Program PWSCF v.5.3.0 (svn rev. 11974) starts on 5Jan2017 at 21: 4:55 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: ./SrPb3.save/ file Pb.rel-pbe-dn-rrkjus_psl.1.0.0.UPF: wavefunction(s) 6S 5D 5D 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 51 36 10 1673 1004 158 Max 53 37 11 1674 1021 163 Sum 1861 1313 385 60245 36417 5791 bravais-lattice index = 14 lattice parameter (alat) = 9.3825 a.u. unit-cell volume = 835.7659 (a.u.)^3 number of atoms/cell = 4 number of atomic types = 2 number of electrons = 52.00 number of Kohn-Sham states= 62 kinetic-energy cutoff = 47.0000 Ry charge density cutoff = 263.0000 Ry Exchange-correlation = PBE ( 1 4 3 4 0 0) Non magnetic calculation with spin-orbit celldm(1)= 9.382490 celldm(2)= 1.000000 celldm(3)= 1.011883 celldm(4)= 0.000000 celldm(5)= 0.000000 celldm(6)= 0.000000 crystal axes: (cart. coord. in units of alat) a(1) = ( 1.000000 0.000000 0.000000 ) a(2) = ( 0.000000 1.000000 0.000000 ) a(3) = ( 0.000000 0.000000 1.011883 ) reciprocal axes: (cart. coord. in units 2 pi/alat) b(1) = ( 1.000000 -0.000000 -0.000000 ) b(2) = ( 0.000000 1.000000 -0.000000 ) b(3) = ( 0.000000 0.000000 0.988256 ) PseudoPot. # 1 for Pb read from file: /users/gautes/Pseudo/Pb.rel-pbe-dn-rrkjus_psl.1.0.0.UPF MD5 check sum: 75f9fe62f948a5acf869e43db2c29526 Pseudo is Ultrasoft + core correction, Zval = 14.0 Generated using "atomic" code by A. Dal Corso v.5.0.2 svn rev. 9656 Using radial grid of 1281 points, 10 beta functions with: l(1) = 0 l(2) = 0 l(3) = 1 l(4) = 1 l(5) = 1 l(6) = 1 l(7) = 2 l(8) = 2 l(9) = 2 l(10) = 2 Q(r) pseudized with 0 coefficients PseudoPot. # 2 for Sr read from file: /users/gautes/Pseudo/Sr.rel-pbe-spn-rrkjus_psl.1.0.0.UPF MD5 check sum: 971034ad0a3914f6282d12395b0824f8 Pseudo is Ultrasoft + core correction, Zval = 10.0 Generated using "atomic" code by A. Dal Corso v.5.0.2 svn rev. 9656 Using radial grid of 1221 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 Pb 14.00 207.20000 Pb( 1.00) Sr 10.00 87.62000 Sr( 1.00) 16 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 [0,0,1] cryst. s( 2) = ( -1 0 0 ) ( 0 -1 0 ) ( 0 0 1 ) cart. s( 2) = ( -1.0000000 0.0000000 0.0000000 ) ( 0.0000000 -1.0000000 0.0000000 ) ( 0.0000000 0.0000000 1.0000000 ) isym = 3 180 deg rotation - cart. axis [0,1,0] cryst. s( 3) = ( -1 0 0 ) ( 0 1 0 ) ( 0 0 -1 ) cart. s( 3) = ( -1.0000000 0.0000000 -0.0000000 ) ( 0.0000000 1.0000000 -0.0000000 ) ( 0.0000000 0.0000000 -1.0000000 ) isym = 4 180 deg rotation - cart. axis [1,0,0] cryst. s( 4) = ( 1 0 0 ) ( 0 -1 0 ) ( 0 0 -1 ) cart. s( 4) = ( 1.0000000 -0.0000000 -0.0000000 ) ( 0.0000000 -1.0000000 0.0000000 ) ( 0.0000000 0.0000000 -1.0000000 ) isym = 5 180 deg rotation - cart. axis [1,1,0] cryst. s( 5) = ( 0 1 0 ) ( 1 0 0 ) ( 0 0 -1 ) cart. s( 5) = ( 0.0000000 1.0000000 -0.0000000 ) ( 1.0000000 -0.0000000 -0.0000000 ) ( 0.0000000 0.0000000 -1.0000000 ) isym = 6 180 deg rotation - cart. axis [1,-1,0] cryst. s( 6) = ( 0 -1 0 ) ( -1 0 0 ) ( 0 0 -1 ) cart. s( 6) = ( -0.0000000 -1.0000000 -0.0000000 ) ( -1.0000000 0.0000000 0.0000000 ) ( 0.0000000 0.0000000 -1.0000000 ) isym = 7 90 deg rotation - cart. axis [0,0,-1] cryst. s( 7) = ( 0 -1 0 ) ( 1 0 0 ) ( 0 0 1 ) cart. s( 7) = ( -0.0000000 1.0000000 0.0000000 ) ( -1.0000000 0.0000000 0.0000000 ) ( 0.0000000 0.0000000 1.0000000 ) isym = 8 90 deg rotation - cart. axis [0,0,1] cryst. s( 8) = ( 0 1 0 ) ( -1 0 0 ) ( 0 0 1 ) cart. s( 8) = ( 0.0000000 -1.0000000 0.0000000 ) ( 1.0000000 -0.0000000 -0.0000000 ) ( 0.0000000 0.0000000 1.0000000 ) isym = 9 inversion cryst. s( 9) = ( -1 0 0 ) ( 0 -1 0 ) ( 0 0 -1 ) cart. s( 9) = ( -1.0000000 0.0000000 0.0000000 ) ( 0.0000000 -1.0000000 0.0000000 ) ( 0.0000000 0.0000000 -1.0000000 ) isym = 10 inv. 180 deg rotation - cart. axis [0,0,1] cryst. s(10) = ( 1 0 0 ) ( 0 1 0 ) ( 0 0 -1 ) cart. s(10) = ( 1.0000000 0.0000000 -0.0000000 ) ( 0.0000000 1.0000000 -0.0000000 ) ( 0.0000000 0.0000000 -1.0000000 ) isym = 11 inv. 180 deg rotation - cart. axis [0,1,0] cryst. s(11) = ( 1 0 0 ) ( 0 -1 0 ) ( 0 0 1 ) cart. s(11) = ( 1.0000000 -0.0000000 0.0000000 ) ( 0.0000000 -1.0000000 0.0000000 ) ( 0.0000000 0.0000000 1.0000000 ) isym = 12 inv. 180 deg rotation - cart. axis [1,0,0] cryst. s(12) = ( -1 0 0 ) ( 0 1 0 ) ( 0 0 1 ) cart. s(12) = ( -1.0000000 0.0000000 0.0000000 ) ( 0.0000000 1.0000000 0.0000000 ) ( 0.0000000 0.0000000 1.0000000 ) isym = 13 inv. 180 deg rotation - cart. axis [1,1,0] cryst. s(13) = ( 0 -1 0 ) ( -1 0 0 ) ( 0 0 1 ) cart. s(13) = ( -0.0000000 -1.0000000 0.0000000 ) ( -1.0000000 0.0000000 0.0000000 ) ( 0.0000000 0.0000000 1.0000000 ) isym = 14 inv. 180 deg rotation - cart. axis [1,-1,0] cryst. s(14) = ( 0 1 0 ) ( 1 0 0 ) ( 0 0 1 ) cart. s(14) = ( 0.0000000 1.0000000 0.0000000 ) ( 1.0000000 -0.0000000 -0.0000000 ) ( 0.0000000 0.0000000 1.0000000 ) isym = 15 inv. 90 deg rotation - cart. axis [0,0,-1] cryst. s(15) = ( 0 1 0 ) ( -1 0 0 ) ( 0 0 -1 ) cart. s(15) = ( 0.0000000 -1.0000000 -0.0000000 ) ( 1.0000000 -0.0000000 -0.0000000 ) ( 0.0000000 0.0000000 -1.0000000 ) isym = 16 inv. 90 deg rotation - cart. axis [0,0,1] cryst. s(16) = ( 0 -1 0 ) ( 1 0 0 ) ( 0 0 -1 ) cart. s(16) = ( -0.0000000 1.0000000 -0.0000000 ) ( -1.0000000 0.0000000 0.0000000 ) ( 0.0000000 0.0000000 -1.0000000 ) double point group D_4h(4/mmm) there are 14 classes and 4 irreducible representations the character table: E -E 2C4 -2C4 C2 2C2' 2C2'' i -i 2S4 -2S4 s_h -C2 -2C2' -2C2' -s_h G_6+ 2.00 -2.00 1.41 -1.41 0.00 0.00 0.00 2.00 -2.00 1.41 -1.41 0.00 G_7+ 2.00 -2.00 -1.41 1.41 0.00 0.00 0.00 2.00 -2.00 -1.41 1.41 0.00 G_6- 2.00 -2.00 1.41 -1.41 0.00 0.00 0.00 -2.00 2.00 -1.41 1.41 0.00 G_7- 2.00 -2.00 -1.41 1.41 0.00 0.00 0.00 -2.00 2.00 1.41 -1.41 0.00 2s_v 2s_d -2s_v -2s_d G_6+ 0.00 0.00 G_7+ 0.00 0.00 G_6- 0.00 0.00 G_7- 0.00 0.00 the symmetry operations in each class and the name of the first element: E 1 identity -E -1 identity E 2C4 7 8 90 deg rotation - cart. axis [0,0,-1] -2C4 -7 -8 90 deg rotation - cart. axis [0,0,-1] E C2 -C2 2 -2 180 deg rotation - cart. axis [0,0,1] 2C2'-2C2' 3 -3 4 -4 180 deg rotation - cart. axis [0,1,0] 2C2''-2C2' 5 -5 6 -6 180 deg rotation - cart. axis [1,1,0] i 9 inversion -i -9 inversion E 2S4 15 16 inv. 90 deg rotation - cart. axis [0,0,-1] -2S4 -15 -16 inv. 90 deg rotation - cart. axis [0,0,-1] E s_h -s_h 10 -10 inv. 180 deg rotation - cart. axis [0,0,1] 2s_v-2s_v 11 -11 12 -12 inv. 180 deg rotation - cart. axis [0,1,0] 2s_d-2s_d 13 -13 14 -14 inv. 180 deg rotation - cart. axis [1,1,0] Cartesian axes number of k points= 323 Fermi-Dirac smearing, width (Ry)= 0.0010 cart. coord. in units 2pi/alat k( 1) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0030960 k( 2) = ( 0.0000000 0.0156250 -0.0000000), wk = 0.0030960 k( 3) = ( 0.0000000 0.0312500 -0.0000000), wk = 0.0030960 k( 4) = ( 0.0000000 0.0468750 -0.0000000), wk = 0.0030960 k( 5) = ( 0.0000000 0.0625000 -0.0000000), wk = 0.0030960 k( 6) = ( 0.0000000 0.0781250 -0.0000000), wk = 0.0030960 k( 7) = ( 0.0000000 0.0937500 -0.0000000), wk = 0.0030960 k( 8) = ( 0.0000000 0.1093750 -0.0000000), wk = 0.0030960 k( 9) = ( 0.0000000 0.1250000 -0.0000000), wk = 0.0030960 k( 10) = ( 0.0000000 0.1406250 -0.0000000), wk = 0.0030960 k( 11) = ( 0.0000000 0.1562500 -0.0000000), wk = 0.0030960 k( 12) = ( 0.0000000 0.1718750 -0.0000000), wk = 0.0030960 k( 13) = ( 0.0000000 0.1875000 -0.0000000), wk = 0.0030960 k( 14) = ( 0.0000000 0.2031250 -0.0000000), wk = 0.0030960 k( 15) = ( 0.0000000 0.2187500 -0.0000000), wk = 0.0030960 k( 16) = ( 0.0000000 0.2343750 -0.0000000), wk = 0.0030960 k( 17) = ( 0.0000000 0.2500000 -0.0000000), wk = 0.0030960 k( 18) = ( 0.0000000 0.2656250 -0.0000000), wk = 0.0030960 k( 19) = ( 0.0000000 0.2812500 -0.0000000), wk = 0.0030960 k( 20) = ( 0.0000000 0.2968750 -0.0000000), wk = 0.0030960 k( 21) = ( 0.0000000 0.3125000 -0.0000000), wk = 0.0030960 k( 22) = ( 0.0000000 0.3281250 -0.0000000), wk = 0.0030960 k( 23) = ( 0.0000000 0.3437500 -0.0000000), wk = 0.0030960 k( 24) = ( 0.0000000 0.3593750 -0.0000000), wk = 0.0030960 k( 25) = ( 0.0000000 0.3750000 -0.0000000), wk = 0.0030960 k( 26) = ( 0.0000000 0.3906250 -0.0000000), wk = 0.0030960 k( 27) = ( 0.0000000 0.4062500 -0.0000000), wk = 0.0030960 k( 28) = ( 0.0000000 0.4218750 -0.0000000), wk = 0.0030960 k( 29) = ( 0.0000000 0.4375000 -0.0000000), wk = 0.0030960 k( 30) = ( 0.0000000 0.4531250 -0.0000000), wk = 0.0030960 k( 31) = ( 0.0000000 0.4687500 -0.0000000), wk = 0.0030960 k( 32) = ( 0.0000000 0.4843750 -0.0000000), wk = 0.0030960 k( 33) = ( 0.0000000 0.5000000 -0.0000000), wk = 0.0030960 k( 34) = ( 0.0000000 0.5000000 -0.0000000), wk = 0.0030960 k( 35) = ( 0.0156250 0.5000000 -0.0000000), wk = 0.0030960 k( 36) = ( 0.0312500 0.5000000 -0.0000000), wk = 0.0030960 k( 37) = ( 0.0468750 0.5000000 -0.0000000), wk = 0.0030960 k( 38) = ( 0.0625000 0.5000000 -0.0000000), wk = 0.0030960 k( 39) = ( 0.0781250 0.5000000 -0.0000000), wk = 0.0030960 