18.1452 -18.1452 -5.5544 -5.5544 -5.4849 -5.4849 -4.9212 -4.9212 -4.7682 -4.7682 -4.7099 -4.7099 -4.5096 -4.5096 -4.3434 -4.3434 -1.9809 -1.9809 -1.8909 -1.8909 -1.8305 -1.8305 -0.5431 -0.5431 -0.3181 -0.3181 -0.0335 -0.0335 0.2205 0.2205 0.2941 0.2941 0.5082 0.5082 0.7745 0.7745 0.7837 0.7837 0.9237 0.9237 1.0097 1.0097 1.0827 1.0827 1.3472 1.3472 1.4681 1.4681 1.5502 1.5502 9.7799 9.7799 11.7219 11.7219 11.9793 11.9793 12.0171 12.0171 12.2965 12.2965 12.5067 12.5067 k = 0.2969 0.1714 0.6075 ( 5670 PWs) bands (ev): -20.7139 -20.7139 -20.6850 -20.6850 -19.7767 -19.7767 -18.7133 -18.7133 -18.6895 -18.6895 -18.6765 -18.6765 -18.1605 -18.1605 -18.1452 -18.1452 -5.5492 -5.5492 -5.4806 -5.4806 -4.9115 -4.9115 -4.7623 -4.7623 -4.7019 -4.7019 -4.5021 -4.5021 -4.3514 -4.3514 -1.9908 -1.9908 -1.8920 -1.8920 -1.8356 -1.8356 -0.5585 -0.5585 -0.3184 -0.3184 -0.0282 -0.0282 0.2166 0.2166 0.2971 0.2971 0.5128 0.5128 0.7589 0.7589 0.7737 0.7737 0.9188 0.9188 1.0060 1.0060 1.0850 1.0850 1.3417 1.3417 1.4613 1.4613 1.5493 1.5493 9.7988 9.7988 11.7546 11.7546 12.0143 12.0143 12.0541 12.0541 12.3083 12.3083 12.5342 12.5342 k = 0.3125 0.1804 0.6075 ( 5670 PWs) bands (ev): -20.7123 -20.7123 -20.6843 -20.6843 -19.7776 -19.7776 -18.7146 -18.7146 -18.6900 -18.6900 -18.6767 -18.6767 -18.1616 -18.1616 -18.1452 -18.1452 -5.5440 -5.5440 -5.4764 -5.4764 -4.9016 -4.9016 -4.7564 -4.7564 -4.6939 -4.6939 -4.4952 -4.4952 -4.3592 -4.3592 -2.0016 -2.0016 -1.8922 -1.8922 -1.8403 -1.8403 -0.5733 -0.5733 -0.3186 -0.3186 -0.0228 -0.0228 0.2129 0.2129 0.3001 0.3001 0.5168 0.5168 0.7429 0.7429 0.7644 0.7644 0.9141 0.9141 1.0025 1.0025 1.0874 1.0874 1.3363 1.3363 1.4548 1.4548 1.5484 1.5484 9.8174 9.8174 11.7874 11.7874 12.0466 12.0466 12.0922 12.0922 12.3221 12.3221 12.5593 12.5593 k = 0.3281 0.1894 0.6075 ( 5666 PWs) bands (ev): -20.7108 -20.7108 -20.6836 -20.6836 -19.7784 -19.7784 -18.7159 -18.7159 -18.6904 -18.6904 -18.6768 -18.6768 -18.1626 -18.1626 -18.1452 -18.1452 -5.5391 -5.5391 -5.4725 -5.4725 -4.8919 -4.8919 -4.7505 -4.7505 -4.6862 -4.6862 -4.4890 -4.4890 -4.3668 -4.3668 -2.0127 -2.0127 -1.8919 -1.8919 -1.8445 -1.8445 -0.5872 -0.5872 -0.3189 -0.3189 -0.0174 -0.0174 0.2093 0.2093 0.3032 0.3032 0.5201 0.5201 0.7274 0.7274 0.7555 0.7555 0.9097 0.9097 0.9992 0.9992 1.0899 1.0899 1.3310 1.3310 1.4485 1.4485 1.5476 1.5476 9.8355 9.8355 11.8201 11.8201 12.0748 12.0748 12.1313 12.1313 12.3386 12.3386 12.5814 12.5814 k = 0.3438 0.1985 0.6075 ( 5662 PWs) bands (ev): -20.7093 -20.7093 -20.6831 -20.6831 -19.7792 -19.7792 -18.7172 -18.7172 -18.6908 -18.6908 -18.6770 -18.6770 -18.1636 -18.1636 -18.1452 -18.1452 -5.5343 -5.5343 -5.4687 -5.4687 -4.8823 -4.8823 -4.7444 -4.7444 -4.6791 -4.6791 -4.4838 -4.4838 -4.3739 -4.3739 -2.0239 -2.0239 -1.8913 -1.8913 -1.8482 -1.8482 -0.6003 -0.6003 -0.3191 -0.3191 -0.0121 -0.0121 0.2059 0.2059 0.3063 0.3063 0.5227 0.5227 0.7126 0.7126 0.7469 0.7469 0.9056 0.9056 0.9961 0.9961 1.0923 1.0923 1.3258 1.3258 1.4426 1.4426 1.5468 1.5468 9.8529 9.8529 11.8525 11.8525 12.0976 12.0976 12.1714 12.1714 12.3584 12.3584 12.6002 12.6002 k = 0.3594 0.2075 0.6075 ( 5666 PWs) bands (ev): -20.7079 -20.7079 -20.6826 -20.6826 -19.7799 -19.7799 -18.7184 -18.7184 -18.6911 -18.6911 -18.6771 -18.6771 -18.1645 -18.1645 -18.1452 -18.1452 -5.5298 -5.5298 -5.4652 -5.4652 -4.8732 -4.8732 -4.7381 -4.7381 -4.6727 -4.6727 -4.4795 -4.4795 -4.3803 -4.3803 -2.0349 -2.0349 -1.8908 -1.8908 -1.8512 -1.8512 -0.6124 -0.6124 -0.3194 -0.3194 -0.0068 -0.0068 0.2027 0.2027 0.3094 0.3094 0.5244 0.5244 0.6988 0.6988 0.7387 0.7387 0.9019 0.9019 0.9932 0.9932 1.0946 1.0946 1.3209 1.3209 1.4371 1.4371 1.5462 1.5462 9.8694 9.8694 11.8844 11.8844 12.1147 12.1147 12.2121 12.2121 12.3811 12.3811 12.6152 12.6152 k = 0.3750 0.2165 0.6075 ( 5650 PWs) bands (ev): -20.7066 -20.7066 -20.6821 -20.6821 -19.7806 -19.7806 -18.7196 -18.7196 -18.6914 -18.6914 -18.6773 -18.6773 -18.1654 -18.1654 -18.1451 -18.1451 -5.5256 -5.5256 -5.4620 -5.4620 -4.8646 -4.8646 -4.7316 -4.7316 -4.6672 -4.6672 -4.4763 -4.4763 -4.3858 -4.3858 -2.0453 -2.0453 -1.8904 -1.8904 -1.8534 -1.8534 -0.6235 -0.6235 -0.3196 -0.3196 -0.0018 -0.0018 0.1998 0.1998 0.3123 0.3123 0.5254 0.5254 0.6863 0.6863 0.7311 0.7311 0.8985 0.8985 0.9905 0.9905 1.0969 1.0969 1.3163 1.3163 1.4320 1.4320 1.5455 1.5455 9.8848 9.8848 11.9155 11.9155 12.1265 12.1265 12.2531 12.2531 12.4059 12.4059 12.6260 12.6260 k = 0.3906 0.2255 0.6075 ( 5648 PWs) bands (ev): -20.7054 -20.7054 -20.6817 -20.6817 -19.7812 -19.7812 -18.7207 -18.7207 -18.6916 -18.6916 -18.6774 -18.6774 -18.1661 -18.1661 -18.1451 -18.1451 -5.5218 -5.5218 -5.4591 -5.4591 -4.8566 -4.8566 -4.7248 -4.7248 -4.6629 -4.6629 -4.4742 -4.4742 -4.3904 -4.3904 -2.0550 -2.0550 -1.8904 -1.8904 -1.8550 -1.8550 -0.6335 -0.6335 -0.3199 -0.3199 0.0030 0.0030 0.1972 0.1972 0.3151 0.3151 0.5256 0.5256 0.6752 0.6752 0.7240 0.7240 0.8954 0.8954 0.9881 0.9881 1.0991 1.0991 1.3121 1.3121 1.4275 1.4275 1.5450 1.5450 9.8989 9.8989 11.9455 11.9455 12.1336 12.1336 12.2941 12.2941 12.4313 12.4313 12.6323 12.6323 k = 0.4062 0.2345 0.6075 ( 5648 PWs) bands (ev): -20.7043 -20.7043 -20.6814 -20.6814 -19.7818 -19.7818 -18.7216 -18.7216 -18.6918 -18.6918 -18.6775 -18.6775 -18.1668 -18.1668 -18.1451 -18.1451 -5.5184 -5.5184 -5.4565 -5.4565 -4.8495 -4.8495 -4.7178 -4.7178 -4.6598 -4.6598 -4.4732 -4.4732 -4.3939 -4.3939 -2.0638 -2.0638 -1.8907 -1.8907 -1.8559 -1.8559 -0.6423 -0.6423 -0.3201 -0.3201 0.0074 0.0074 0.1949 0.1949 0.3177 0.3177 0.5250 0.5250 0.6657 0.6657 0.7176 0.7176 0.8927 0.8927 0.9860 0.9860 1.1011 1.1011 1.3082 1.3082 1.4234 1.4234 1.5445 1.5445 9.9116 9.9116 11.9740 11.9740 12.1371 12.1371 12.3345 12.3345 12.4559 12.4559 12.6341 12.6341 k = 0.4219 0.2436 0.6075 ( 5644 PWs) bands (ev): -20.7033 -20.7033 -20.6811 -20.6811 -19.7823 -19.7823 -18.7225 -18.7225 -18.6919 -18.6919 -18.6776 -18.6776 -18.1674 -18.1674 -18.1451 -18.1451 -5.5155 -5.5155 -5.4543 -5.4543 -4.8434 -4.8434 -4.7106 -4.7106 -4.6582 -4.6582 -4.4731 -4.4731 -4.3963 -4.3963 -2.0715 -2.0715 -1.8913 -1.8913 -1.8563 -1.8563 -0.6498 -0.6498 -0.3203 -0.3203 0.0113 0.0113 0.1930 0.1930 0.3200 0.3200 0.5240 0.5240 0.6579 0.6579 0.7120 0.7120 0.8904 0.8904 0.9842 0.9842 1.1028 1.1028 1.3049 1.3049 1.4200 1.4200 1.5441 1.5441 9.9226 9.9226 12.0004 12.0004 12.1378 12.1378 12.3741 12.3741 12.4784 12.4784 12.6310 12.6310 k = 0.4375 0.2526 0.6075 ( 5652 PWs) bands (ev): -20.7025 -20.7025 -20.6809 -20.6809 -19.7827 -19.7827 -18.7232 -18.7232 -18.6921 -18.6921 -18.6777 -18.6777 -18.1679 -18.1679 -18.1451 -18.1451 -5.5130 -5.5130 -5.4525 -5.4525 -4.8383 -4.8383 -4.7033 -4.7033 -4.6579 -4.6579 -4.4735 -4.4735 -4.3979 -4.3979 -2.0779 -2.0779 -1.8920 -1.8920 -1.8563 -1.8563 -0.6561 -0.6561 -0.3205 -0.3205 0.0147 0.0147 0.1914 0.1914 0.3220 0.3220 0.5226 0.5226 0.6517 0.6517 0.7073 0.7073 0.8885 0.8885 0.9827 0.9827 1.1044 1.1044 1.3020 1.3020 1.4171 1.4171 1.5438 1.5438 9.9318 9.9318 12.0245 12.0245 12.1362 12.1362 12.4124 12.4124 12.4979 12.4979 12.6233 12.6233 k = 0.4531 0.2616 0.6075 ( 5652 PWs) bands (ev): -20.7018 -20.7018 -20.6808 -20.6808 -19.7830 -19.7830 -18.7237 -18.7237 -18.6922 -18.6922 -18.6777 -18.6777 -18.1683 -18.1683 -18.1451 -18.1451 -5.5111 -5.5111 -5.4510 -5.4510 -4.8343 -4.8343 -4.6962 -4.6962 -4.6590 -4.6590 -4.4743 -4.4743 -4.3988 -4.3988 -2.0831 -2.0831 -1.8927 -1.8927 -1.8561 -1.8561 -0.6610 -0.6610 -0.3206 -0.3206 0.0174 0.0174 0.1901 0.1901 0.3236 0.3236 0.5211 0.5211 0.6470 0.6470 0.7036 0.7036 0.8871 0.8871 0.9815 0.9815 1.1056 1.1056 1.2997 1.2997 1.4148 1.4148 1.5435 1.5435 9.9391 9.9391 12.0456 12.0456 12.1329 12.1329 12.4487 12.4487 12.5135 12.5135 12.6110 12.6110 k = 0.4688 0.2706 0.6075 ( 5644 PWs) bands (ev): -20.7013 -20.7013 -20.6807 -20.6807 -19.7832 -19.7832 -18.7241 -18.7241 -18.6922 -18.6922 -18.6778 -18.6778 -18.1686 -18.1686 -18.1451 -18.1451 -5.5097 -5.5097 -5.4500 -5.4500 -4.8314 -4.8314 -4.6896 -4.6896 -4.6611 -4.6611 -4.4750 -4.4750 -4.3993 -4.3993 -2.0868 -2.0868 -1.8933 -1.8933 -1.8559 -1.8559 -0.6645 -0.6645 -0.3207 -0.3207 0.0194 0.0194 0.1893 0.1893 0.3248 0.3248 0.5199 0.5199 0.6438 0.6438 0.7008 0.7008 0.8860 0.8860 0.9807 0.9807 1.1065 1.1065 1.2981 1.2981 1.4132 1.4132 1.5433 1.5433 9.9444 9.9444 12.0630 12.0630 12.1283 12.1283 12.4826 12.4826 12.5249 12.5249 12.5945 12.5945 k = 0.4844 0.2797 0.6075 ( 5652 PWs) bands (ev): -20.7011 -20.7011 -20.6806 -20.6806 -19.7833 -19.7833 -18.7244 -18.7244 -18.6923 -18.6923 -18.6778 -18.6778 -18.1687 -18.1687 -18.1451 -18.1451 -5.5088 -5.5088 -5.4494 -5.4494 -4.8296 -4.8296 -4.6843 -4.6843 -4.6637 -4.6637 -4.4755 -4.4755 -4.3995 -4.3995 -2.0891 -2.0891 -1.8936 -1.8936 -1.8557 -1.8557 -0.6666 -0.6666 -0.3208 -0.3208 0.0206 0.0206 0.1887 0.1887 0.3255 0.3255 0.5190 0.5190 0.6419 0.6419 0.6992 0.6992 0.8853 0.8853 0.9802 0.9802 1.1070 1.1070 1.2971 1.2971 1.4122 1.4122 1.5432 1.5432 9.9476 9.9476 12.0756 12.0756 12.1235 12.1235 12.5127 12.5127 12.5317 12.5317 12.5750 12.5750 k = 0.5000 0.2887 0.6075 ( 5644 PWs) bands (ev): -20.7010 -20.7010 -20.6806 -20.6806 -19.7834 -19.7834 -18.7245 -18.7245 -18.6923 -18.6923 -18.6778 -18.6778 -18.1688 -18.1688 -18.1451 -18.1451 -5.5085 -5.5085 -5.4492 -5.4492 -4.8290 -4.8290 -4.6821 -4.6821 -4.6651 -4.6651 -4.4757 -4.4757 -4.3996 -4.3996 -2.0899 -2.0899 -1.8938 -1.8938 -1.8557 -1.8557 -0.6673 -0.6673 -0.3208 -0.3208 0.0210 0.0210 0.1886 0.1886 0.3257 0.3257 0.5187 0.5187 0.6413 0.6413 0.6986 0.6986 0.8851 0.8851 0.9800 0.9800 1.1072 1.1072 1.2967 1.2967 1.4119 1.4119 1.5432 1.5432 9.9487 9.9487 12.0805 12.0805 12.1212 12.1212 12.5321 12.5321 12.5322 12.5322 12.5610 12.5610 k = 0.5000 0.2887 0.6075 ( 5644 PWs) bands (ev): -20.7010 -20.7010 -20.6806 -20.6806 -19.7834 -19.7834 -18.7245 -18.7245 -18.6923 -18.6923 -18.6778 -18.6778 -18.1688 -18.1688 -18.1451 -18.1451 -5.5085 -5.5085 -5.4492 -5.4492 -4.8290 -4.8290 -4.6821 -4.6821 -4.6651 -4.6651 -4.4757 -4.4757 -4.3996 -4.3996 -2.0899 -2.0899 -1.8938 -1.8938 -1.8557 -1.8557 -0.6673 -0.6673 -0.3208 -0.3208 0.0210 0.0210 0.1886 0.1886 0.3257 0.3257 0.5187 0.5187 0.6413 0.6413 0.6986 0.6986 0.8851 0.8851 0.9800 0.9800 1.1072 1.1072 1.2967 1.2967 1.4119 1.4119 1.5432 1.5432 9.9487 9.9487 12.0805 12.0805 12.1212 12.1212 12.5321 12.5321 12.5322 12.5322 12.5610 12.5610 k = 0.4907 0.3047 0.6075 ( 5652 PWs) bands (ev): -20.7009 -20.7009 -20.6806 -20.6806 -19.7834 -19.7834 -18.7244 -18.7244 -18.6923 -18.6923 -18.6779 -18.6779 -18.1688 -18.1688 -18.1451 -18.1451 -5.5083 -5.5083 -5.4492 -5.4492 -4.8286 -4.8286 -4.6829 -4.6829 -4.6639 -4.6639 -4.4759 -4.4759 -4.3999 -4.3999 -2.0896 -2.0896 -1.8942 -1.8942 -1.8559 -1.8559 -0.6667 -0.6667 -0.3216 -0.3216 0.0210 0.0210 0.1888 0.1888 0.3254 0.3254 0.5191 0.5191 0.6415 0.6415 0.6986 0.6986 0.8844 0.8844 0.9802 0.9802 1.1068 1.1068 1.2967 1.2967 1.4121 1.4121 1.5428 1.5428 9.9492 9.9492 12.0810 12.0810 12.1216 12.1216 12.5196 12.5196 12.5456 12.5456 12.5627 12.5627 k = 0.4815 0.3208 0.6075 ( 5648 PWs) bands (ev): -20.7007 -20.7007 -20.6807 -20.6807 -19.7834 -19.7834 -18.7242 -18.7242 -18.6925 -18.6925 -18.6781 -18.6781 -18.1686 -18.1686 -18.1453 -18.1453 -5.5077 -5.5077 -5.4492 -5.4492 -4.8271 -4.8271 -4.6850 -4.6850 -4.6611 -4.6611 -4.4764 -4.4764 -4.4007 -4.4007 -2.0887 -2.0887 -1.8955 -1.8955 -1.8564 -1.8564 -0.6649 -0.6649 -0.3239 -0.3239 0.0210 0.0210 0.1897 0.1897 0.3242 0.3242 0.5201 0.5201 0.6419 0.6419 0.6987 0.6987 0.8823 0.8823 0.9807 0.9807 1.1057 1.1057 1.2967 1.2967 1.4128 1.4128 1.5418 1.5418 9.9508 9.9508 12.0826 12.0826 12.1228 12.1228 12.5086 12.5086 12.5582 12.5582 12.5691 12.5691 k = 0.4722 0.3368 0.6075 ( 5636 PWs) bands (ev): -20.7004 -20.7004 -20.6808 -20.6808 -19.7835 -19.7835 -18.7238 -18.7238 -18.6927 -18.6927 -18.6785 -18.6785 -18.1684 -18.1684 -18.1456 -18.1456 -5.5067 -5.5067 -5.4492 -5.4492 -4.8248 -4.8248 -4.6875 -4.6875 -4.6572 -4.6572 -4.4773 -4.4773 -4.4019 -4.4019 -2.0872 -2.0872 -1.8977 -1.8977 -1.8573 -1.8573 -0.6620 -0.6620 -0.3277 -0.3277 0.0210 0.0210 0.1910 0.1910 0.3224 0.3224 0.5218 0.5218 0.6427 0.6427 0.6987 0.6987 0.8788 0.8788 0.9815 0.9815 1.1039 1.1039 1.2968 1.2968 1.4139 1.4139 1.5402 1.5402 9.9534 9.9534 12.0852 12.0852 12.1246 12.1246 12.4991 12.4991 12.5676 12.5676 12.5826 12.5826 k = 0.4630 0.3528 0.6075 ( 5640 PWs) bands (ev): -20.7001 -20.7001 -20.6809 -20.6809 -19.7836 -19.7836 -18.7233 -18.7233 -18.6930 -18.6930 -18.6790 -18.6790 -18.1681 -18.1681 -18.1459 -18.1459 -5.5054 -5.5054 -5.4493 -5.4493 -4.8215 -4.8215 -4.6901 -4.6901 -4.6528 -4.6528 -4.4787 -4.4787 -4.4036 -4.4036 -2.0852 -2.0852 -1.9009 -1.9009 -1.8584 -1.8584 -0.6579 -0.6579 -0.3329 -0.3329 0.0209 0.0209 0.1928 0.1928 0.3199 0.3199 0.5241 0.5241 0.6437 0.6437 0.6988 0.6988 0.8739 0.8739 0.9826 0.9826 1.1013 1.1013 1.2968 1.2968 1.4155 1.4155 1.5379 1.5379 9.9570 9.9570 12.0887 12.0887 12.1270 12.1270 12.4912 12.4912 12.5769 12.5769 12.5998 12.5998 k = 0.4537 0.3689 0.6075 ( 5636 PWs) bands (ev): -20.6996 -20.6996 -20.6811 -20.6811 -19.7837 -19.7837 -18.7227 -18.7227 -18.6934 -18.6934 -18.6797 -18.6797 -18.1676 -18.1676 -18.1464 -18.1464 -5.5037 -5.5037 -5.4493 -5.4493 -4.8174 -4.8174 -4.6925 -4.6925 -4.6480 -4.6480 -4.4804 -4.4804 -4.4057 -4.4057 -2.0827 -2.0827 -1.9050 -1.9050 -1.8597 -1.8597 -0.6527 -0.6527 -0.3396 -0.3396 0.0208 0.0208 0.1952 0.1952 0.3168 0.3168 0.5269 0.5269 0.6452 0.6452 0.6990 0.6990 0.8677 0.8677 0.9841 0.9841 1.0981 1.0981 1.2968 1.2968 1.4175 1.4175 1.5350 1.5350 9.9614 9.9614 12.0931 12.0931 12.1296 12.1296 12.4850 12.4850 12.5884 12.5884 12.6185 12.6185 k = 0.4444 0.3849 0.6075 ( 5638 PWs) bands (ev): -20.6990 -20.6990 -20.6813 -20.6813 -19.7838 -19.7838 -18.7219 -18.7219 -18.6939 -18.6939 -18.6805 -18.6805 -18.1671 -18.1671 -18.1469 -18.1469 -5.5017 -5.5017 -5.4495 -5.4495 -4.8125 -4.8125 -4.6948 -4.6948 -4.6430 -4.6430 -4.4827 -4.4827 -4.4080 -4.4080 -2.0796 -2.0796 -1.9101 -1.9101 -1.8609 -1.8609 -0.6464 -0.6464 -0.3477 -0.3477 0.0208 0.0208 0.1980 0.1980 0.3132 0.3132 0.5300 0.5300 0.6470 0.6470 0.6991 0.6991 0.8603 0.8603 0.9859 0.9859 1.0944 1.0944 1.2968 1.2968 1.4199 1.4199 1.5315 1.5315 9.9666 9.9666 12.0983 12.0983 12.1323 12.1323 12.4804 12.4804 12.6024 12.6024 12.6382 12.6382 k = 0.4352 0.4009 0.6075 ( 5642 PWs) bands (ev): -20.6983 -20.6983 -20.6815 -20.6815 -19.7839 -19.7839 -18.7211 -18.7211 -18.6945 -18.6945 -18.6814 -18.6814 -18.1666 -18.1666 -18.1476 -18.1476 -5.4994 -5.4994 -5.4496 -5.4496 -4.8069 -4.8069 -4.6968 -4.6968 -4.6379 -4.6379 -4.4856 -4.4856 -4.4104 -4.4104 -2.0760 -2.0760 -1.9161 -1.9161 -1.8622 -1.8622 -0.6391 -0.6391 -0.3570 -0.3570 0.0207 0.0207 0.2013 0.2013 0.3091 0.3091 0.5333 0.5333 0.6493 0.6493 0.6993 0.6993 0.8517 0.8517 0.9880 0.9880 1.0901 1.0901 1.2968 1.2968 1.4226 1.4226 1.5276 1.5276 9.9724 9.9724 12.1042 12.1042 12.1350 12.1350 12.4774 12.4774 12.6192 12.6192 12.6585 12.6585 k = 0.4259 0.4170 0.6075 ( 5654 PWs) bands (ev): -20.6975 -20.6975 -20.6818 -20.6818 -19.7841 -19.7841 -18.7201 -18.7201 -18.6950 -18.6950 -18.6824 -18.6824 -18.1659 -18.1659 -18.1483 -18.1483 -5.4968 -5.4968 -5.4498 -5.4498 -4.8008 -4.8008 -4.6984 -4.6984 -4.6327 -4.6327 -4.4891 -4.4891 -4.4127 -4.4127 -2.0719 -2.0719 -1.9229 -1.9229 -1.8634 -1.8634 -0.6308 -0.6308 -0.3676 -0.3676 0.0207 0.0207 0.2049 0.2049 0.3047 0.3047 0.5368 0.5368 0.6522 0.6522 0.6996 0.6996 0.8421 0.8421 0.9904 0.9904 1.0854 1.0854 1.2968 1.2968 1.4256 1.4256 1.5232 1.5232 9.9787 9.9787 12.1108 12.1108 12.1374 12.1374 12.4759 12.4759 12.6385 12.6385 12.6792 12.6792 k = 0.4167 0.4330 0.6075 ( 5658 PWs) bands (ev): -20.6967 -20.6967 -20.6822 -20.6822 -19.7842 -19.7842 -18.7191 -18.7191 -18.6956 -18.6956 -18.6834 -18.6834 -18.1652 -18.1652 -18.1491 -18.1491 -5.4941 -5.4941 -5.4501 -5.4501 -4.7942 -4.7942 -4.6998 -4.6998 -4.6274 -4.6274 -4.4933 -4.4933 -4.4150 -4.4150 -2.0674 -2.0674 -1.9305 -1.9305 -1.8644 -1.8644 -0.6216 -0.6216 -0.3792 -0.3792 0.0206 0.0206 0.2089 0.2089 0.3000 0.3000 0.5402 0.5402 0.6557 0.6557 0.6999 0.6999 0.8316 0.8316 0.9931 0.9931 1.0803 1.0803 1.2967 1.2967 1.4289 1.4289 1.5185 1.5185 9.9852 9.9852 12.1177 12.1177 12.1396 12.1396 12.4757 12.4757 12.6603 12.6603 12.7001 12.7001 k = 0.4074 0.4491 0.6075 ( 5660 PWs) bands (ev): -20.6958 -20.6958 -20.6825 -20.6825 -19.7844 -19.7844 -18.7181 -18.7181 -18.6962 -18.6962 -18.6846 -18.6846 -18.1645 -18.1645 -18.1499 -18.1499 -5.4913 -5.4913 -5.4505 -5.4505 -4.7873 -4.7873 -4.7009 -4.7009 -4.6221 -4.6221 -4.4982 -4.4982 -4.4170 -4.4170 -2.0625 -2.0625 -1.9386 -1.9386 -1.8654 -1.8654 -0.6115 -0.6115 -0.3917 -0.3917 0.0206 0.0206 0.2132 0.2132 0.2951 0.2951 0.5434 0.5434 0.6598 0.6598 0.7003 0.7003 0.8203 0.8203 0.9961 0.9961 1.0750 1.0750 1.2967 1.2967 1.4325 1.4325 1.5134 1.5134 9.9919 9.9919 12.1248 12.1248 12.1414 12.1414 12.4766 12.4766 12.6841 12.6841 12.7208 12.7208 k = 0.3981 0.4651 0.6075 ( 5656 PWs) bands (ev): -20.6949 -20.6949 -20.6830 -20.6830 -19.7845 -19.7845 -18.7170 -18.7170 -18.6968 -18.6968 -18.6857 -18.6857 -18.1637 -18.1637 -18.1508 -18.1508 -5.4884 -5.4884 -5.4509 -5.4509 -4.7804 -4.7804 -4.7016 -4.7016 -4.6169 -4.6169 -4.5037 -4.5037 -4.4187 -4.4187 -2.0573 -2.0573 -1.9472 -1.9472 -1.8662 -1.8662 -0.6006 -0.6006 -0.4050 -0.4050 0.0207 0.0207 0.2178 0.2178 0.2900 0.2900 0.5463 0.5463 0.6645 0.6645 0.7008 0.7008 0.8085 0.8085 0.9993 0.9993 1.0695 1.0695 1.2966 1.2966 1.4363 1.4363 1.5081 1.5081 9.9985 9.9985 12.1319 12.1319 12.1430 12.1430 12.4785 12.4785 12.7094 12.7094 12.7411 12.7411 k = 0.3889 0.4811 0.6075 ( 5660 PWs) bands (ev): -20.6939 -20.6939 -20.6835 -20.6835 -19.7847 -19.7847 -18.7159 -18.7159 -18.6972 -18.6972 -18.6869 -18.6869 -18.1629 -18.1629 -18.1517 -18.1517 -5.4856 -5.4856 -5.4514 -5.4514 -4.7737 -4.7737 -4.7020 -4.7020 -4.6118 -4.6118 -4.5098 -4.5098 -4.4200 -4.4200 -2.0517 -2.0517 -1.9560 -1.9560 -1.8669 -1.8669 -0.5890 -0.5890 -0.4190 -0.4190 0.0207 0.0207 0.2226 0.2226 0.2848 0.2848 0.5489 0.5489 0.6700 0.6700 0.7013 0.7013 0.7961 0.7961 1.0027 1.0027 1.0640 1.0640 1.2966 1.2966 1.4402 1.4402 1.5028 1.5028 10.0049 10.0049 12.1385 12.1385 12.1446 12.1446 12.4812 12.4812 12.7353 12.7353 12.7606 12.7606 k = 0.3796 0.4972 0.6075 ( 5648 PWs) bands (ev): -20.6929 -20.6929 -20.6840 -20.6840 -19.7848 -19.7848 -18.7150 -18.7150 -18.6976 -18.6976 -18.6881 -18.6881 -18.1620 -18.1620 -18.1527 -18.1527 -5.4828 -5.4828 -5.4520 -5.4520 -4.7674 -4.7674 -4.7019 -4.7019 -4.6068 -4.6068 -4.5163 -4.5163 -4.4210 -4.4210 -2.0460 -2.0460 -1.9649 -1.9649 -1.8675 -1.8675 -0.5769 -0.5769 -0.4334 -0.4334 0.0208 0.0208 0.2275 0.2275 0.2796 0.2796 0.5511 0.5511 0.6760 0.6760 0.7021 0.7021 0.7836 0.7836 1.0063 1.0063 1.0585 1.0585 1.2965 1.2965 1.4442 1.4442 1.4974 1.4974 10.0107 10.0107 12.1439 12.1439 12.1468 12.1468 12.4843 12.4843 12.7608 12.7608 12.7789 12.7789 k = 0.3704 0.5132 0.6075 ( 5644 PWs) bands (ev): -20.6918 -20.6918 -20.6847 -20.6847 -19.7849 -19.7849 -18.7141 -18.7141 -18.6978 -18.6978 -18.6892 -18.6892 -18.1611 -18.1611 -18.1537 -18.1537 -5.4803 -5.4803 -5.4526 -5.4526 -4.7619 -4.7619 -4.7015 -4.7015 -4.6020 -4.6020 -4.5229 -4.5229 -4.4217 -4.4217 -2.0401 -2.0401 -1.9736 -1.9736 -1.8679 -1.8679 -0.5643 -0.5643 -0.4481 -0.4481 0.0209 0.0209 0.2324 0.2324 0.2745 0.2745 0.5529 0.5529 0.6826 0.6826 0.7030 0.7030 0.7711 0.7711 1.0100 1.0100 1.0532 1.0532 1.2964 1.2964 1.4482 1.4482 1.4921 1.4921 10.0159 10.0159 12.1463 12.1463 12.1511 12.1511 12.4877 12.4877 12.7846 12.7846 12.7959 12.7959 k = 0.3611 0.5292 0.6075 ( 5652 PWs) bands (ev): -20.6908 -20.6908 -20.6854 -20.6854 -19.7851 -19.7851 -18.7135 -18.7135 -18.6979 -18.6979 -18.6902 -18.6902 -18.1602 -18.1602 -18.1546 -18.1546 -5.4780 -5.4780 -5.4532 -5.4532 -4.7573 -4.7573 -4.7008 -4.7008 -4.5976 -4.5976 -4.5292 -4.5292 -4.4221 -4.4221 -2.0343 -2.0343 -1.9818 -1.9818 -1.8683 -1.8683 -0.5514 -0.5514 -0.4628 -0.4628 0.0211 0.0211 0.2373 0.2373 0.2695 0.2695 0.5542 0.5542 0.6893 0.6893 0.7041 0.7041 0.7589 0.7589 1.0136 1.0136 1.0482 1.0482 1.2963 1.2963 1.4520 1.4520 1.4872 1.4872 10.0203 10.0203 12.1481 12.1481 12.1551 12.1551 12.4908 12.4908 12.8044 12.8044 12.8114 12.8114 k = 0.3519 0.5453 0.6075 ( 5660 PWs) bands (ev): -20.6898 -20.6898 -20.6861 -20.6861 -19.7851 -19.7851 -18.7130 -18.7130 -18.6978 -18.6978 -18.6911 -18.6911 -18.1593 -18.1593 -18.1556 -18.1556 -5.4763 -5.4763 -5.4537 -5.4537 -4.7540 -4.7540 -4.6999 -4.6999 -4.5938 -4.5938 -4.5347 -4.5347 -4.4223 -4.4223 -2.0289 -2.0289 -1.9890 -1.9890 -1.8685 -1.8685 -0.5385 -0.5385 -0.4770 -0.4770 0.0212 0.0212 0.2419 0.2419 0.2648 0.2648 0.5551 0.5551 0.6957 0.6957 0.7058 0.7058 0.7477 0.7477 1.0169 1.0169 1.0439 1.0439 1.2962 1.2962 1.4556 1.4556 1.4828 1.4828 10.0235 10.0235 12.1500 12.1500 12.1575 12.1575 12.4935 12.4935 12.8185 12.8185 12.8253 12.8253 k = 0.3426 0.5613 0.6075 ( 5668 PWs) bands (ev): -20.6888 -20.6888 -20.6869 -20.6869 -19.7852 -19.7852 -18.7128 -18.7128 -18.6976 -18.6976 -18.6917 -18.6917 -18.1584 -18.1584 -18.1566 -18.1566 -5.4751 -5.4751 -5.4541 -5.4541 -4.7520 -4.7520 -4.6992 -4.6992 -4.5912 -4.5912 -4.5386 -4.5386 -4.4224 -4.4224 -2.0247 -2.0247 -1.9944 -1.9944 -1.8687 -1.8687 -0.5265 -0.5265 -0.4899 -0.4899 0.0213 0.0213 0.2457 0.2457 0.2608 0.2608 0.5556 0.5556 0.7005 0.7005 0.7079 0.7079 0.7387 0.7387 1.0195 1.0195 1.0408 1.0408 1.2962 1.2962 1.4582 1.4582 1.4796 1.4796 10.0256 10.0256 12.1523 12.1523 12.1581 12.1581 12.4954 12.4954 12.8274 12.8274 12.8345 12.8345 k = 0.3333 0.5774 0.6075 ( 5688 PWs) bands (ev): -20.6879 -20.6879 -20.6878 -20.6878 -19.7852 -19.7852 -18.7127 -18.7127 -18.6975 -18.6975 -18.6919 -18.6919 -18.1575 -18.1575 -18.1575 -18.1575 -5.4747 -5.4747 -5.4542 -5.4542 -4.7513 -4.7513 -4.6988 -4.6988 -4.5902 -4.5902 -4.5401 -4.5401 -4.4224 -4.4224 -2.0231 -2.0231 -1.9965 -1.9965 -1.8687 -1.8687 -0.5200 -0.5200 -0.4968 -0.4968 0.0213 0.0213 0.2475 0.2475 0.2591 0.2591 0.5558 0.5558 0.7024 0.7024 0.7091 0.7091 0.7349 0.7349 1.0205 1.0205 1.0396 1.0396 1.2961 1.2961 1.4592 1.4592 1.4784 1.4784 10.0263 10.0263 12.1541 12.1541 12.1573 12.1573 12.4961 12.4961 12.8312 12.8312 12.8371 12.8371 k = 0.3333 0.5774 0.6075 ( 5688 PWs) bands (ev): -20.6879 -20.6879 -20.6878 -20.6878 -19.7852 -19.7852 -18.7127 -18.7127 -18.6975 -18.6975 -18.6919 -18.6919 -18.1575 -18.1575 -18.1575 -18.1575 -5.4747 -5.4747 -5.4542 -5.4542 -4.7513 -4.7513 -4.6988 -4.6988 -4.5902 -4.5902 -4.5401 -4.5401 -4.4224 -4.4224 -2.0231 -2.0231 -1.9965 -1.9965 -1.8687 -1.8687 -0.5200 -0.5200 -0.4968 -0.4968 0.0213 0.0213 0.2475 0.2475 0.2591 0.2591 0.5558 0.5558 0.7024 0.7024 0.7091 0.7091 0.7349 0.7349 1.0205 1.0205 1.0396 1.0396 1.2961 1.2961 1.4592 1.4592 1.4784 1.4784 10.0263 10.0263 12.1541 12.1541 12.1573 12.1573 12.4961 12.4961 12.8312 12.8312 12.8371 12.8371 k = 0.3241 0.5613 0.6075 ( 5664 PWs) bands (ev): -20.6888 -20.6888 -20.6869 -20.6869 -19.7852 -19.7852 -18.7128 -18.7128 -18.6976 -18.6976 -18.6917 -18.6917 -18.1584 -18.1584 -18.1566 -18.1566 -5.4751 -5.4751 -5.4541 -5.4541 -4.7520 -4.7520 -4.6993 -4.6993 -4.5912 -4.5912 -4.5386 -4.5386 -4.4224 -4.4224 -2.0246 -2.0246 -1.9946 -1.9946 -1.8687 -1.8687 -0.5262 -0.5262 -0.4901 -0.4901 0.0213 0.0213 0.2459 0.2459 0.2607 0.2607 0.5556 0.5556 0.6996 0.6996 0.7093 0.7093 0.7382 0.7382 1.0196 1.0196 1.0407 1.0407 1.2962 1.2962 1.4583 1.4583 1.4795 1.4795 10.0256 10.0256 12.1508 12.1508 12.1595 12.1595 12.4953 12.4953 12.8253 12.8253 12.8364 12.8364 k = 0.3148 0.5453 0.6075 ( 5660 PWs) bands (ev): -20.6899 -20.6899 -20.6861 -20.6861 -19.7851 -19.7851 -18.7129 -18.7129 -18.6979 -18.6979 -18.6910 -18.6910 -18.1592 -18.1592 -18.1557 -18.1557 -5.4763 -5.4763 -5.4538 -5.4538 -4.7539 -4.7539 -4.7008 -4.7008 -4.5936 -4.5936 -4.5345 -4.5345 -4.4225 -4.4225 -2.0278 -2.0278 -1.9899 -1.9899 -1.8686 -1.8686 -0.5372 -0.5372 -0.4781 -0.4781 0.0211 0.0211 0.2426 0.2426 0.2640 0.2640 0.5552 0.5552 0.6930 0.6930 0.7109 0.7109 0.7456 0.7456 1.0174 1.0174 1.0434 1.0434 1.2963 1.2963 1.4562 1.4562 1.4823 1.4823 10.0232 10.0232 12.1436 12.1436 12.1633 12.1633 12.4926 12.4926 12.8086 12.8086 12.8335 12.8335 k = 0.3056 0.5292 0.6075 ( 5660 PWs) bands (ev): -20.6910 -20.6910 -20.6853 -20.6853 -19.7850 -19.7850 -18.7131 -18.7131 -18.6983 -18.6983 -18.6900 -18.6900 -18.1599 -18.1599 -18.1549 -18.1549 -5.4783 -5.4783 -5.4534 -5.4534 -4.7570 -4.7570 -4.7034 -4.7034 -4.5969 -4.5969 -4.5284 -4.5284 -4.4226 -4.4226 -2.0312 -2.0312 -1.9840 -1.9840 -1.8684 -1.8684 -0.5483 -0.5483 -0.4651 -0.4651 0.0207 0.0207 0.2390 0.2390 0.2675 0.2675 0.5545 0.5545 0.6860 0.6860 0.7132 0.7132 0.7546 0.7546 1.0148 1.0148 1.0469 1.0469 1.2966 1.2966 1.4537 1.4537 1.4859 1.4859 10.0193 10.0193 12.1334 12.1334 12.1677 12.1677 12.4877 12.4877 12.7828 12.7828 12.8274 12.8274 k = 0.2963 0.5132 0.6075 ( 5656 PWs) bands (ev): -20.6922 -20.6922 -20.6846 -20.6846 -19.7848 -19.7848 -18.7133 -18.7133 -18.6987 -18.6987 -18.6889 -18.6889 -18.1606 -18.1606 -18.1541 -18.1541 -5.4808 -5.4808 -5.4531 -5.4531 -4.7615 -4.7615 -4.7071 -4.7071 -4.6006 -4.6006 -4.5210 -4.5210 -4.4227 -4.4227 -2.0341 -2.0341 -1.9775 -1.9775 -1.8682 -1.8682 -0.5586 -0.5586 -0.4521 -0.4521 0.0200 0.0200 0.2355 0.2355 0.2710 0.2710 0.5536 0.5536 0.6797 0.6797 0.7160 0.7160 0.7643 0.7643 1.0123 1.0123 1.0507 1.0507 1.2970 1.2970 1.4513 1.4513 1.4899 1.4899 10.0136 10.0136 12.1201 12.1201 12.1726 12.1726 12.4803 12.4803 12.7497 12.7497 12.8183 12.8183 k = 0.2870 0.4972 0.6075 ( 5648 PWs) bands (ev): -20.6934 -20.6934 -20.6840 -20.6840 -19.7846 -19.7846 -18.7135 -18.7135 -18.6991 -18.6991 -18.6877 -18.6877 -18.1611 -18.1611 -18.1533 -18.1533 -5.4839 -5.4839 -5.4530 -5.4530 -4.7672 -4.7672 -4.7116 -4.7116 -4.6045 -4.6045 -4.5129 -4.5129 -4.4229 -4.4229 -2.0361 -2.0361 -1.9708 -1.9708 -1.8679 -1.8679 -0.5677 -0.5677 -0.4394 -0.4394 0.0191 0.0191 0.2323 0.2323 0.2741 0.2741 0.5524 0.5524 0.6747 0.6747 0.7192 0.7192 0.7744 0.7744 1.0101 1.0101 1.0545 1.0545 1.2977 1.2977 1.4493 1.4493 1.4941 1.4941 10.0062 10.0062 12.1041 12.1041 12.1776 12.1776 12.4700 12.4700 12.7107 12.7107 12.8063 12.8063 k = 0.2778 0.4811 0.6075 ( 5652 PWs) bands (ev): -20.6948 -20.6948 -20.6835 -20.6835 -19.7843 -19.7843 -18.7136 -18.7136 -18.6993 -18.6993 -18.6864 -18.6864 -18.1616 -18.1616 -18.1525 -18.1525 -5.4874 -5.4874 -5.4532 -5.4532 -4.7744 -4.7744 -4.7165 -4.7165 -4.6085 -4.6085 -4.5046 -4.5046 -4.4229 -4.4229 -2.0369 -2.0369 -1.9641 -1.9641 -1.8676 -1.8676 -0.5754 -0.5754 -0.4271 -0.4271 0.0178 0.0178 0.2295 0.2295 0.2769 0.2769 0.5511 0.5511 0.6713 0.6713 0.7228 0.7228 0.7846 0.7846 1.0082 1.0082 1.0581 1.0581 1.2987 1.2987 1.4478 1.4478 1.4982 1.4982 9.9972 9.9972 12.0853 12.0853 12.1826 12.1826 12.4566 12.4566 12.6676 12.6676 12.7918 12.7918 k = 0.2685 0.4651 0.6075 ( 5656 PWs) bands (ev): -20.6962 -20.6962 -20.6831 -20.6831 -19.7839 -19.7839 -18.7137 -18.7137 -18.6994 -18.6994 -18.6852 -18.6852 -18.1620 -18.1620 -18.1518 -18.1518 -5.4913 -5.4913 -5.4537 -5.4537 -4.7828 -4.7828 -4.7216 -4.7216 -4.6129 -4.6129 -4.4965 -4.4965 -4.4226 -4.4226 -2.0366 -2.0366 -1.9574 -1.9574 -1.8672 -1.8672 -0.5816 -0.5816 -0.4154 -0.4154 0.0160 0.0160 0.2270 0.2270 0.2792 0.2792 0.5495 0.5495 0.6696 0.6696 0.7269 0.7269 0.7950 0.7950 1.0068 1.0068 1.0615 1.0615 1.3001 1.3001 1.4469 1.4469 1.5024 1.5024 9.9865 9.9865 12.0641 12.0641 12.1870 12.1870 12.4398 12.4398 12.6217 12.6217 12.7750 12.7750 k = 0.2593 0.4491 0.6075 ( 5648 PWs) bands (ev): -20.6976 -20.6976 -20.6828 -20.6828 -19.7835 -19.7835 -18.7137 -18.7137 -18.6994 -18.6994 -18.6840 -18.6840 -18.1622 -18.1622 -18.1511 -18.1511 -5.4955 -5.4955 -5.4546 -5.4546 -4.7924 -4.7924 -4.7266 -4.7266 -4.6178 -4.6178 -4.4891 -4.4891 -4.4217 -4.4217 -2.0350 -2.0350 -1.9508 -1.9508 -1.8666 -1.8666 -0.5861 -0.5861 -0.4043 -0.4043 0.0139 0.0139 0.2250 0.2250 0.2812 0.2812 0.5477 0.5477 0.6698 0.6698 0.7314 0.7314 0.8054 0.8054 1.0057 1.0057 1.0646 1.0646 1.3019 1.3019 1.4466 1.4466 1.5064 1.5064 9.9742 9.9742 12.0408 12.0408 12.1903 12.1903 12.4195 12.4195 12.5746 12.5746 12.7562 12.7562 k = 0.2500 0.4330 0.6075 ( 5648 PWs) bands (ev): -20.6991 -20.6991 -20.6826 -20.6826 -19.7830 -19.7830 -18.7137 -18.7137 -18.6993 -18.6993 -18.6828 -18.6828 -18.1624 -18.1624 -18.1505 -18.1505 -5.5001 -5.5001 -5.4559 -5.4559 -4.8030 -4.8030 -4.7315 -4.7315 -4.6232 -4.6232 -4.4831 -4.4831 -4.4196 -4.4196 -2.0323 -2.0323 -1.9445 -1.9445 -1.8659 -1.8659 -0.5889 -0.5889 -0.3938 -0.3938 0.0112 0.0112 0.2234 0.2234 0.2828 0.2828 0.5457 0.5457 0.6717 0.6717 0.7365 0.7365 0.8157 0.8157 1.0051 1.0051 1.0673 1.0673 1.3041 1.3041 1.4469 1.4469 1.5104 1.5104 9.9605 9.9605 12.0156 12.0156 12.1918 12.1918 12.3955 12.3955 12.5278 12.5278 12.7357 12.7357 k = 0.2407 0.4170 0.6075 ( 5660 PWs) bands (ev): -20.7007 -20.7007 -20.6825 -20.6825 -19.7825 -19.7825 -18.7135 -18.7135 -18.6991 -18.6991 -18.6818 -18.6818 -18.1624 -18.1624 -18.1499 -18.1499 -5.5050 -5.5050 -5.4575 -5.4575 -4.8144 -4.8144 -4.7363 -4.7363 -4.6292 -4.6292 -4.4791 -4.4791 -4.4160 -4.4160 -2.0283 -2.0283 -1.9385 -1.9385 -1.8649 -1.8649 -0.5900 -0.5900 -0.3841 -0.3841 0.0081 0.0081 0.2222 0.2222 0.2840 0.2840 0.5434 0.5434 0.6756 0.6756 0.7421 0.7421 0.8260 0.8260 1.0049 1.0049 1.0696 1.0696 1.3067 1.3067 1.4477 1.4477 1.5143 1.5143 9.9454 9.9454 11.9888 11.9888 12.1902 12.1902 12.3679 12.3679 12.4831 12.4831 12.7134 12.7134 k = 0.2315 0.4009 0.6075 ( 5664 PWs) bands (ev): -20.7023 -20.7023 -20.6825 -20.6825 -19.7819 -19.7819 -18.7133 -18.7133 -18.6987 -18.6987 -18.6808 -18.6808 -18.1623 -18.1623 -18.1493 -18.1493 -5.5101 -5.5101 -5.4596 -5.4596 -4.8264 -4.8264 -4.7409 -4.7409 -4.6359 -4.6359 -4.4772 -4.4772 -4.4106 -4.4106 -2.0232 -2.0232 -1.9330 -1.9330 -1.8635 -1.8635 -0.5892 -0.5892 -0.3752 -0.3752 0.0045 0.0045 0.2215 0.2215 0.2849 0.2849 0.5408 0.5408 0.6812 0.6812 0.7482 0.7482 0.8362 0.8362 1.0051 1.0051 1.0715 1.0715 1.3099 1.3099 1.4492 1.4492 1.5181 1.5181 9.9290 9.9290 11.9607 11.9607 12.1840 12.1840 12.3367 12.3367 12.4425 12.4425 12.6897 12.6897 k = 0.2222 0.3849 0.6075 ( 5668 PWs) bands (ev): -20.7040 -20.7040 -20.6827 -20.6827 -19.7812 -19.7812 -18.7130 -18.7130 -18.6982 -18.6982 -18.6799 -18.6799 -18.1621 -18.1621 -18.1488 -18.1488 -5.5154 -5.5154 -5.4620 -5.4620 -4.8388 -4.8388 -4.7455 -4.7455 -4.6434 -4.6434 -4.4775 -4.4775 -4.4037 -4.4037 -2.0170 -2.0170 -1.9280 -1.9280 -1.8616 -1.8616 -0.5866 -0.5866 -0.3671 -0.3671 0.0004 0.0004 0.2213 0.2213 0.2855 0.2855 0.5379 0.5379 0.6886 0.6886 0.7547 0.7547 0.8462 0.8462 1.0058 1.0058 1.0729 1.0729 1.3135 1.3135 1.4513 1.4513 1.5217 1.5217 9.9116 9.9116 11.9315 11.9315 12.1714 12.1714 12.3025 12.3025 12.4082 12.4082 12.6645 12.6645 k = 0.2130 0.3689 0.6075 ( 5664 PWs) bands (ev): -20.7057 -20.7057 -20.6829 -20.6829 -19.7805 -19.7805 -18.7126 -18.7126 -18.6976 -18.6976 -18.6791 -18.6791 -18.1617 -18.1617 -18.1483 -18.1483 -5.5209 -5.5209 -5.4648 -5.4648 -4.8514 -4.8514 -4.7499 -4.7499 -4.6514 -4.6514 -4.4797 -4.4797 -4.3957 -4.3957 -2.0100 -2.0100 -1.9235 -1.9235 -1.8591 -1.8591 -0.5823 -0.5823 -0.3597 -0.3597 -0.0041 -0.0041 0.2215 0.2215 0.2858 0.2858 0.5347 0.5347 0.6975 0.6975 0.7618 0.7618 0.8561 0.8561 1.0067 1.0067 1.0739 1.0739 1.3177 1.3177 1.4540 1.4540 1.5252 1.5252 9.8932 9.8932 11.9014 11.9014 12.1510 12.1510 12.2655 12.2655 12.3816 12.3816 12.6381 12.6381 k = 0.2037 0.3528 0.6075 ( 5674 PWs) bands (ev): -20.7074 -20.7074 -20.6833 -20.6833 -19.7797 -19.7797 -18.7121 -18.7121 -18.6968 -18.6968 -18.6783 -18.6783 -18.1613 -18.1613 -18.1479 -18.1479 -5.5266 -5.5266 -5.4680 -5.4680 -4.8640 -4.8640 -4.7543 -4.7543 -4.6601 -4.6601 -4.4833 -4.4833 -4.3869 -4.3869 -2.0023 -2.0023 -1.9196 -1.9196 -1.8559 -1.8559 -0.5762 -0.5762 -0.3531 -0.3531 -0.0089 -0.0089 0.2221 0.2221 0.2859 0.2859 0.5310 0.5310 0.7078 0.7078 0.7694 0.7694 0.8658 0.8658 1.0081 1.0081 1.0746 1.0746 1.3222 1.3222 1.4571 1.4571 1.5286 1.5286 9.8740 9.8740 11.8705 11.8705 12.1230 12.1230 12.2262 12.2262 12.3628 12.3628 12.6104 12.6104 k = 0.1944 0.3368 0.6075 ( 5666 PWs) bands (ev): -20.7091 -20.7091 -20.6837 -20.6837 -19.7789 -19.7789 -18.7116 -18.7116 -18.6959 -18.6959 -18.6777 -18.6777 -18.1607 -18.1607 -18.1475 -18.1475 -5.5324 -5.5324 -5.4714 -5.4714 -4.8764 -4.8764 -4.7588 -4.7588 -4.6693 -4.6693 -4.4880 -4.4880 -4.3777 -4.3777 -1.9941 -1.9941 -1.9160 -1.9160 -1.8520 -1.8520 -0.5684 -0.5684 -0.3472 -0.3472 -0.0140 -0.0140 0.2232 0.2232 0.2857 0.2857 0.5270 0.5270 0.7193 0.7193 0.7774 0.7774 0.8754 0.8754 1.0097 1.0097 1.0749 1.0749 1.3272 1.3272 1.4608 1.4608 1.5318 1.5318 9.8543 9.8543 11.8390 11.8390 12.0894 12.0894 12.1852 12.1852 12.3501 12.3501 12.5815 12.5815 k = 0.1852 0.3208 0.6075 ( 5662 PWs) bands (ev): -20.7109 -20.7109 -20.6842 -20.6842 -19.7780 -19.7780 -18.7110 -18.7110 -18.6950 -18.6950 -18.6771 -18.6771 -18.1600 -18.1600 -18.1471 -18.1471 -5.5383 -5.5383 -5.4752 -5.4752 -4.8887 -4.8887 -4.7632 -4.7632 -4.6789 -4.6789 -4.4938 -4.4938 -4.3684 -4.3684 -1.9858 -1.9858 -1.9127 -1.9127 -1.8474 -1.8474 -0.5591 -0.5591 -0.3420 -0.3420 -0.0192 -0.0192 0.2246 0.2246 0.2852 0.2852 0.5226 0.5226 0.7318 0.7318 0.7858 0.7858 0.8848 0.8848 1.0116 1.0116 1.0748 1.0748 1.3324 1.3324 1.4650 1.4650 1.5349 1.5349 9.8340 9.8340 11.8071 11.8071 12.0524 12.0524 12.1432 12.1432 12.3412 12.3412 12.5516 12.5516 k = 0.1759 0.3047 0.6075 ( 5668 PWs) bands (ev): -20.7126 -20.7126 -20.6848 -20.6848 -19.7772 -19.7772 -18.7103 -18.7103 -18.6939 -18.6939 -18.6767 -18.6767 -18.1593 -18.1593 -18.1468 -18.1468 -5.5442 -5.5442 -5.4792 -5.4792 -4.9007 -4.9007 -4.7677 -4.7677 -4.6886 -4.6886 -4.5003 -4.5003 -4.3590 -4.3590 -1.9778 -1.9778 -1.9092 -1.9092 -1.8423 -1.8423 -0.5483 -0.5483 -0.3375 -0.3375 -0.0246 -0.0246 0.2264 0.2264 0.2846 0.2846 0.5177 0.5177 0.7449 0.7449 0.7947 0.7947 0.8940 0.8940 1.0138 1.0138 1.0746 1.0746 1.3379 1.3379 1.4696 1.4696 1.5378 1.5378 9.8135 9.8135 11.7746 11.7746 12.0140 12.0140 12.1008 12.1008 12.3342 12.3342 12.5208 12.5208 k = 0.1667 0.2887 0.6075 ( 5672 PWs) bands (ev): -20.7143 -20.7143 -20.6855 -20.6855 -19.7763 -19.7763 -18.7096 -18.7096 -18.6928 -18.6928 -18.6763 -18.6763 -18.1585 -18.1585 -18.1465 -18.1465 -5.5501 -5.5501 -5.4834 -5.4834 -4.9123 -4.9123 -4.7724 -4.7724 -4.6984 -4.6984 -4.5076 -4.5076 -4.3498 -4.3498 -1.9704 -1.9704 -1.9051 -1.9051 -1.8367 -1.8367 -0.5363 -0.5363 -0.3336 -0.3336 -0.0301 -0.0301 0.2284 0.2284 0.2839 0.2839 0.5124 0.5124 0.7583 0.7583 0.8042 0.8042 0.9029 0.9029 1.0162 1.0162 1.0741 1.0741 1.3436 1.3436 1.4747 1.4747 1.5406 1.5406 9.7929 9.7929 11.7417 11.7417 11.9757 11.9757 12.0586 12.0586 12.3276 12.3276 12.4893 12.4893 k = 0.1574 0.2726 0.6075 ( 5680 PWs) bands (ev): -20.7161 -20.7161 -20.6862 -20.6862 -19.7753 -19.7753 -18.7089 -18.7089 -18.6916 -18.6916 -18.6759 -18.6759 -18.1576 -18.1576 -18.1463 -18.1463 -5.5561 -5.5561 -5.4877 -5.4877 -4.9235 -4.9235 -4.7774 -4.7774 -4.7079 -4.7079 -4.5154 -4.5154 -4.3408 -4.3408 -1.9642 -1.9642 -1.9000 -1.9000 -1.8307 -1.8307 -0.5231 -0.5231 -0.3302 -0.3302 -0.0355 -0.0355 0.2308 0.2308 0.2829 0.2829 0.5067 0.5067 0.7717 0.7717 0.8142 0.8142 0.9117 0.9117 1.0188 1.0188 1.0734 1.0734 1.3493 1.3493 1.4800 1.4800 1.5432 1.5432 9.7723 9.7723 11.7084 11.7084 11.9386 11.9386 12.0173 12.0173 12.3205 12.3205 12.4571 12.4571 k = 0.1481 0.2566 0.6075 ( 5688 PWs) bands (ev): -20.7177 -20.7177 -20.6870 -20.6870 -19.7744 -19.7744 -18.7082 -18.7082 -18.6904 -18.6904 -18.6756 -18.6756 -18.1566 -18.1566 -18.1461 -18.1461 -5.5619 -5.5619 -5.4922 -5.4922 -4.9341 -4.9341 -4.7826 -4.7826 -4.7170 -4.7170 -4.5237 -4.5237 -4.3321 -4.3321 -1.9595 -1.9595 -1.8938 -1.8938 -1.8244 -1.8244 -0.5089 -0.5089 -0.3273 -0.3273 -0.0408 -0.0408 0.2333 0.2333 0.2819 0.2819 0.5005 0.5005 0.7846 0.7846 0.8249 0.8249 0.9202 0.9202 1.0215 1.0215 1.0727 1.0727 1.3551 1.3551 1.4857 1.4857 1.5457 1.5457 9.7520 9.7520 11.6748 11.6748 11.9032 11.9032 11.9776 11.9776 12.3121 12.3121 12.4247 12.4247 k = 0.1389 0.2406 0.6075 ( 5692 PWs) bands (ev): -20.7194 -20.7194 -20.6878 -20.6878 -19.7734 -19.7734 -18.7075 -18.7075 -18.6892 -18.6892 -18.6754 -18.6754 -18.1557 -18.1557 -18.1459 -18.1459 -5.5677 -5.5677 -5.4967 -5.4967 -4.9442 -4.9442 -4.7884 -4.7884 -4.7255 -4.7255 -4.5324 -4.5324 -4.3237 -4.3237 -1.9562 -1.9562 -1.8863 -1.8863 -1.8179 -1.8179 -0.4939 -0.4939 -0.3249 -0.3249 -0.0459 -0.0459 0.2360 0.2360 0.2808 0.2808 0.4940 0.4940 0.7968 0.7968 0.8363 0.8363 0.9286 0.9286 1.0244 1.0244 1.0719 1.0719 1.3608 1.3608 1.4916 1.4916 1.5481 1.5481 9.7320 9.7320 11.6409 11.6409 11.8700 11.8700 11.9398 11.9398 12.3022 12.3022 12.3922 12.3922 k = 0.1296 0.2245 0.6075 ( 5692 PWs) bands (ev): -20.7210 -20.7210 -20.6887 -20.6887 -19.7725 -19.7725 -18.7067 -18.7067 -18.6879 -18.6879 -18.6751 -18.6751 -18.1546 -18.1546 -18.1458 -18.1458 -5.5733 -5.5733 -5.5013 -5.5013 -4.9536 -4.9536 -4.7946 -4.7946 -4.7330 -4.7330 -4.5414 -4.5414 -4.3156 -4.3156 -1.9543 -1.9543 -1.8779 -1.8779 -1.8113 -1.8113 -0.4784 -0.4784 -0.3229 -0.3229 -0.0508 -0.0508 0.2389 0.2389 0.2796 0.2796 0.4871 0.4871 0.8080 0.8080 0.8483 0.8483 0.9367 0.9367 1.0273 1.0273 1.0711 1.0711 1.3663 1.3663 1.4976 1.4976 1.5504 1.5504 9.7125 9.7125 11.6068 11.6068 11.8394 11.8394 11.9045 11.9045 12.2903 12.2903 12.3599 12.3599 k = 0.1204 0.2085 0.6075 ( 5690 PWs) bands (ev): -20.7225 -20.7225 -20.6895 -20.6895 -19.7716 -19.7716 -18.7060 -18.7060 -18.6867 -18.6867 -18.6749 -18.6749 -18.1536 -18.1536 -18.1457 -18.1457 -5.5787 -5.5787 -5.5057 -5.5057 -4.9624 -4.9624 -4.8014 -4.8014 -4.7394 -4.7394 -4.5506 -4.5506 -4.3080 -4.3080 -1.9534 -1.9534 -1.8690 -1.8690 -1.8046 -1.8046 -0.4625 -0.4625 -0.3212 -0.3212 -0.0555 -0.0555 0.2418 0.2418 0.2783 0.2783 0.4800 0.4800 0.8181 0.8181 0.8608 0.8608 0.9445 0.9445 1.0303 1.0303 1.0703 1.0703 1.3717 1.3717 1.5037 1.5037 1.5525 1.5525 9.6937 9.6937 11.5729 11.5729 11.8114 11.8114 11.8719 11.8719 12.2765 12.2765 12.3282 12.3282 k = 0.1111 0.1925 0.6075 ( 5694 PWs) bands (ev): -20.7240 -20.7240 -20.6903 -20.6903 -19.7707 -19.7707 -18.7054 -18.7054 -18.6855 -18.6855 -18.6747 -18.6747 -18.1526 -18.1526 -18.1456 -18.1456 -5.5839 -5.5839 -5.5101 -5.5101 -4.9706 -4.9706 -4.8087 -4.8087 -4.7448 -4.7448 -4.5599 -4.5599 -4.3009 -4.3009 -1.9532 -1.9532 -1.8599 -1.8599 -1.7979 -1.7979 -0.4464 -0.4464 -0.3197 -0.3197 -0.0599 -0.0599 0.2448 0.2448 0.2771 0.2771 0.4726 0.4726 0.8272 0.8272 0.8733 0.8733 0.9522 0.9522 1.0333 1.0333 1.0696 1.0696 1.3768 1.3768 1.5097 1.5097 1.5546 1.5546 9.6757 9.6757 11.5394 11.5394 11.7863 11.7863 11.8422 11.8422 12.2608 12.2608 12.2973 12.2973 k = 0.1019 0.1764 0.6075 ( 5698 PWs) bands (ev): -20.7254 -20.7254 -20.6912 -20.6912 -19.7698 -19.7698 -18.7048 -18.7048 -18.6844 -18.6844 -18.6745 -18.6745 -18.1516 -18.1516 -18.1455 -18.1455 -5.5889 -5.5889 -5.5144 -5.5144 -4.9781 -4.9781 -4.8164 -4.8164 -4.7491 -4.7491 -4.5692 -4.5692 -4.2942 -4.2942 -1.9536 -1.9536 -1.8510 -1.8510 -1.7911 -1.7911 -0.4305 -0.4305 -0.3185 -0.3185 -0.0640 -0.0640 0.2477 0.2477 0.2758 0.2758 0.4650 0.4650 0.8353 0.8353 0.8856 0.8856 0.9596 0.9596 1.0363 1.0363 1.0690 1.0690 1.3817 1.3817 1.5156 1.5156 1.5566 1.5566 9.6587 9.6587 11.5066 11.5066 11.7641 11.7641 11.8155 11.8155 12.2432 12.2432 12.2675 12.2675 k = 0.0926 0.1604 0.6075 ( 5702 PWs) bands (ev): -20.7267 -20.7267 -20.6920 -20.6920 -19.7690 -19.7690 -18.7042 -18.7042 -18.6834 -18.6834 -18.6742 -18.6742 -18.1507 -18.1507 -18.1454 -18.1454 -5.5935 -5.5935 -5.5185 -5.5185 -4.9849 -4.9849 -4.8241 -4.8241 -4.7524 -4.7524 -4.5783 -4.5783 -4.2880 -4.2880 -1.9542 -1.9542 -1.8426 -1.8426 -1.7844 -1.7844 -0.4150 -0.4150 -0.3173 -0.3173 -0.0677 -0.0677 0.2506 0.2506 0.2746 0.2746 0.4575 0.4575 0.8426 0.8426 0.8973 0.8973 0.9668 0.9668 1.0391 1.0391 1.0685 1.0685 1.3862 1.3862 1.5212 1.5212 1.5586 1.5586 9.6426 9.6426 11.4750 11.4750 11.7447 11.7447 11.7919 11.7919 12.2241 12.2241 12.2394 12.2394 k = 0.0833 0.1443 0.6075 ( 5686 PWs) bands (ev): -20.7278 -20.7278 -20.6927 -20.6927 -19.7683 -19.7683 -18.7037 -18.7037 -18.6824 -18.6824 -18.6739 -18.6739 -18.1497 -18.1497 -18.1454 -18.1454 -5.5979 -5.5979 -5.5223 -5.5223 -4.9910 -4.9910 -4.8318 -4.8318 -4.7549 -4.7549 -4.5871 -4.5871 -4.2824 -4.2824 -1.9551 -1.9551 -1.8348 -1.8348 -1.7778 -1.7778 -0.4002 -0.4002 -0.3161 -0.3161 -0.0711 -0.0711 0.2534 0.2534 0.2735 0.2735 0.4499 0.4499 0.8491 0.8491 0.9082 0.9082 0.9738 0.9738 1.0418 1.0418 1.0682 1.0682 1.3905 1.3905 1.5265 1.5265 1.5605 1.5605 9.6278 9.6278 11.4449 11.4449 11.7281 11.7281 11.7713 11.7713 12.2035 12.2035 12.2134 12.2134 k = 0.0741 0.1283 0.6075 ( 5694 PWs) bands (ev): -20.7289 -20.7289 -20.6934 -20.6934 -19.7676 -19.7676 -18.7032 -18.7032 -18.6815 -18.6815 -18.6736 -18.6736 -18.1489 -18.1489 -18.1454 -18.1454 -5.6019 -5.6019 -5.5258 -5.5258 -4.9964 -4.9964 -4.8392 -4.8392 -4.7566 -4.7566 -4.5956 -4.5956 -4.2773 -4.2773 -1.9560 -1.9560 -1.8277 -1.8277 -1.7714 -1.7714 -0.3864 -0.3864 -0.3149 -0.3149 -0.0741 -0.0741 0.2561 0.2561 0.2724 0.2724 0.4426 0.4426 0.8548 0.8548 0.9180 0.9180 0.9805 0.9805 1.0442 1.0442 1.0681 1.0681 1.3943 1.3943 1.5313 1.5313 1.5624 1.5624 9.6142 9.6142 11.4169 11.4169 11.7141 11.7141 11.7536 11.7536 12.1818 12.1818 12.1899 12.1899 k = 0.0648 0.1123 0.6075 ( 5690 PWs) bands (ev): -20.7299 -20.7299 -20.6941 -20.6941 -19.7669 -19.7669 -18.7028 -18.7028 -18.6808 -18.6808 -18.6733 -18.6733 -18.1481 -18.1481 -18.1453 -18.1453 -5.6054 -5.6054 -5.5291 -5.5291 -5.0011 -5.0011 -4.8461 -4.8461 -4.7578 -4.7578 -4.6036 -4.6036 -4.2727 -4.2727 -1.9570 -1.9570 -1.8215 -1.8215 -1.7654 -1.7654 -0.3740 -0.3740 -0.3133 -0.3133 -0.0768 -0.0768 0.2586 0.2586 0.2714 0.2714 0.4356 0.4356 0.8599 0.8599 0.9266 0.9266 0.9868 0.9868 1.0463 1.0463 1.0682 1.0682 1.3977 1.3977 1.5355 1.5355 1.5643 1.5643 9.6020 9.6020 11.3912 11.3912 11.7025 11.7025 11.7387 11.7387 12.1604 12.1604 12.1686 12.1686 k = 0.0556 0.0962 0.6075 ( 5682 PWs) bands (ev): -20.7308 -20.7308 -20.6947 -20.6947 -19.7664 -19.7664 -18.7025 -18.7025 -18.6802 -18.6802 -18.6730 -18.6730 -18.1474 -18.1474 -18.1453 -18.1453 -5.6086 -5.6086 -5.5319 -5.5319 -5.0051 -5.0051 -4.8524 -4.8524 -4.7585 -4.7585 -4.6109 -4.6109 -4.2688 -4.2688 -1.9579 -1.9579 -1.8162 -1.8162 -1.7598 -1.7598 -0.3632 -0.3632 -0.3114 -0.3114 -0.0791 -0.0791 0.2608 0.2608 0.2705 0.2705 0.4291 0.4291 0.8642 0.8642 0.9339 0.9339 0.9926 0.9926 1.0482 1.0482 1.0684 1.0684 1.4007 1.4007 1.5391 1.5391 1.5662 1.5662 9.5912 9.5912 11.3682 11.3682 11.6930 11.6930 11.7265 11.7265 12.1405 12.1405 12.1489 12.1489 k = 0.0463 0.0802 0.6075 ( 5690 PWs) bands (ev): -20.7315 -20.7315 -20.6952 -20.6952 -19.7659 -19.7659 -18.7022 -18.7022 -18.6797 -18.6797 -18.6727 -18.6727 -18.1468 -18.1468 -18.1453 -18.1453 -5.6113 -5.6113 -5.5344 -5.5344 -5.0085 -5.0085 -4.8579 -4.8579 -4.7589 -4.7589 -4.6174 -4.6174 -4.2654 -4.2654 -1.9587 -1.9587 -1.8117 -1.8117 -1.7548 -1.7548 -0.3545 -0.3545 -0.3090 -0.3090 -0.0811 -0.0811 0.2628 0.2628 0.2697 0.2697 0.4232 0.4232 0.8679 0.8679 0.9401 0.9401 0.9979 0.9979 1.0497 1.0497 1.0688 1.0688 1.4032 1.4032 1.5421 1.5421 1.5681 1.5681 9.5819 9.5819 11.3482 11.3482 11.6852 11.6852 11.7170 11.7170 12.1231 12.1231 12.1309 12.1309 k = 0.0370 0.0642 0.6075 ( 5702 PWs) bands (ev): -20.7322 -20.7322 -20.6956 -20.6956 -19.7655 -19.7655 -18.7020 -18.7020 -18.6793 -18.6793 -18.6724 -18.6724 -18.1463 -18.1463 -18.1453 -18.1453 -5.6136 -5.6136 -5.5365 -5.5365 -5.0112 -5.0112 -4.8626 -4.8626 -4.7590 -4.7590 -4.6230 -4.6230 -4.2626 -4.2626 -1.9594 -1.9594 -1.8081 -1.8081 -1.7506 -1.7506 -0.3480 -0.3480 -0.3062 -0.3062 -0.0827 -0.0827 0.2645 0.2645 0.2691 0.2691 0.4181 0.4181 0.8708 0.8708 0.9449 0.9449 1.0024 1.0024 1.0508 1.0508 1.0693 1.0693 1.4053 1.4053 1.5444 1.5444 1.5697 1.5697 9.5743 9.5743 11.3316 11.3316 11.6791 11.6791 11.7098 11.7098 12.1083 12.1083 12.1153 12.1153 k = 0.0278 0.0481 0.6075 ( 5706 PWs) bands (ev): -20.7326 -20.7326 -20.6960 -20.6960 -19.7652 -19.7652 -18.7018 -18.7018 -18.6790 -18.6790 -18.6721 -18.6721 -18.1459 -18.1459 -18.1453 -18.1453 -5.6154 -5.6154 -5.5382 -5.5382 -5.0133 -5.0133 -4.8663 -4.8663 -4.7589 -4.7589 -4.6275 -4.6275 -4.2605 -4.2605 -1.9600 -1.9600 -1.8054 -1.8054 -1.7471 -1.7471 -0.3434 -0.3434 -0.3032 -0.3032 -0.0839 -0.0839 0.2659 0.2659 0.2686 0.2686 0.4140 0.4140 0.8731 0.8731 0.9487 0.9487 1.0061 1.0061 1.0517 1.0517 1.0698 1.0698 1.4070 1.4070 1.5461 1.5461 1.5712 1.5712 9.5682 9.5682 11.3184 11.3184 11.6744 11.6744 11.7048 11.7048 12.0964 12.0964 12.1025 12.1025 k = 0.0185 0.0321 0.6075 ( 5706 PWs) bands (ev): -20.7330 -20.7330 -20.6962 -20.6962 -19.7649 -19.7649 -18.7017 -18.7017 -18.6788 -18.6788 -18.6719 -18.6719 -18.1456 -18.1456 -18.1453 -18.1453 -5.6167 -5.6167 -5.5394 -5.5394 -5.0148 -5.0148 -4.8690 -4.8690 -4.7588 -4.7588 -4.6308 -4.6308 -4.2589 -4.2589 -1.9605 -1.9605 -1.8034 -1.8034 -1.7446 -1.7446 -0.3405 -0.3405 -0.3006 -0.3006 -0.0848 -0.0848 0.2668 0.2668 0.2683 0.2683 0.4109 0.4109 0.8748 0.8748 0.9513 0.9513 1.0088 1.0088 1.0522 1.0522 1.0702 1.0702 1.4082 1.4082 1.5473 1.5473 1.5723 1.5723 9.5639 9.5639 11.3088 11.3088 11.6711 11.6711 11.7016 11.7016 12.0876 12.0876 12.0931 12.0931 k = 0.0093 0.0160 0.6075 ( 5714 PWs) bands (ev): -20.7332 -20.7332 -20.6964 -20.6964 -19.7648 -19.7648 -18.7016 -18.7016 -18.6786 -18.6786 -18.6718 -18.6718 -18.1454 -18.1454 -18.1453 -18.1453 -5.6174 -5.6174 -5.5401 -5.5401 -5.0156 -5.0156 -4.8706 -4.8706 -4.7587 -4.7587 -4.6329 -4.6329 -4.2580 -4.2580 -1.9607 -1.9607 -1.8022 -1.8022 -1.7431 -1.7431 -0.3389 -0.3389 -0.2989 -0.2989 -0.0853 -0.0853 0.2674 0.2674 0.2681 0.2681 0.4090 0.4090 0.8758 0.8758 0.9528 0.9528 1.0105 1.0105 1.0526 1.0526 1.0705 1.0705 1.4089 1.4089 1.5480 1.5480 1.5730 1.5730 9.5613 9.5613 11.3031 11.3031 11.6690 11.6690 11.6998 11.6998 12.0822 12.0822 12.0873 12.0873 k = 0.0000 0.0000 0.6075 ( 5708 PWs) bands (ev): -20.7333 -20.7333 -20.6964 -20.6964 -19.7647 -19.7647 -18.7016 -18.7016 -18.6786 -18.6786 -18.6717 -18.6717 -18.1453 -18.1453 -18.1453 -18.1453 -5.6177 -5.6177 -5.5403 -5.5403 -5.0159 -5.0159 -4.8712 -4.8712 -4.7586 -4.7586 -4.6336 -4.6336 -4.2577 -4.2577 -1.9608 -1.9608 -1.8018 -1.8018 -1.7426 -1.7426 -0.3384 -0.3384 -0.2982 -0.2982 -0.0855 -0.0855 0.2675 0.2675 0.2682 0.2682 0.4084 0.4084 0.8761 0.8761 0.9533 0.9533 1.0110 1.0110 1.0527 1.0527 1.0706 1.0706 1.4091 1.4091 1.5482 1.5482 1.5732 1.5732 9.5604 9.5604 11.3011 11.3011 11.6684 11.6684 11.6992 11.6992 12.0804 12.0804 12.0854 12.0854 k = 0.5000 0.2887 0.6075 ( 5644 PWs) bands (ev): -20.7010 -20.7010 -20.6806 -20.6806 -19.7834 -19.7834 -18.7245 -18.7245 -18.6923 -18.6923 -18.6778 -18.6778 -18.1688 -18.1688 -18.1451 -18.1451 -5.5085 -5.5085 -5.4492 -5.4492 -4.8290 -4.8290 -4.6821 -4.6821 -4.6651 -4.6651 -4.4757 -4.4757 -4.3996 -4.3996 -2.0899 -2.0899 -1.8938 -1.8938 -1.8557 -1.8557 -0.6673 -0.6673 -0.3208 -0.3208 0.0210 0.0210 0.1886 0.1886 0.3257 0.3257 0.5187 0.5187 0.6413 0.6413 0.6986 0.6986 0.8851 0.8851 0.9800 0.9800 1.1072 1.1072 1.2967 1.2967 1.4119 1.4119 1.5432 1.5432 9.9487 9.9487 12.0805 12.0805 12.1212 12.1212 12.5321 12.5321 12.5322 12.5322 12.5610 12.5610 k = 0.5000 0.2887 0.5891 ( 5652 PWs) bands (ev): -20.7010 -20.7010 -20.6806 -20.6806 -19.7835 -19.7835 -18.7244 -18.7244 -18.6922 -18.6922 -18.6779 -18.6779 -18.1687 -18.1687 -18.1450 -18.1450 -5.5086 -5.5086 -5.4492 -5.4492 -4.8294 -4.8294 -4.6853 -4.6853 -4.6613 -4.6613 -4.4756 -4.4756 -4.3996 -4.3996 -2.0896 -2.0896 -1.8938 -1.8938 -1.8556 -1.8556 -0.6667 -0.6667 -0.3206 -0.3206 0.0177 0.0177 0.1880 0.1880 0.3256 0.3256 0.5216 0.5216 0.6418 0.6418 0.6986 0.6986 0.8852 0.8852 0.9791 0.9791 1.1064 1.1064 1.2971 1.2971 1.4122 1.4122 1.5433 1.5433 9.9478 9.9478 12.0606 12.0606 12.1394 12.1394 12.5288 12.5288 12.5338 12.5338 12.5655 12.5655 k = 0.5000 0.2887 0.5707 ( 5652 PWs) bands (ev): -20.7012 -20.7012 -20.6807 -20.6807 -19.7839 -19.7839 -18.7240 -18.7240 -18.6920 -18.6920 -18.6781 -18.6781 -18.1685 -18.1685 -18.1447 -18.1447 -5.5086 -5.5086 -5.4492 -5.4492 -4.8304 -4.8304 -4.6914 -4.6914 -4.6536 -4.6536 -4.4754 -4.4754 -4.3996 -4.3996 -2.0890 -2.0890 -1.8939 -1.8939 -1.8553 -1.8553 -0.6648 -0.6648 -0.3198 -0.3198 0.0081 0.0081 0.1865 0.1865 0.3252 0.3252 0.5298 0.5298 0.6435 0.6435 0.6985 0.6985 0.8853 0.8853 0.9762 0.9762 1.1038 1.1038 1.2980 1.2980 1.4130 1.4130 1.5438 1.5438 9.9450 9.9450 12.0266 12.0266 12.1684 12.1684 12.5242 12.5242 12.5361 12.5361 12.5764 12.5764 k = 0.5000 0.2887 0.5523 ( 5652 PWs) bands (ev): -20.7015 -20.7015 -20.6807 -20.6807 -19.7846 -19.7846 -18.7235 -18.7235 -18.6916 -18.6916 -18.6785 -18.6785 -18.1681 -18.1681 -18.1442 -18.1442 -5.5088 -5.5088 -5.4492 -5.4492 -4.8321 -4.8321 -4.6978 -4.6978 -4.6447 -4.6447 -4.4750 -4.4750 -4.3995 -4.3995 -2.0878 -2.0878 -1.8941 -1.8941 -1.8549 -1.8549 -0.6618 -0.6618 -0.3186 -0.3186 -0.0071 -0.0071 0.1840 0.1840 0.3245 0.3245 0.5421 0.5421 0.6467 0.6467 0.6982 0.6982 0.8855 0.8855 0.9714 0.9714 1.0995 1.0995 1.2997 1.2997 1.4143 1.4143 1.5446 1.5446 9.9405 9.9405 11.9885 11.9885 12.1983 12.1983 12.5201 12.5201 12.5392 12.5392 12.5914 12.5914 k = 0.5000 0.2887 0.5339 ( 5656 PWs) bands (ev): -20.7020 -20.7020 -20.6808 -20.6808 -19.7855 -19.7855 -18.7228 -18.7228 -18.6911 -18.6911 -18.6790 -18.6790 -18.1676 -18.1676 -18.1436 -18.1436 -5.5089 -5.5089 -5.4492 -5.4492 -4.8344 -4.8344 -4.7038 -4.7038 -4.6352 -4.6352 -4.4746 -4.4746 -4.3993 -4.3993 -2.0863 -2.0863 -1.8944 -1.8944 -1.8542 -1.8542 -0.6576 -0.6576 -0.3169 -0.3169 -0.0269 -0.0269 0.1805 0.1805 0.3236 0.3236 0.5567 0.5567 0.6523 0.6523 0.6979 0.6979 0.8858 0.8858 0.9649 0.9649 1.0937 1.0937 1.3019 1.3019 1.4160 1.4160 1.5457 1.5457 9.9343 9.9343 11.9474 11.9474 12.2283 12.2283 12.5171 12.5171 12.5429 12.5429 12.6094 12.6094 k = 0.5000 0.2887 0.5155 ( 5644 PWs) bands (ev): -20.7025 -20.7025 -20.6809 -20.6809 -19.7866 -19.7866 -18.7220 -18.7220 -18.6904 -18.6904 -18.6796 -18.6796 -18.1669 -18.1669 -18.1427 -18.1427 -5.5092 -5.5092 -5.4493 -5.4493 -4.8372 -4.8372 -4.7093 -4.7093 -4.6253 -4.6253 -4.4740 -4.4740 -4.3990 -4.3990 -2.0842 -2.0842 -1.8949 -1.8949 -1.8534 -1.8534 -0.6524 -0.6524 -0.3147 -0.3147 -0.0502 -0.0502 0.1763 0.1763 0.3225 0.3225 0.5712 0.5712 0.6616 0.6616 0.6974 0.6974 0.8863 0.8863 0.9567 0.9567 1.0865 1.0865 1.3047 1.3047 1.4181 1.4181 1.5470 1.5470 9.9265 9.9265 11.9037 11.9037 12.2584 12.2584 12.5156 12.5156 12.5467 12.5467 12.6303 12.6303 k = 0.5000 0.2887 0.4971 ( 5648 PWs) bands (ev): -20.7032 -20.7032 -20.6810 -20.6810 -19.7880 -19.7880 -18.7210 -18.7210 -18.6896 -18.6896 -18.6803 -18.6803 -18.1661 -18.1661 -18.1417 -18.1417 -5.5094 -5.5094 -5.4494 -5.4494 -4.8406 -4.8406 -4.7142 -4.7142 -4.6153 -4.6153 -4.4734 -4.4734 -4.3986 -4.3986 -2.0818 -2.0818 -1.8955 -1.8955 -1.8523 -1.8523 -0.6462 -0.6462 -0.3121 -0.3121 -0.0761 -0.0761 0.1714 0.1714 0.3213 0.3213 0.5831 0.5831 0.6758 0.6758 0.6969 0.6969 0.8871 0.8871 0.9470 0.9470 1.0779 1.0779 1.3079 1.3079 1.4204 1.4204 1.5484 1.5484 9.9173 9.9173 11.8574 11.8574 12.2885 12.2885 12.5155 12.5155 12.5500 12.5500 12.6539 12.6539 k = 0.5000 0.2887 0.4786 ( 5662 PWs) bands (ev): -20.7040 -20.7040 -20.6812 -20.6812 -19.7896 -19.7896 -18.7200 -18.7200 -18.6888 -18.6888 -18.6808 -18.6808 -18.1652 -18.1652 -18.1405 -18.1405 -5.5097 -5.5097 -5.4496 -5.4496 -4.8444 -4.8444 -4.7185 -4.7185 -4.6052 -4.6052 -4.4728 -4.4728 -4.3979 -4.3979 -2.0789 -2.0789 -1.8963 -1.8963 -1.8509 -1.8509 -0.6391 -0.6391 -0.3090 -0.3090 -0.1039 -0.1039 0.1659 0.1659 0.3199 0.3199 0.5915 0.5915 0.6921 0.6921 0.6993 0.6993 0.8880 0.8880 0.9360 0.9360 1.0682 1.0682 1.3117 1.3117 1.4228 1.4228 1.5498 1.5498 9.9067 9.9067 11.8089 11.8089 12.3182 12.3182 12.5167 12.5167 12.5526 12.5526 12.6801 12.6801 k = 0.5000 0.2887 0.4602 ( 5674 PWs) bands (ev): -20.7048 -20.7048 -20.6814 -20.6814 -19.7914 -19.7914 -18.7190 -18.7190 -18.6883 -18.6883 -18.6810 -18.6810 -18.1641 -18.1641 -18.1392 -18.1392 -5.5100 -5.5100 -5.4498 -5.4498 -4.8485 -4.8485 -4.7223 -4.7223 -4.5950 -4.5950 -4.4722 -4.4722 -4.3970 -4.3970 -2.0755 -2.0755 -1.8974 -1.8974 -1.8493 -1.8493 -0.6312 -0.6312 -0.3055 -0.3055 -0.1328 -0.1328 0.1599 0.1599 0.3184 0.3184 0.5965 0.5965 0.6934 0.6934 0.7207 0.7207 0.8893 0.8893 0.9237 0.9237 1.0575 1.0575 1.3157 1.3157 1.4254 1.4254 1.5512 1.5512 9.8951 9.8951 11.7584 11.7584 12.3467 12.3467 12.5192 12.5192 12.5543 12.5543 12.7089 12.7089 k = 0.5000 0.2887 0.4418 ( 5672 PWs) bands (ev): -20.7058 -20.7058 -20.6816 -20.6816 -19.7934 -19.7934 -18.7180 -18.7180 -18.6882 -18.6882 -18.6805 -18.6805 -18.1629 -18.1629 -18.1378 -18.1378 -5.5103 -5.5103 -5.4500 -5.4500 -4.8528 -4.8528 -4.7255 -4.7255 -4.5850 -4.5850 -4.4718 -4.4718 -4.3956 -4.3956 -2.0718 -2.0718 -1.8986 -1.8986 -1.8474 -1.8474 -0.6228 -0.6228 -0.3016 -0.3016 -0.1624 -0.1624 0.1537 0.1537 0.3169 0.3169 0.5993 0.5993 0.6918 0.6918 0.7471 0.7471 0.8910 0.8910 0.9106 0.9106 1.0459 1.0459 1.3202 1.3202 1.4278 1.4278 1.5526 1.5526 9.8825 9.8825 11.7062 11.7062 12.3719 12.3719 12.5228 12.5228 12.5559 12.5559 12.7403 12.7403 k = 0.5000 0.2887 0.4234 ( 5664 PWs) bands (ev): -20.7068 -20.7068 -20.6818 -20.6818 -19.7955 -19.7955 -18.7170 -18.7170 -18.6888 -18.6888 -18.6792 -18.6792 -18.1616 -18.1616 -18.1362 -18.1362 -5.5105 -5.5105 -5.4504 -5.4504 -4.8573 -4.8573 -4.7284 -4.7284 -4.5752 -4.5752 -4.4714 -4.4714 -4.3938 -4.3938 -2.0676 -2.0676 -1.9001 -1.9001 -1.8452 -1.8452 -0.6140 -0.6140 -0.2973 -0.2973 -0.1921 -0.1921 0.1473 0.1473 0.3153 0.3153 0.6004 0.6004 0.6897 0.6897 0.7748 0.7748 0.8931 0.8931 0.8970 0.8970 1.0337 1.0337 1.3249 1.3249 1.4302 1.4302 1.5539 1.5539 9.8692 9.8692 11.6529 11.6529 12.3905 12.3905 12.5274 12.5274 12.5598 12.5598 12.7741 12.7741 k = 0.5000 0.2887 0.4050 ( 5672 PWs) bands (ev): -20.7078 -20.7078 -20.6821 -20.6821 -19.7978 -19.7978 -18.7161 -18.7161 -18.6898 -18.6898 -18.6773 -18.6773 -18.1603 -18.1603 -18.1345 -18.1345 -5.5108 -5.5108 -5.4508 -5.4508 -4.8619 -4.8619 -4.7309 -4.7309 -4.5656 -4.5656 -4.4712 -4.4712 -4.3916 -4.3916 -2.0631 -2.0631 -1.9018 -1.9018 -1.8427 -1.8427 -0.6049 -0.6049 -0.2927 -0.2927 -0.2216 -0.2216 0.1409 0.1409 0.3138 0.3138 0.6004 0.6004 0.6871 0.6871 0.8020 0.8020 0.8834 0.8834 0.8961 0.8961 1.0211 1.0211 1.3297 1.3297 1.4324 1.4324 1.5549 1.5549 9.8552 9.8552 11.5986 11.5986 12.3980 12.3980 12.5331 12.5331 12.5694 12.5694 12.8103 12.8103 k = 0.5000 0.2887 0.3866 ( 5668 PWs) bands (ev): -20.7089 -20.7089 -20.6824 -20.6824 -19.8002 -19.8002 -18.7153 -18.7153 -18.6912 -18.6912 -18.6749 -18.6749 -18.1588 -18.1588 -18.1328 -18.1328 -5.5110 -5.5110 -5.4513 -5.4513 -4.8664 -4.8664 -4.7330 -4.7330 -4.5563 -4.5563 -4.4712 -4.4712 -4.3889 -4.3889 -2.0583 -2.0583 -1.9037 -1.9037 -1.8400 -1.8400 -0.5958 -0.5958 -0.2882 -0.2882 -0.2502 -0.2502 0.1348 0.1348 0.3124 0.3124 0.5996 0.5996 0.6840 0.6840 0.8247 0.8247 0.8731 0.8731 0.9002 0.9002 1.0082 1.0082 1.3348 1.3348 1.4343 1.4343 1.5558 1.5558 9.8409 9.8409 11.5438 11.5438 12.3916 12.3916 12.5398 12.5398 12.5867 12.5867 12.8485 12.8485 k = 0.5000 0.2887 0.3682 ( 5676 PWs) bands (ev): -20.7101 -20.7101 -20.6828 -20.6828 -19.8026 -19.8026 -18.7145 -18.7145 -18.6926 -18.6926 -18.6721 -18.6721 -18.1573 -18.1573 -18.1309 -18.1309 -5.5112 -5.5112 -5.4520 -5.4520 -4.8709 -4.8709 -4.7349 -4.7349 -4.5475 -4.5475 -4.4714 -4.4714 -4.3856 -4.3856 -2.0531 -2.0531 -1.9058 -1.9058 -1.8371 -1.8371 -0.5869 -0.5869 -0.2877 -0.2877 -0.2738 -0.2738 0.1290 0.1290 0.3111 0.3111 0.5982 0.5982 0.6804 0.6804 0.8315 0.8315 0.8750 0.8750 0.9073 0.9073 0.9954 0.9954 1.3399 1.3399 1.4359 1.4359 1.5564 1.5564 9.8263 9.8263 11.4889 11.4889 12.3726 12.3726 12.5472 12.5472 12.6107 12.6107 12.8882 12.8882 k = 0.5000 0.2887 0.3498 ( 5664 PWs) bands (ev): -20.7112 -20.7112 -20.6831 -20.6831 -19.8052 -19.8052 -18.7139 -18.7139 -18.6942 -18.6942 -18.6691 -18.6691 -18.1558 -18.1558 -18.1291 -18.1291 -5.5113 -5.5113 -5.4528 -5.4528 -4.8752 -4.8752 -4.7366 -4.7366 -4.5391 -4.5391 -4.4717 -4.4717 -4.3818 -4.3818 -2.0477 -2.0477 -1.9080 -1.9080 -1.8339 -1.8339 -0.5786 -0.5786 -0.3089 -0.3089 -0.2743 -0.2743 0.1238 0.1238 0.3100 0.3100 0.5962 0.5962 0.6762 0.6762 0.8215 0.8215 0.8857 0.8857 0.9214 0.9214 0.9831 0.9831 1.3451 1.3451 1.4372 1.4372 1.5567 1.5567 9.8117 9.8117 11.4343 11.4343 12.3446 12.3446 12.5552 12.5552 12.6381 12.6381 12.9133 12.9133 k = 0.5000 0.2887 0.3314 ( 5652 PWs) bands (ev): -20.7124 -20.7124 -20.6835 -20.6835 -19.8077 -19.8077 -18.7134 -18.7134 -18.6958 -18.6958 -18.6659 -18.6659 -18.1542 -18.1542 -18.1272 -18.1272 -5.5114 -5.5114 -5.4536 -5.4536 -4.8793 -4.8793 -4.7381 -4.7381 -4.5312 -4.5312 -4.4720 -4.4720 -4.3776 -4.3776 -2.0420 -2.0420 -1.9104 -1.9104 -1.8306 -1.8306 -0.5710 -0.5710 -0.3344 -0.3344 -0.2690 -0.2690 0.1192 0.1192 0.3091 0.3091 0.5939 0.5939 0.6716 0.6716 0.8065 0.8065 0.8922 0.8922 0.9423 0.9423 0.9726 0.9726 1.3502 1.3502 1.4382 1.4382 1.5568 1.5568 9.7971 9.7971 11.3803 11.3803 12.3108 12.3108 12.5636 12.5636 12.6662 12.6662 12.9201 12.9201 k = 0.5000 0.2887 0.3130 ( 5660 PWs) bands (ev): -20.7136 -20.7136 -20.6839 -20.6839 -19.8103 -19.8103 -18.7131 -18.7131 -18.6974 -18.6974 -18.6625 -18.6625 -18.1526 -18.1526 -18.1253 -18.1253 -5.5114 -5.5114 -5.4547 -5.4547 -4.8832 -4.8832 -4.7395 -4.7395 -4.5240 -4.5240 -4.4725 -4.4725 -4.3729 -4.3729 -2.0362 -2.0362 -1.9130 -1.9130 -1.8271 -1.8271 -0.5647 -0.5647 -0.3587 -0.3587 -0.2631 -0.2631 0.1155 0.1155 0.3084 0.3084 0.5911 0.5911 0.6664 0.6664 0.7902 0.7902 0.8949 0.8949 0.9548 0.9548 0.9751 0.9751 1.3553 1.3553 1.4388 1.4388 1.5566 1.5566 9.7827 9.7827 11.3273 11.3273 12.2734 12.2734 12.5723 12.5723 12.6930 12.6930 12.9323 12.9323 k = 0.5000 0.2887 0.2946 ( 5652 PWs) bands (ev): -20.7147 -20.7147 -20.6843 -20.6843 -19.8129 -19.8129 -18.7128 -18.7128 -18.6990 -18.6990 -18.6591 -18.6591 -18.1510 -18.1510 -18.1233 -18.1233 -5.5113 -5.5113 -5.4558 -5.4558 -4.8869 -4.8869 -4.7408 -4.7408 -4.5175 -4.5175 -4.4729 -4.4729 -4.3678 -4.3678 -2.0302 -2.0302 -1.9156 -1.9156 -1.8234 -1.8234 -0.5600 -0.5600 -0.3810 -0.3810 -0.2570 -0.2570 0.1127 0.1127 0.3081 0.3081 0.5880 0.5880 0.6607 0.6607 0.7734 0.7734 0.8946 0.8946 0.9495 0.9495 0.9982 0.9982 1.3602 1.3602 1.4391 1.4391 1.5561 1.5561 9.7687 9.7687 11.2756 11.2756 12.2342 12.2342 12.5812 12.5812 12.7176 12.7176 12.9496 12.9496 k = 0.5000 0.2887 0.2761 ( 5636 PWs) bands (ev): -20.7159 -20.7159 -20.6847 -20.6847 -19.8154 -19.8154 -18.7127 -18.7127 -18.7005 -18.7005 -18.6556 -18.6556 -18.1494 -18.1494 -18.1214 -18.1214 -5.5111 -5.5111 -5.4571 -5.4571 -4.8902 -4.8902 -4.7419 -4.7419 -4.5116 -4.5116 -4.4731 -4.4731 -4.3625 -4.3625 -2.0242 -2.0242 -1.9183 -1.9183 -1.8197 -1.8197 -0.5575 -0.5575 -0.4008 -0.4008 -0.2507 -0.2507 0.1109 0.1109 0.3081 0.3081 0.5846 0.5846 0.6546 0.6546 0.7567 0.7567 0.8912 0.8912 0.9449 0.9449 1.0234 1.0234 1.3650 1.3650 1.4391 1.4391 1.5555 1.5555 9.7551 9.7551 11.2255 11.2255 12.1945 12.1945 12.5903 12.5903 12.7397 12.7397 12.9706 12.9706 k = 0.5000 0.2887 0.2577 ( 5648 PWs) bands (ev): -20.7170 -20.7170 -20.6852 -20.6852 -19.8179 -19.8179 -18.7127 -18.7127 -18.7018 -18.7018 -18.6522 -18.6522 -18.1478 -18.1478 -18.1196 -18.1196 -5.5108 -5.5108 -5.4584 -5.4584 -4.8933 -4.8933 -4.7431 -4.7431 -4.5066 -4.5066 -4.4731 -4.4731 -4.3569 -4.3569 -2.0182 -2.0182 -1.9210 -1.9210 -1.8159 -1.8159 -0.5576 -0.5576 -0.4175 -0.4175 -0.2443 -0.2443 0.1102 0.1102 0.3084 0.3084 0.5809 0.5809 0.6480 0.6480 0.7401 0.7401 0.8849 0.8849 0.9432 0.9432 1.0481 1.0481 1.3696 1.3696 1.4387 1.4387 1.5546 1.5546 9.7421 9.7421 11.1774 11.1774 12.1552 12.1552 12.5994 12.5994 12.7594 12.7594 12.9932 12.9932 k = 0.5000 0.2887 0.2393 ( 5646 PWs) bands (ev): -20.7181 -20.7181 -20.6856 -20.6856 -19.8204 -19.8204 -18.7128 -18.7128 -18.7031 -18.7031 -18.6488 -18.6488 -18.1462 -18.1462 -18.1178 -18.1178 -5.5104 -5.5104 -5.4599 -5.4599 -4.8962 -4.8962 -4.7442 -4.7442 -4.5025 -4.5025 -4.4728 -4.4728 -4.3512 -4.3512 -2.0124 -2.0124 -1.9236 -1.9236 -1.8121 -1.8121 -0.5609 -0.5609 -0.4307 -0.4307 -0.2380 -0.2380 0.1106 0.1106 0.3091 0.3091 0.5770 0.5770 0.6409 0.6409 0.7240 0.7240 0.8766 0.8766 0.9437 0.9437 1.0717 1.0717 1.3739 1.3739 1.4381 1.4381 1.5535 1.5535 9.7297 9.7297 11.1314 11.1314 12.1169 12.1169 12.6085 12.6085 12.7772 12.7772 13.0154 13.0154 k = 0.5000 0.2887 0.2209 ( 5646 PWs) bands (ev): -20.7192 -20.7192 -20.6860 -20.6860 -19.8227 -19.8227 -18.7131 -18.7131 -18.7041 -18.7041 -18.6454 -18.6454 -18.1447 -18.1447 -18.1161 -18.1161 -5.5099 -5.5099 -5.4615 -5.4615 -4.8987 -4.8987 -4.7452 -4.7452 -4.4994 -4.4994 -4.4719 -4.4719 -4.3455 -4.3455 -2.0067 -2.0067 -1.9262 -1.9262 -1.8082 -1.8082 -0.5672 -0.5672 -0.4403 -0.4403 -0.2318 -0.2318 0.1120 0.1120 0.3102 0.3102 0.5729 0.5729 0.6335 0.6335 0.7084 0.7084 0.8674 0.8674 0.9458 0.9458 1.0940 1.0940 1.3779 1.3779 1.4373 1.4373 1.5523 1.5523 9.7180 9.7180 11.0878 11.0878 12.0802 12.0802 12.6173 12.6173 12.7938 12.7938 13.0352 13.0352 k = 0.5000 0.2887 0.2025 ( 5648 PWs) bands (ev): -20.7202 -20.7202 -20.6864 -20.6864 -19.8249 -19.8249 -18.7136 -18.7136 -18.7049 -18.7049 -18.6423 -18.6423 -18.1433 -18.1433 -18.1144 -18.1144 -5.5093 -5.5093 -5.4632 -5.4632 -4.9010 -4.9010 -4.7462 -4.7462 -4.4971 -4.4971 -4.4707 -4.4707 -4.3399 -4.3399 -2.0012 -2.0012 -1.9286 -1.9286 -1.8044 -1.8044 -0.5761 -0.5761 -0.4469 -0.4469 -0.2258 -0.2258 0.1144 0.1144 0.3117 0.3117 0.5685 0.5685 0.6258 0.6258 0.6936 0.6936 0.8579 0.8579 0.9486 0.9486 1.1150 1.1150 1.3815 1.3815 1.4363 1.4363 1.5510 1.5510 9.7071 9.7071 11.0469 11.0469 12.0454 12.0454 12.6258 12.6258 12.8095 12.8095 13.0509 13.0509 k = 0.5000 0.2887 0.1841 ( 5650 PWs) bands (ev): -20.7211 -20.7211 -20.6868 -20.6868 -19.8270 -19.8270 -18.7143 -18.7143 -18.7056 -18.7056 -18.6392 -18.6392 -18.1420 -18.1420 -18.1129 -18.1129 -5.5085 -5.5085 -5.4650 -5.4650 -4.9030 -4.9030 -4.7471 -4.7471 -4.4957 -4.4957 -4.4690 -4.4690 -4.3344 -4.3344 -1.9961 -1.9961 -1.9309 -1.9309 -1.8007 -1.8007 -0.5867 -0.5867 -0.4510 -0.4510 -0.2200 -0.2200 0.1177 0.1177 0.3136 0.3136 0.5640 0.5640 0.6179 0.6179 0.6798 0.6798 0.8487 0.8487 0.9518 0.9518 1.1344 1.1344 1.3848 1.3848 1.4353 1.4353 1.5497 1.5497 9.6970 9.6970 11.0089 11.0089 12.0130 12.0130 12.6339 12.6339 12.8247 12.8247 13.0618 13.0618 k = 0.5000 0.2887 0.1657 ( 5650 PWs) bands (ev): -20.7220 -20.7220 -20.6872 -20.6872 -19.8289 -19.8289 -18.7150 -18.7150 -18.7060 -18.7060 -18.6364 -18.6364 -18.1407 -18.1407 -18.1114 -18.1114 -5.5077 -5.5077 -5.4668 -5.4668 -4.9047 -4.9047 -4.7480 -4.7480 -4.4949 -4.4949 -4.4671 -4.4671 -4.3291 -4.3291 -1.9914 -1.9914 -1.9330 -1.9330 -1.7971 -1.7971 -0.5982 -0.5982 -0.4536 -0.4536 -0.2145 -0.2145 0.1216 0.1216 0.3158 0.3158 0.5593 0.5593 0.6098 0.6098 0.6669 0.6669 0.8401 0.8401 0.9551 0.9551 1.1522 1.1522 1.3877 1.3877 1.4342 1.4342 1.5483 1.5483 9.6878 9.6878 10.9739 10.9739 11.9831 11.9831 12.6416 12.6416 12.8397 12.8397 13.0676 13.0676 k = 0.5000 0.2887 0.1473 ( 5658 PWs) bands (ev): -20.7228 -20.7228 -20.6875 -20.6875 -19.8307 -19.8307 -18.7158 -18.7158 -18.7063 -18.7063 -18.6338 -18.6338 -18.1396 -18.1396 -18.1101 -18.1101 -5.5068 -5.5068 -5.4687 -5.4687 -4.9063 -4.9063 -4.7488 -4.7488 -4.4945 -4.4945 -4.4651 -4.4651 -4.3242 -4.3242 -1.9872 -1.9872 -1.9348 -1.9348 -1.7937 -1.7937 -0.6097 -0.6097 -0.4552 -0.4552 -0.2094 -0.2094 0.1261 0.1261 0.3183 0.3183 0.5546 0.5546 0.6018 0.6018 0.6553 0.6553 0.8321 0.8321 0.9584 0.9584 1.1683 1.1683 1.3901 1.3901 1.4331 1.4331 1.5470 1.5470 9.6795 9.6795 10.9421 10.9421 11.9559 11.9559 12.6487 12.6487 12.8544 12.8544 13.0690 13.0690 k = 0.5000 0.2887 0.1289 ( 5660 PWs) bands (ev): -20.7235 -20.7235 -20.6879 -20.6879 -19.8323 -19.8323 -18.7166 -18.7166 -18.7065 -18.7065 -18.6314 -18.6314 -18.1385 -18.1385 -18.1089 -18.1089 -5.5058 -5.5058 -5.4705 -5.4705 -4.9075 -4.9075 -4.7496 -4.7496 -4.4944 -4.4944 -4.4632 -4.4632 -4.3197 -4.3197 -1.9836 -1.9836 -1.9363 -1.9363 -1.7905 -1.7905 -0.6207 -0.6207 -0.4563 -0.4563 -0.2047 -0.2047 0.1308 0.1308 0.3210 0.3210 0.5499 0.5499 0.5940 0.5940 0.6450 0.6450 0.8250 0.8250 0.9615 0.9615 1.1827 1.1827 1.3922 1.3922 1.4322 1.4322 1.5457 1.5457 9.6721 9.6721 10.9137 10.9137 11.9316 11.9316 12.6551 12.6551 12.8690 12.8690 13.0666 13.0666 k = 0.5000 0.2887 0.1105 ( 5664 PWs) bands (ev): -20.7241 -20.7241 -20.6881 -20.6881 -19.8337 -19.8337 -18.7174 -18.7174 -18.7067 -18.7067 -18.6293 -18.6293 -18.1376 -18.1376 -18.1079 -18.1079 -5.5048 -5.5048 -5.4724 -5.4724 -4.9086 -4.9086 -4.7502 -4.7502 -4.4945 -4.4945 -4.4615 -4.4615 -4.3156 -4.3156 -1.9805 -1.9805 -1.9374 -1.9374 -1.7876 -1.7876 -0.6308 -0.6308 -0.4570 -0.4570 -0.2006 -0.2006 0.1356 0.1356 0.3237 0.3237 0.5452 0.5452 0.5866 0.5866 0.6361 0.6361 0.8187 0.8187 0.9644 0.9644 1.1952 1.1952 1.3938 1.3938 1.4313 1.4313 1.5446 1.5446 9.6657 9.6657 10.8888 10.8888 11.9103 11.9103 12.6609 12.6609 12.8834 12.8834 13.0614 13.0614 k = 0.5000 0.2887 0.0920 ( 5670 PWs) bands (ev): -20.7247 -20.7247 -20.6884 -20.6884 -19.8349 -19.8349 -18.7181 -18.7181 -18.7068 -18.7068 -18.6275 -18.6275 -18.1368 -18.1368 -18.1070 -18.1070 -5.5038 -5.5038 -5.4741 -5.4741 -4.9095 -4.9095 -4.7508 -4.7508 -4.4946 -4.4946 -4.4599 -4.4599 -4.3121 -4.3121 -1.9780 -1.9780 -1.9383 -1.9383 -1.7851 -1.7851 -0.6397 -0.6397 -0.4576 -0.4576 -0.1969 -0.1969 0.1401 0.1401 0.3265 0.3265 0.5409 0.5409 0.5798 0.5798 0.6285 0.6285 0.8134 0.8134 0.9669 0.9669 1.2059 1.2059 1.3950 1.3950 1.4306 1.4306 1.5435 1.5435 9.6602 9.6602 10.8675 10.8675 11.8921 11.8921 12.6658 12.6658 12.8975 12.8975 13.0542 13.0542 k = 0.5000 0.2887 0.0736 ( 5662 PWs) bands (ev): -20.7251 -20.7251 -20.6886 -20.6886 -19.8359 -19.8359 -18.7187 -18.7187 -18.7068 -18.7068 -18.6260 -18.6260 -18.1361 -18.1361 -18.1062 -18.1062 -5.5027 -5.5027 -5.4757 -5.4757 -4.9102 -4.9102 -4.7513 -4.7513 -4.4947 -4.4947 -4.4586 -4.4586 -4.3092 -4.3092 -1.9761 -1.9761 -1.9389 -1.9389 -1.7829 -1.7829 -0.6472 -0.6472 -0.4580 -0.4580 -0.1939 -0.1939 0.1443 0.1443 0.3290 0.3290 0.5369 0.5369 0.5738 0.5738 0.6224 0.6224 0.8090 0.8090 0.9691 0.9691 1.2147 1.2147 1.3958 1.3958 1.4301 1.4301 1.5426 1.5426 9.6558 9.6558 10.8500 10.8500 11.8772 11.8772 12.6699 12.6699 12.9110 12.9110 13.0457 13.0457 k = 0.5000 0.2887 0.0552 ( 5664 PWs) bands (ev): -20.7255 -20.7255 -20.6887 -20.6887 -19.8367 -19.8367 -18.7191 -18.7191 -18.7068 -18.7068 -18.6248 -18.6248 -18.1356 -18.1356 -18.1056 -18.1056 -5.5018 -5.5018 -5.4771 -5.4771 -4.9107 -4.9107 -4.7518 -4.7518 -4.4949 -4.4949 -4.4576 -4.4576 -4.3068 -4.3068 -1.9747 -1.9747 -1.9392 -1.9392 -1.7811 -1.7811 -0.6532 -0.6532 -0.4584 -0.4584 -0.1915 -0.1915 0.1478 0.1478 0.3312 0.3312 0.5336 0.5336 0.5689 0.5689 0.6177 0.6177 0.8056 0.8056 0.9708 0.9708 1.2216 1.2216 1.3964 1.3964 1.4298 1.4298 1.5419 1.5419 9.6523 9.6523 10.8363 10.8363 11.8655 11.8655 12.6732 12.6732 12.9235 12.9235 13.0368 13.0368 k = 0.5000 0.2887 0.0368 ( 5668 PWs) bands (ev): -20.7257 -20.7257 -20.6889 -20.6889 -19.8373 -19.8373 -18.7195 -18.7195 -18.7069 -18.7069 -18.6239 -18.6239 -18.1352 -18.1352 -18.1052 -18.1052 -5.5011 -5.5011 -5.4782 -5.4782 -4.9111 -4.9111 -4.7520 -4.7520 -4.4950 -4.4950 -4.4569 -4.4569 -4.3051 -4.3051 -1.9738 -1.9738 -1.9394 -1.9394 -1.7798 -1.7798 -0.6575 -0.6575 -0.4586 -0.4586 -0.1897 -0.1897 0.1504 0.1504 0.3329 0.3329 0.5310 0.5310 0.5653 0.5653 0.6143 0.6143 0.8032 0.8032 0.9720 0.9720 1.2265 1.2265 1.3968 1.3968 1.4295 1.4295 1.5414 1.5414 9.6498 9.6498 10.8264 10.8264 11.8571 11.8571 12.6755 12.6755 12.9344 12.9344 13.0284 13.0284 k = 0.5000 0.2887 0.0184 ( 5660 PWs) bands (ev): -20.7259 -20.7259 -20.6889 -20.6889 -19.8376 -19.8376 -18.7197 -18.7197 -18.7069 -18.7069 -18.6234 -18.6234 -18.1350 -18.1350 -18.1049 -18.1049 -5.5006 -5.5006 -5.4789 -5.4789 -4.9113 -4.9113 -4.7522 -4.7522 -4.4951 -4.4951 -4.4564 -4.4564 -4.3041 -4.3041 -1.9733 -1.9733 -1.9394 -1.9394 -1.7790 -1.7790 -0.6602 -0.6602 -0.4588 -0.4588 -0.1887 -0.1887 0.1521 0.1521 0.3340 0.3340 0.5294 0.5294 0.5630 0.5630 0.6123 0.6123 0.8018 0.8018 0.9728 0.9728 1.2295 1.2295 1.3970 1.3970 1.4294 1.4294 1.5411 1.5411 9.6483 9.6483 10.8205 10.8205 11.8520 11.8520 12.6769 12.6769 12.9421 12.9421 13.0220 13.0220 k = 0.5000 0.2887-0.0000 ( 5654 PWs) bands (ev): -20.7259 -20.7259 -20.6890 -20.6890 -19.8377 -19.8377 -18.7198 -18.7198 -18.7069 -18.7069 -18.6232 -18.6232 -18.1349 -18.1349 -18.1049 -18.1049 -5.5004 -5.5004 -5.4791 -5.4791 -4.9114 -4.9114 -4.7523 -4.7523 -4.4951 -4.4951 -4.4563 -4.4563 -4.3037 -4.3037 -1.9731 -1.9731 -1.9394 -1.9394 -1.7788 -1.7788 -0.6610 -0.6610 -0.4589 -0.4589 -0.1883 -0.1883 0.1526 0.1526 0.3344 0.3344 0.5289 0.5289 0.5622 0.5622 0.6117 0.6117 0.8013 0.8013 0.9730 0.9730 1.2305 1.2305 1.3971 1.3971 1.4293 1.4293 1.5410 1.5410 9.6478 9.6478 10.8185 10.8185 11.8503 11.8503 12.6774 12.6774 12.9450 12.9450 13.0196 13.0196 k = 0.3333 0.5774-0.0000 ( 5664 PWs) bands (ev): -20.7019 -20.7019 -20.7018 -20.7018 -19.8529 -19.8529 -18.7166 -18.7166 -18.7081 -18.7081 -18.6225 -18.6225 -18.1210 -18.1210 -18.1210 -18.1210 -5.5283 -5.5283 -5.4394 -5.4394 -4.9451 -4.9451 -4.5951 -4.5951 -4.5708 -4.5708 -4.4237 -4.4237 -4.3323 -4.3323 -1.9437 -1.9437 -1.9117 -1.9117 -1.7973 -1.7973 -0.6273 -0.6273 -0.4044 -0.4044 -0.3792 -0.3792 0.1792 0.1792 0.1899 0.1899 0.6277 0.6277 0.6562 0.6562 0.6771 0.6771 0.7753 0.7753 0.7957 0.7957 1.2268 1.2268 1.3934 1.3934 1.4602 1.4602 1.4715 1.4715 9.8395 9.8395 11.3138 11.3138 11.3244 11.3244 12.4296 12.4296 13.0461 13.0461 13.0549 13.0549 k = 0.3333 0.5774 0.0184 ( 5676 PWs) bands (ev): -20.7018 -20.7018 -20.7018 -20.7018 -19.8527 -19.8527 -18.7166 -18.7166 -18.7081 -18.7081 -18.6227 -18.6227 -18.1211 -18.1211 -18.1211 -18.1211 -5.5281 -5.5281 -5.4395 -5.4395 -4.9450 -4.9450 -4.5952 -4.5952 -4.5708 -4.5708 -4.4237 -4.4237 -4.3324 -4.3324 -1.9440 -1.9440 -1.9120 -1.9120 -1.7974 -1.7974 -0.6264 -0.6264 -0.4044 -0.4044 -0.3794 -0.3794 0.1793 0.1793 0.1898 0.1898 0.6278 0.6278 0.6568 0.6568 0.6776 0.6776 0.7754 0.7754 0.7957 0.7957 1.2259 1.2259 1.3932 1.3932 1.4603 1.4603 1.4717 1.4717 9.8399 9.8399 11.3154 11.3154 11.3261 11.3261 12.4301 12.4301 13.0449 13.0449 13.0536 13.0536 k = 0.3333 0.5774 0.0368 ( 5688 PWs) bands (ev): -20.7018 -20.7018 -20.7017 -20.7017 -19.8523 -19.8523 -18.7165 -18.7165 -18.7080 -18.7080 -18.6232 -18.6232 -18.1213 -18.1213 -18.1213 -18.1213 -5.5275 -5.5275 -5.4397 -5.4397 -4.9446 -4.9446 -4.5957 -4.5957 -4.5709 -4.5709 -4.4240 -4.4240 -4.3330 -4.3330 -1.9447 -1.9447 -1.9128 -1.9128 -1.7979 -1.7979 -0.6237 -0.6237 -0.4047 -0.4047 -0.3797 -0.3797 0.1795 0.1795 0.1898 0.1898 0.6282 0.6282 0.6586 0.6586 0.6790 0.6790 0.7755 0.7755 0.7956 0.7956 1.2231 1.2231 1.3927 1.3927 1.4607 1.4607 1.4721 1.4721 9.8411 9.8411 11.3203 11.3203 11.3309 11.3309 12.4316 12.4316 13.0413 13.0413 13.0500 13.0500 k = 0.3333 0.5774 0.0552 ( 5676 PWs) bands (ev): -20.7016 -20.7016 -20.7015 -20.7015 -19.8516 -19.8516 -18.7163 -18.7163 -18.7078 -18.7078 -18.6242 -18.6242 -18.1217 -18.1217 -18.1217 -18.1217 -5.5266 -5.5266 -5.4402 -5.4402 -4.9438 -4.9438 -4.5964 -4.5964 -4.5711 -4.5711 -4.4244 -4.4244 -4.3338 -4.3338 -1.9459 -1.9459 -1.9141 -1.9141 -1.7987 -1.7987 -0.6193 -0.6193 -0.4052 -0.4052 -0.3803 -0.3803 0.1799 0.1799 0.1896 0.1896 0.6289 0.6289 0.6616 0.6616 0.6813 0.6813 0.7757 0.7757 0.7956 0.7956 1.2185 1.2185 1.3918 1.3918 1.4614 1.4614 1.4730 1.4730 9.8430 9.8430 11.3285 11.3285 11.3390 11.3390 12.4340 12.4340 13.0355 13.0355 13.0441 13.0441 k = 0.3333 0.5774 0.0736 ( 5679 PWs) bands (ev): -20.7014 -20.7014 -20.7013 -20.7013 -19.8506 -19.8506 -18.7161 -18.7161 -18.7076 -18.7076 -18.6255 -18.6255 -18.1223 -18.1223 -18.1223 -18.1223 -5.5253 -5.5253 -5.4407 -5.4407 -4.9428 -4.9428 -4.5975 -4.5975 -4.5713 -4.5713 -4.4250 -4.4250 -4.3350 -4.3350 -1.9476 -1.9476 -1.9159 -1.9159 -1.7998 -1.7998 -0.6131 -0.6131 -0.4059 -0.4059 -0.3812 -0.3812 0.1805 0.1805 0.1895 0.1895 0.6299 0.6299 0.6657 0.6657 0.6844 0.6844 0.7762 0.7762 0.7956 0.7956 1.2120 1.2120 1.3905 1.3905 1.4623 1.4623 1.4741 1.4741 9.8457 9.8457 11.3399 11.3399 11.3503 11.3503 12.4374 12.4374 13.0275 13.0275 13.0361 13.0361 k = 0.3333 0.5774 0.0920 ( 5685 PWs) bands (ev): -20.7011 -20.7011 -20.7010 -20.7010 -19.8494 -19.8494 -18.7158 -18.7158 -18.7073 -18.7073 -18.6271 -18.6271 -18.1230 -18.1230 -18.1230 -18.1230 -5.5237 -5.5237 -5.4415 -5.4415 -4.9414 -4.9414 -4.5988 -4.5988 -4.5716 -4.5716 -4.4258 -4.4258 -4.3366 -4.3366 -1.9497 -1.9497 -1.9181 -1.9181 -1.8013 -1.8013 -0.6051 -0.6051 -0.4069 -0.4069 -0.3824 -0.3824 0.1813 0.1813 0.1895 0.1895 0.6312 0.6312 0.6708 0.6708 0.6881 0.6881 0.7770 0.7770 0.7956 0.7956 1.2038 1.2038 1.3889 1.3889 1.4635 1.4635 1.4754 1.4754 9.8490 9.8490 11.3544 11.3544 11.3647 11.3647 12.4415 12.4415 13.0176 13.0176 13.0260 13.0260 k = 0.3333 0.5774 0.1105 ( 5661 PWs) bands (ev): -20.7008 -20.7008 -20.7007 -20.7007 -19.8478 -19.8478 -18.7155 -18.7155 -18.7069 -18.7069 -18.6290 -18.6290 -18.1238 -18.1238 -18.1238 -18.1238 -5.5217 -5.5217 -5.4424 -5.4424 -4.9396 -4.9396 -4.6004 -4.6004 -4.5719 -4.5719 -4.4267 -4.4267 -4.3385 -4.3385 -1.9522 -1.9522 -1.9208 -1.9208 -1.8030 -1.8030 -0.5954 -0.5954 -0.4082 -0.4082 -0.3840 -0.3840 0.1824 0.1824 0.1896 0.1896 0.6327 0.6327 0.6768 0.6768 0.6923 0.6923 0.7784 0.7784 0.7959 0.7959 1.1937 1.1937 1.3869 1.3869 1.4648 1.4648 1.4771 1.4771 9.8531 9.8531 11.3721 11.3721 11.3822 11.3822 12.4464 12.4464 13.0059 13.0059 13.0143 13.0143 k = 0.3333 0.5774 0.1289 ( 5664 PWs) bands (ev): -20.7004 -20.7004 -20.7003 -20.7003 -19.8461 -19.8461 -18.7151 -18.7151 -18.7065 -18.7065 -18.6313 -18.6313 -18.1248 -18.1248 -18.1248 -18.1248 -5.5194 -5.5194 -5.4434 -5.4434 -4.9376 -4.9376 -4.6023 -4.6023 -4.5723 -4.5723 -4.4278 -4.4278 -4.3408 -4.3408 -1.9551 -1.9551 -1.9238 -1.9238 -1.8050 -1.8050 -0.5839 -0.5839 -0.4099 -0.4099 -0.3859 -0.3859 0.1837 0.1837 0.1898 0.1898 0.6344 0.6344 0.6835 0.6835 0.6967 0.6967 0.7805 0.7805 0.7965 0.7965 1.1818 1.1818 1.3846 1.3846 1.4663 1.4663 1.4788 1.4788 9.8579 9.8579 11.3928 11.3928 11.4027 11.4027 12.4520 12.4520 12.9928 12.9928 13.0010 13.0010 k = 0.3333 0.5774 0.1473 ( 5664 PWs) bands (ev): -20.6999 -20.6999 -20.6999 -20.6999 -19.8441 -19.8441 -18.7146 -18.7146 -18.7060 -18.7060 -18.6339 -18.6339 -18.1259 -18.1259 -18.1259 -18.1259 -5.5168 -5.5168 -5.4446 -5.4446 -4.9351 -4.9351 -4.6044 -4.6044 -4.5728 -4.5728 -4.4291 -4.4291 -4.3435 -4.3435 -1.9582 -1.9582 -1.9271 -1.9271 -1.8072 -1.8072 -0.5708 -0.5708 -0.4120 -0.4120 -0.3882 -0.3882 0.1854 0.1854 0.1903 0.1903 0.6364 0.6364 0.6907 0.6907 0.7009 0.7009 0.7836 0.7836 0.7975 0.7975 1.1681 1.1681 1.3819 1.3819 1.4680 1.4680 1.4807 1.4807 9.8633 9.8633 11.4164 11.4164 11.4260 11.4260 12.4580 12.4580 12.9785 12.9785 12.9865 12.9865 k = 0.3333 0.5774 0.1657 ( 5667 PWs) bands (ev): -20.6995 -20.6995 -20.6994 -20.6994 -19.8419 -19.8419 -18.7141 -18.7141 -18.7055 -18.7055 -18.6368 -18.6368 -18.1272 -18.1272 -18.1271 -18.1271 -5.5140 -5.5140 -5.4459 -5.4459 -4.9322 -4.9322 -4.6067 -4.6067 -4.5733 -4.5733 -4.4306 -4.4306 -4.3466 -4.3466 -1.9616 -1.9616 -1.9308 -1.9308 -1.8097 -1.8097 -0.5559 -0.5559 -0.4145 -0.4145 -0.3910 -0.3910 0.1874 0.1874 0.1910 0.1910 0.6386 0.6386 0.6982 0.6982 0.7048 0.7048 0.7880 0.7880 0.7992 0.7992 1.1527 1.1527 1.3789 1.3789 1.4696 1.4696 1.4826 1.4826 9.8693 9.8693 11.4428 11.4428 11.4522 11.4522 12.4644 12.4644 12.9632 12.9632 12.9711 12.9711 k = 0.3333 0.5774 0.1841 ( 5649 PWs) bands (ev): -20.6989 -20.6989 -20.6989 -20.6989 -19.8395 -19.8395 -18.7135 -18.7135 -18.7049 -18.7049 -18.6399 -18.6399 -18.1285 -18.1285 -18.1285 -18.1285 -5.5110 -5.5110 -5.4473 -5.4473 -4.9289 -4.9289 -4.6091 -4.6091 -4.5739 -4.5739 -4.4323 -4.4323 -4.3501 -4.3501 -1.9652 -1.9652 -1.9346 -1.9346 -1.8124 -1.8124 -0.5395 -0.5395 -0.4175 -0.4175 -0.3942 -0.3942 0.1898 0.1898 0.1920 0.1920 0.6410 0.6410 0.7057 0.7057 0.7080 0.7080 0.7939 0.7939 0.8018 0.8018 1.1356 1.1356 1.3756 1.3756 1.4713 1.4713 1.4846 1.4846 9.8759 9.8759 11.4719 11.4719 11.4809 11.4809 12.4709 12.4709 12.9474 12.9474 12.9551 12.9551 k = 0.3333 0.5774 0.2025 ( 5649 PWs) bands (ev): -20.6984 -20.6984 -20.6983 -20.6983 -19.8369 -19.8369 -18.7129 -18.7129 -18.7042 -18.7042 -18.6433 -18.6433 -18.1299 -18.1299 -18.1299 -18.1299 -5.5078 -5.5078 -5.4487 -5.4487 -4.9251 -4.9251 -4.6118 -4.6118 -4.5745 -4.5745 -4.4343 -4.4343 -4.3540 -4.3540 -1.9690 -1.9690 -1.9386 -1.9386 -1.8152 -1.8152 -0.5215 -0.5215 -0.4209 -0.4209 -0.3977 -0.3977 0.1925 0.1925 0.1934 0.1934 0.6437 0.6437 0.7104 0.7104 0.7127 0.7127 0.8013 0.8013 0.8056 0.8056 1.1169 1.1169 1.3720 1.3720 1.4730 1.4730 1.4865 1.4865 9.8830 9.8830 11.5034 11.5034 11.5121 11.5121 12.4775 12.4775 12.9311 12.9311 12.9386 12.9386 k = 0.3333 0.5774 0.2209 ( 5643 PWs) bands (ev): -20.6978 -20.6978 -20.6977 -20.6977 -19.8341 -19.8341 -18.7123 -18.7123 -18.7036 -18.7036 -18.6468 -18.6468 -18.1314 -18.1314 -18.1314 -18.1314 -5.5044 -5.5044 -5.4503 -5.4503 -4.9209 -4.9209 -4.6146 -4.6146 -4.5752 -4.5752 -4.4365 -4.4365 -4.3581 -4.3581 -1.9729 -1.9729 -1.9427 -1.9427 -1.8183 -1.8183 -0.5020 -0.5020 -0.4249 -0.4249 -0.4016 -0.4016 0.1952 0.1952 0.1956 0.1956 0.6464 0.6464 0.7120 0.7120 0.7190 0.7190 0.8104 0.8104 0.8108 0.8108 1.0966 1.0966 1.3682 1.3682 1.4745 1.4745 1.4883 1.4883 9.8905 9.8905 11.5373 11.5373 11.5456 11.5456 12.4840 12.4840 12.9148 12.9148 12.9220 12.9220 k = 0.3333 0.5774 0.2393 ( 5649 PWs) bands (ev): -20.6972 -20.6972 -20.6971 -20.6971 -19.8312 -19.8312 -18.7116 -18.7116 -18.7029 -18.7029 -18.6505 -18.6505 -18.1330 -18.1330 -18.1330 -18.1330 -5.5010 -5.5010 -5.4519 -5.4519 -4.9162 -4.9162 -4.6175 -4.6175 -4.5760 -4.5760 -4.4389 -4.4389 -4.3626 -4.3626 -1.9768 -1.9768 -1.9469 -1.9469 -1.8215 -1.8215 -0.4813 -0.4813 -0.4293 -0.4293 -0.4057 -0.4057 0.1973 0.1973 0.1990 0.1990 0.6494 0.6494 0.7128 0.7128 0.7243 0.7243 0.8178 0.8178 0.8209 0.8209 1.0747 1.0747 1.3641 1.3641 1.4759 1.4759 1.4899 1.4899 9.8984 9.8984 11.5732 11.5732 11.5811 11.5811 12.4901 12.4901 12.8987 12.8987 12.9057 12.9057 k = 0.3333 0.5774 0.2577 ( 5628 PWs) bands (ev): -20.6965 -20.6965 -20.6965 -20.6965 -19.8282 -19.8282 -18.7110 -18.7110 -18.7021 -18.7021 -18.6544 -18.6544 -18.1347 -18.1347 -18.1347 -18.1347 -5.4974 -5.4974 -5.4535 -5.4535 -4.9109 -4.9109 -4.6205 -4.6205 -4.5768 -4.5768 -4.4418 -4.4418 -4.3674 -4.3674 -1.9807 -1.9807 -1.9511 -1.9511 -1.8247 -1.8247 -0.4597 -0.4597 -0.4341 -0.4341 -0.4095 -0.4095 0.1997 0.1997 0.2027 0.2027 0.6524 0.6524 0.7130 0.7130 0.7285 0.7285 0.8265 0.8265 0.8326 0.8326 1.0513 1.0513 1.3598 1.3598 1.4771 1.4771 1.4914 1.4914 9.9067 9.9067 11.6109 11.6109 11.6184 11.6184 12.4957 12.4957 12.8830 12.8830 12.8897 12.8897 k = 0.3333 0.5774 0.2761 ( 5628 PWs) bands (ev): -20.6959 -20.6959 -20.6958 -20.6958 -19.8251 -19.8251 -18.7103 -18.7103 -18.7014 -18.7014 -18.6584 -18.6584 -18.1364 -18.1364 -18.1364 -18.1364 -5.4938 -5.4938 -5.4552 -5.4552 -4.9051 -4.9051 -4.6237 -4.6237 -4.5777 -4.5777 -4.4450 -4.4450 -4.3723 -4.3723 -1.9846 -1.9846 -1.9553 -1.9553 -1.8281 -1.8281 -0.4397 -0.4397 -0.4394 -0.4394 -0.4108 -0.4108 0.2025 0.2025 0.2066 0.2066 0.6556 0.6556 0.7127 0.7127 0.7315 0.7315 0.8367 0.8367 0.8453 0.8453 1.0266 1.0266 1.3554 1.3554 1.4781 1.4781 1.4926 1.4926 9.9152 9.9152 11.6502 11.6502 11.6573 11.6573 12.5007 12.5007 12.8680 12.8680 12.8744 12.8744 k = 0.3333 0.5774 0.2946 ( 5634 PWs) bands (ev): -20.6952 -20.6952 -20.6952 -20.6952 -19.8219 -19.8219 -18.7096 -18.7096 -18.7006 -18.7006 -18.6624 -18.6624 -18.1381 -18.1381 -18.1381 -18.1381 -5.4902 -5.4902 -5.4569 -5.4569 -4.8988 -4.8988 -4.6269 -4.6269 -4.5786 -4.5786 -4.4486 -4.4486 -4.3774 -4.3774 -1.9884 -1.9884 -1.9594 -1.9594 -1.8315 -1.8315 -0.4450 -0.4450 -0.4307 -0.4307 -0.3999 -0.3999 0.2055 0.2055 0.2107 0.2107 0.6589 0.6589 0.7120 0.7120 0.7336 0.7336 0.8483 0.8483 0.8588 0.8588 1.0005 1.0005 1.3509 1.3509 1.4787 1.4787 1.4935 1.4935 9.9239 9.9239 11.6907 11.6907 11.6973 11.6973 12.5050 12.5050 12.8539 12.8539 12.8600 12.8600 k = 0.3333 0.5774 0.3130 ( 5634 PWs) bands (ev): -20.6945 -20.6945 -20.6945 -20.6945 -19.8187 -19.8187 -18.7089 -18.7089 -18.6999 -18.6999 -18.6664 -18.6664 -18.1398 -18.1398 -18.1398 -18.1398 -5.4867 -5.4867 -5.4586 -5.4586 -4.8919 -4.8919 -4.6302 -4.6302 -4.5795 -4.5795 -4.4527 -4.4527 -4.3824 -4.3824 -1.9922 -1.9922 -1.9633 -1.9633 -1.8349 -1.8349 -0.4509 -0.4509 -0.4330 -0.4330 -0.3768 -0.3768 0.2087 0.2087 0.2149 0.2149 0.6621 0.6621 0.7111 0.7111 0.7350 0.7350 0.8609 0.8609 0.8730 0.8730 0.9733 0.9733 1.3463 1.3463 1.4791 1.4791 1.4941 1.4941 9.9328 9.9328 11.7321 11.7321 11.7382 11.7382 12.5084 12.5084 12.8410 12.8410 12.8467 12.8467 k = 0.3333 0.5774 0.3314 ( 5646 PWs) bands (ev): -20.6939 -20.6939 -20.6938 -20.6938 -19.8154 -19.8154 -18.7083 -18.7083 -18.6991 -18.6991 -18.6705 -18.6705 -18.1416 -18.1416 -18.1416 -18.1416 -5.4832 -5.4832 -5.4602 -5.4602 -4.8845 -4.8845 -4.6336 -4.6336 -4.5804 -4.5804 -4.4574 -4.4574 -4.3873 -4.3873 -1.9958 -1.9958 -1.9672 -1.9672 -1.8382 -1.8382 -0.4570 -0.4570 -0.4379 -0.4379 -0.3500 -0.3500 0.2121 0.2121 0.2192 0.2192 0.6654 0.6654 0.7101 0.7101 0.7358 0.7358 0.8743 0.8743 0.8874 0.8874 0.9451 0.9451 1.3416 1.3416 1.4790 1.4790 1.4943 1.4943 9.9416 9.9416 11.7738 11.7738 11.7795 11.7795 12.5109 12.5109 12.8295 12.8295 12.8347 12.8347 k = 0.3333 0.5774 0.3498 ( 5655 PWs) bands (ev): -20.6932 -20.6932 -20.6932 -20.6932 -19.8122 -19.8122 -18.7076 -18.7076 -18.6983 -18.6983 -18.6745 -18.6745 -18.1433 -18.1433 -18.1433 -18.1433 -5.4798 -5.4798 -5.4618 -5.4618 -4.8765 -4.8765 -4.6370 -4.6370 -4.5814 -4.5814 -4.4626 -4.4626 -4.3921 -4.3921 -1.9992 -1.9992 -1.9708 -1.9708 -1.8416 -1.8416 -0.4632 -0.4632 -0.4435 -0.4435 -0.3217 -0.3217 0.2156 0.2156 0.2235 0.2235 0.6686 0.6686 0.7089 0.7089 0.7362 0.7362 0.8881 0.8881 0.9015 0.9015 0.9167 0.9167 1.3369 1.3369 1.4787 1.4787 1.4943 1.4943 9.9505 9.9505 11.8156 11.8156 11.8208 11.8208 12.5126 12.5126 12.8196 12.8196 12.8243 12.8243 k = 0.3333 0.5774 0.3682 ( 5661 PWs) bands (ev): -20.6926 -20.6926 -20.6926 -20.6926 -19.8091 -19.8091 -18.7071 -18.7071 -18.6976 -18.6976 -18.6783 -18.6783 -18.1450 -18.1450 -18.1450 -18.1450 -5.4766 -5.4766 -5.4634 -5.4634 -4.8680 -4.8680 -4.6406 -4.6406 -4.5824 -4.5824 -4.4684 -4.4684 -4.3966 -4.3966 -2.0024 -2.0024 -1.9743 -1.9743 -1.8448 -1.8448 -0.4695 -0.4695 -0.4493 -0.4493 -0.2922 -0.2922 0.2192 0.2192 0.2277 0.2277 0.6717 0.6717 0.7077 0.7077 0.7364 0.7364 0.8854 0.8854 0.9022 0.9022 0.9176 0.9176 1.3323 1.3323 1.4780 1.4780 1.4939 1.4939 9.9592 9.9592 11.8568 11.8568 11.8616 11.8616 12.5133 12.5133 12.8115 12.8115 12.8157 12.8157 k = 0.3333 0.5774 0.3866 ( 5670 PWs) bands (ev): -20.6920 -20.6920 -20.6919 -20.6919 -19.8061 -19.8061 -18.7066 -18.7066 -18.6969 -18.6969 -18.6820 -18.6820 -18.1466 -18.1466 -18.1466 -18.1466 -5.4735 -5.4735 -5.4649 -5.4649 -4.8590 -4.8590 -4.6442 -4.6442 -4.5833 -4.5833 -4.4748 -4.4748 -4.4007 -4.4007 -2.0054 -2.0054 -1.9776 -1.9776 -1.8480 -1.8480 -0.4757 -0.4757 -0.4552 -0.4552 -0.2619 -0.2619 0.2227 0.2227 0.2318 0.2318 0.6745 0.6745 0.7065 0.7065 0.7363 0.7363 0.8553 0.8553 0.9163 0.9163 0.9321 0.9321 1.3278 1.3278 1.4770 1.4770 1.4931 1.4931 9.9677 9.9677 11.8971 11.8971 11.9014 11.9014 12.5133 12.5133 12.8054 12.8054 12.8089 12.8089 k = 0.3333 0.5774 0.4050 ( 5670 PWs) bands (ev): -20.6914 -20.6914 -20.6913 -20.6913 -19.8031 -19.8031 -18.7062 -18.7062 -18.6962 -18.6962 -18.6855 -18.6855 -18.1482 -18.1482 -18.1482 -18.1482 -5.4705 -5.4705 -5.4664 -5.4664 -4.8496 -4.8496 -4.6480 -4.6480 -4.5843 -4.5843 -4.4817 -4.4817 -4.4044 -4.4044 -2.0082 -2.0082 -1.9806 -1.9806 -1.8510 -1.8510 -0.4818 -0.4818 -0.4609 -0.4609 -0.2311 -0.2311 0.2262 0.2262 0.2358 0.2358 0.6769 0.6769 0.7053 0.7053 0.7362 0.7362 0.8250 0.8250 0.9303 0.9303 0.9464 0.9464 1.3234 1.3234 1.4757 1.4757 1.4921 1.4921 9.9760 9.9760 11.9357 11.9357 11.9397 11.9397 12.5126 12.5126 12.8013 12.8013 12.8041 12.8041 k = 0.3333 0.5774 0.4234 ( 5664 PWs) bands (ev): -20.6908 -20.6908 -20.6908 -20.6908 -19.8003 -19.8003 -18.7060 -18.7060 -18.6955 -18.6955 -18.6886 -18.6886 -18.1497 -18.1497 -18.1496 -18.1496 -5.4678 -5.4678 -5.4677 -5.4677 -4.8397 -4.8397 -4.6520 -4.6520 -4.5852 -4.5852 -4.4889 -4.4889 -4.4078 -4.4078 -2.0108 -2.0108 -1.9833 -1.9833 -1.8538 -1.8538 -0.4877 -0.4877 -0.4664 -0.4664 -0.1999 -0.1999 0.2295 0.2295 0.2396 0.2396 0.6786 0.6786 0.7040 0.7040 0.7360 0.7360 0.7951 0.7951 0.9438 0.9438 0.9604 0.9604 1.3192 1.3192 1.4741 1.4741 1.4909 1.4909 9.9839 9.9839 11.9723 11.9723 11.9760 11.9760 12.5114 12.5114 12.7994 12.7994 12.8014 12.8014 k = 0.3333 0.5774 0.4418 ( 5664 PWs) bands (ev): -20.6903 -20.6903 -20.6903 -20.6903 -19.7976 -19.7976 -18.7060 -18.7060 -18.6949 -18.6949 -18.6914 -18.6914 -18.1511 -18.1511 -18.1510 -18.1510 -5.4690 -5.4690 -5.4653 -5.4653 -4.8295 -4.8295 -4.6562 -4.6562 -4.5860 -4.5860 -4.4963 -4.4963 -4.4107 -4.4107 -2.0131 -2.0131 -1.9858 -1.9858 -1.8565 -1.8565 -0.4933 -0.4933 -0.4717 -0.4717 -0.1687 -0.1687 0.2327 0.2327 0.2430 0.2430 0.6787 0.6787 0.7027 0.7027 0.7358 0.7358 0.7668 0.7668 0.9567 0.9567 0.9737 0.9737 1.3152 1.3152 1.4723 1.4723 1.4894 1.4894 9.9913 9.9913 12.0064 12.0064 12.0097 12.0097 12.5097 12.5097 12.7996 12.7996 12.8007 12.8007 k = 0.3333 0.5774 0.4602 ( 5688 PWs) bands (ev): -20.6898 -20.6898 -20.6898 -20.6898 -19.7952 -19.7952 -18.7063 -18.7063 -18.6943 -18.6943 -18.6936 -18.6936 -18.1524 -18.1524 -18.1523 -18.1523 -5.4702 -5.4702 -5.4630 -5.4630 -4.8190 -4.8190 -4.6607 -4.6607 -4.5869 -4.5869 -4.5037 -4.5037 -4.4133 -4.4133 -2.0152 -2.0152 -1.9881 -1.9881 -1.8589 -1.8589 -0.4985 -0.4985 -0.4766 -0.4766 -0.1378 -0.1378 0.2356 0.2356 0.2462 0.2462 0.6753 0.6753 0.7014 0.7014 0.7356 0.7356 0.7422 0.7422 0.9688 0.9688 0.9862 0.9862 1.3114 1.3114 1.4704 1.4704 1.4878 1.4878 9.9981 9.9981 12.0374 12.0374 12.0405 12.0405 12.5077 12.5077 12.8018 12.8018 12.8019 12.8019 k = 0.3333 0.5774 0.4786 ( 5682 PWs) bands (ev): -20.6894 -20.6894 -20.6893 -20.6893 -19.7930 -19.7930 -18.7070 -18.7070 -18.6953 -18.6953 -18.6938 -18.6938 -18.1535 -18.1535 -18.1535 -18.1535 -5.4712 -5.4712 -5.4610 -5.4610 -4.8083 -4.8083 -4.6655 -4.6655 -4.5876 -4.5876 -4.5110 -4.5110 -4.4155 -4.4155 -2.0171 -2.0171 -1.9901 -1.9901 -1.8611 -1.8611 -0.5032 -0.5032 -0.4811 -0.4811 -0.1077 -0.1077 0.2383 0.2383 0.2491 0.2491 0.6649 0.6649 0.7005 0.7005 0.7250 0.7250 0.7354 0.7354 0.9801 0.9801 0.9978 0.9978 1.3080 1.3080 1.4684 1.4684 1.4861 1.4861 10.0044 10.0044 12.0650 12.0650 12.0680 12.0680 12.5056 12.5056 12.8047 12.8047 12.8057 12.8057 k = 0.3333 0.5774 0.4971 ( 5676 PWs) bands (ev): -20.6890 -20.6890 -20.6890 -20.6890 -19.7910 -19.7910 -18.7080 -18.7080 -18.6963 -18.6963 -18.6933 -18.6933 -18.1545 -18.1545 -18.1545 -18.1545 -5.4721 -5.4721 -5.4592 -5.4592 -4.7976 -4.7976 -4.6706 -4.6706 -4.5883 -4.5883 -4.5179 -4.5179 -4.4174 -4.4174 -2.0187 -2.0187 -1.9918 -1.9918 -1.8631 -1.8631 -0.5075 -0.5075 -0.4851 -0.4851 -0.0789 -0.0789 0.2406 0.2406 0.2517 0.2517 0.6466 0.6466 0.7004 0.7004 0.7160 0.7160 0.7353 0.7353 0.9902 0.9902 1.0083 1.0083 1.3050 1.3050 1.4663 1.4663 1.4844 1.4844 10.0100 10.0100 12.0889 12.0889 12.0920 12.0920 12.5035 12.5035 12.8089 12.8089 12.8109 12.8109 k = 0.3333 0.5774 0.5155 ( 5661 PWs) bands (ev): -20.6886 -20.6886 -20.6886 -20.6886 -19.7893 -19.7893 -18.7091 -18.7091 -18.6969 -18.6969 -18.6929 -18.6929 -18.1554 -18.1554 -18.1554 -18.1554 -5.4729 -5.4729 -5.4577 -5.4577 -4.7871 -4.7871 -4.6761 -4.6761 -4.5888 -4.5888 -4.5242 -4.5242 -4.4190 -4.4190 -2.0200 -2.0200 -1.9932 -1.9932 -1.8648 -1.8648 -0.5112 -0.5112 -0.4886 -0.4886 -0.0520 -0.0520 0.2427 0.2427 0.2539 0.2539 0.6246 0.6246 0.7008 0.7008 0.7121 0.7121 0.7352 0.7352 0.9991 0.9991 1.0175 1.0175 1.3024 1.3024 1.4644 1.4644 1.4828 1.4828 10.0149 10.0149 12.1091 12.1091 12.1122 12.1122 12.5015 12.5015 12.8138 12.8138 12.8169 12.8169 k = 0.3333 0.5774 0.5339 ( 5646 PWs) bands (ev): -20.6883 -20.6883 -20.6883 -20.6883 -19.7878 -19.7878 -18.7103 -18.7103 -18.6973 -18.6973 -18.6925 -18.6925 -18.1562 -18.1562 -18.1561 -18.1561 -5.4735 -5.4735 -5.4565 -5.4565 -4.7769 -4.7769 -4.6818 -4.6818 -4.5893 -4.5893 -4.5296 -4.5296 -4.4202 -4.4202 -2.0211 -2.0211 -1.9944 -1.9944 -1.8662 -1.8662 -0.5143 -0.5143 -0.4915 -0.4915 -0.0279 -0.0279 0.2444 0.2444 0.2557 0.2557 0.6029 0.6029 0.7014 0.7014 0.7103 0.7103 0.7351 0.7351 1.0066 1.0066 1.0252 1.0252 1.3002 1.3002 1.4627 1.4627 1.4813 1.4813 10.0189 10.0189 12.1255 12.1255 12.1286 12.1286 12.4997 12.4997 12.8190 12.8190 12.8230 12.8230 k = 0.3333 0.5774 0.5523 ( 5646 PWs) bands (ev): -20.6881 -20.6881 -20.6881 -20.6881 -19.7867 -19.7867 -18.7113 -18.7113 -18.6974 -18.6974 -18.6922 -18.6922 -18.1568 -18.1568 -18.1567 -18.1567 -5.4740 -5.4740 -5.4555 -5.4555 -4.7674 -4.7674 -4.6876 -4.6876 -4.5897 -4.5897 -4.5341 -4.5341 -4.4212 -4.4212 -2.0220 -2.0220 -1.9953 -1.9953 -1.8673 -1.8673 -0.5167 -0.5167 -0.4938 -0.4938 -0.0075 -0.0075 0.2458 0.2458 0.2572 0.2572 0.5837 0.5837 0.7019 0.7019 0.7095 0.7095 0.7350 0.7350 1.0126 1.0126 1.0314 1.0314 1.2984 1.2984 1.4613 1.4613 1.4801 1.4801 10.0221 10.0221 12.1381 12.1381 12.1412 12.1412 12.4982 12.4982 12.8238 12.8238 12.8286 12.8286 k = 0.3333 0.5774 0.5707 ( 5646 PWs) bands (ev): -20.6880 -20.6880 -20.6880 -20.6880 -19.7859 -19.7859 -18.7120 -18.7120 -18.6975 -18.6975 -18.6921 -18.6921 -18.1572 -18.1572 -18.1571 -18.1571 -5.4744 -5.4744 -5.4548 -5.4548 -4.7593 -4.7593 -4.6931 -4.6931 -4.5900 -4.5900 -4.5374 -4.5374 -4.4219 -4.4219 -2.0226 -2.0226 -1.9960 -1.9960 -1.8681 -1.8681 -0.5185 -0.5185 -0.4954 -0.4954 0.0081 0.0081 0.2467 0.2467 0.2582 0.2582 0.5687 0.5687 0.7022 0.7022 0.7092 0.7092 0.7349 0.7349 1.0170 1.0170 1.0359 1.0359 1.2972 1.2972 1.4602 1.4602 1.4792 1.4792 10.0245 10.0245 12.1470 12.1470 12.1502 12.1502 12.4970 12.4970 12.8277 12.8277 12.8332 12.8332 k = 0.3333 0.5774 0.5891 ( 5670 PWs) bands (ev): -20.6879 -20.6879 -20.6879 -20.6879 -19.7854 -19.7854 -18.7125 -18.7125 -18.6975 -18.6975 -18.6919 -18.6919 -18.1574 -18.1574 -18.1574 -18.1574 -5.4746 -5.4746 -5.4544 -5.4544 -4.7535 -4.7535 -4.6972 -4.6972 -4.5902 -4.5902 -4.5394 -4.5394 -4.4223 -4.4223 -2.0230 -2.0230 -1.9964 -1.9964 -1.8685 -1.8685 -0.5196 -0.5196 -0.4964 -0.4964 0.0179 0.0179 0.2473 0.2473 0.2589 0.2589 0.5591 0.5591 0.7023 0.7023 0.7091 0.7091 0.7349 0.7349 1.0196 1.0196 1.0387 1.0387 1.2964 1.2964 1.4595 1.4595 1.4786 1.4786 10.0259 10.0259 12.1523 12.1523 12.1555 12.1555 12.4963 12.4963 12.8303 12.8303 12.8361 12.8361 k = 0.3333 0.5774 0.6075 ( 5688 PWs) bands (ev): -20.6879 -20.6879 -20.6878 -20.6878 -19.7852 -19.7852 -18.7127 -18.7127 -18.6975 -18.6975 -18.6919 -18.6919 -18.1575 -18.1575 -18.1575 -18.1575 -5.4747 -5.4747 -5.4542 -5.4542 -4.7513 -4.7513 -4.6988 -4.6988 -4.5902 -4.5902 -4.5401 -4.5401 -4.4224 -4.4224 -2.0231 -2.0231 -1.9965 -1.9965 -1.8687 -1.8687 -0.5200 -0.5200 -0.4968 -0.4968 0.0213 0.0213 0.2475 0.2475 0.2591 0.2591 0.5558 0.5558 0.7024 0.7024 0.7091 0.7091 0.7349 0.7349 1.0205 1.0205 1.0396 1.0396 1.2961 1.2961 1.4592 1.4592 1.4784 1.4784 10.0263 10.0263 12.1541 12.1541 12.1573 12.1573 12.4961 12.4961 12.8312 12.8312 12.8371 12.8371 Writing output data file Rb2GeF6.save init_run : 0.35s CPU 0.49s WALL ( 1 calls) electrons : 257.24s CPU 260.78s WALL ( 1 calls) Called by init_run: wfcinit : 0.00s CPU 0.01s WALL ( 1 calls) potinit : 0.02s CPU 0.06s WALL ( 1 calls) Called by electrons: c_bands : 257.23s CPU 260.77s WALL ( 1 calls) v_of_rho : 0.01s CPU 0.01s WALL ( 1 calls) v_h : 0.00s CPU 0.00s WALL ( 1 calls) v_xc : 0.00s CPU 0.01s WALL ( 1 calls) newd : 0.05s CPU 0.08s WALL ( 1 calls) Called by c_bands: init_us_2 : 0.06s CPU 0.10s WALL ( 280 calls) cegterg : 237.48s CPU 239.95s WALL ( 410 calls) Called by sum_band: Called by *egterg: h_psi : 142.32s CPU 143.99s WALL ( 6395 calls) s_psi : 6.82s CPU 6.88s WALL ( 6395 calls) g_psi : 0.34s CPU 0.38s WALL ( 5705 calls) cdiaghg : 75.36s CPU 76.15s WALL ( 5985 calls) cegterg:over : 11.28s CPU 11.38s WALL ( 5705 calls) cegterg:upda : 9.52s CPU 9.63s WALL ( 5705 calls) cegterg:last : 5.17s CPU 5.19s WALL ( 970 calls) cdiaghg:chol : 4.45s CPU 4.43s WALL ( 5985 calls) cdiaghg:inve : 3.09s CPU 3.20s WALL ( 5985 calls) cdiaghg:para : 5.62s CPU 5.54s WALL ( 11970 calls) Called by h_psi: h_psi:vloc : 125.45s CPU 127.22s WALL ( 6395 calls) h_psi:vnl : 16.47s CPU 16.37s WALL ( 6395 calls) add_vuspsi : 8.07s CPU 8.02s WALL ( 6395 calls) General routines calbec : 8.34s CPU 8.33s WALL ( 6395 calls) fft : 0.02s CPU 0.02s WALL ( 19 calls) ffts : 0.00s CPU 0.00s WALL ( 4 calls) fftw : 117.80s CPU 119.59s WALL ( 932596 calls) interpolate : 0.00s CPU 0.00s WALL ( 4 calls) davcio : 0.22s CPU 0.34s WALL ( 560 calls) Parallel routines fft_scatter : 36.55s CPU 37.17s WALL ( 932619 calls) PWSCF : 4m40.24s CPU 4m56.54s WALL This run was terminated on: 18: 4:59 5Jan2017 =------------------------------------------------------------------------------= JOB DONE. =------------------------------------------------------------------------------=