k( 40) = ( 0.0937500 0.5000000 -0.0000000), wk = 0.0030960 k( 41) = ( 0.1093750 0.5000000 -0.0000000), wk = 0.0030960 k( 42) = ( 0.1250000 0.5000000 -0.0000000), wk = 0.0030960 k( 43) = ( 0.1406250 0.5000000 -0.0000000), wk = 0.0030960 k( 44) = ( 0.1562500 0.5000000 -0.0000000), wk = 0.0030960 k( 45) = ( 0.1718750 0.5000000 -0.0000000), wk = 0.0030960 k( 46) = ( 0.1875000 0.5000000 -0.0000000), wk = 0.0030960 k( 47) = ( 0.2031250 0.5000000 -0.0000000), wk = 0.0030960 k( 48) = ( 0.2187500 0.5000000 -0.0000000), wk = 0.0030960 k( 49) = ( 0.2343750 0.5000000 -0.0000000), wk = 0.0030960 k( 50) = ( 0.2500000 0.5000000 -0.0000000), wk = 0.0030960 k( 51) = ( 0.2656250 0.5000000 -0.0000000), wk = 0.0030960 k( 52) = ( 0.2812500 0.5000000 -0.0000000), wk = 0.0030960 k( 53) = ( 0.2968750 0.5000000 -0.0000000), wk = 0.0030960 k( 54) = ( 0.3125000 0.5000000 -0.0000000), wk = 0.0030960 k( 55) = ( 0.3281250 0.5000000 -0.0000000), wk = 0.0030960 k( 56) = ( 0.3437500 0.5000000 -0.0000000), wk = 0.0030960 k( 57) = ( 0.3593750 0.5000000 -0.0000000), wk = 0.0030960 k( 58) = ( 0.3750000 0.5000000 -0.0000000), wk = 0.0030960 k( 59) = ( 0.3906250 0.5000000 -0.0000000), wk = 0.0030960 k( 60) = ( 0.4062500 0.5000000 -0.0000000), wk = 0.0030960 k( 61) = ( 0.4218750 0.5000000 -0.0000000), wk = 0.0030960 k( 62) = ( 0.4375000 0.5000000 -0.0000000), wk = 0.0030960 k( 63) = ( 0.4531250 0.5000000 -0.0000000), wk = 0.0030960 k( 64) = ( 0.4687500 0.5000000 -0.0000000), wk = 0.0030960 k( 65) = ( 0.4843750 0.5000000 -0.0000000), wk = 0.0030960 k( 66) = ( 0.5000000 0.5000000 -0.0000000), wk = 0.0030960 k( 67) = ( 0.5000000 0.5000000 -0.0000000), wk = 0.0030960 k( 68) = ( 0.4888889 0.4888889 -0.0000000), wk = 0.0030960 k( 69) = ( 0.4777778 0.4777778 -0.0000000), wk = 0.0030960 k( 70) = ( 0.4666667 0.4666667 -0.0000000), wk = 0.0030960 k( 71) = ( 0.4555556 0.4555556 -0.0000000), wk = 0.0030960 k( 72) = ( 0.4444444 0.4444444 -0.0000000), wk = 0.0030960 k( 73) = ( 0.4333333 0.4333333 -0.0000000), wk = 0.0030960 k( 74) = ( 0.4222222 0.4222222 -0.0000000), wk = 0.0030960 k( 75) = ( 0.4111111 0.4111111 -0.0000000), wk = 0.0030960 k( 76) = ( 0.4000000 0.4000000 -0.0000000), wk = 0.0030960 k( 77) = ( 0.3888889 0.3888889 -0.0000000), wk = 0.0030960 k( 78) = ( 0.3777778 0.3777778 -0.0000000), wk = 0.0030960 k( 79) = ( 0.3666667 0.3666667 -0.0000000), wk = 0.0030960 k( 80) = ( 0.3555556 0.3555556 -0.0000000), wk = 0.0030960 k( 81) = ( 0.3444444 0.3444444 -0.0000000), wk = 0.0030960 k( 82) = ( 0.3333333 0.3333333 -0.0000000), wk = 0.0030960 k( 83) = ( 0.3222222 0.3222222 -0.0000000), wk = 0.0030960 k( 84) = ( 0.3111111 0.3111111 -0.0000000), wk = 0.0030960 k( 85) = ( 0.3000000 0.3000000 -0.0000000), wk = 0.0030960 k( 86) = ( 0.2888889 0.2888889 -0.0000000), wk = 0.0030960 k( 87) = ( 0.2777778 0.2777778 -0.0000000), wk = 0.0030960 k( 88) = ( 0.2666667 0.2666667 -0.0000000), wk = 0.0030960 k( 89) = ( 0.2555556 0.2555556 -0.0000000), wk = 0.0030960 k( 90) = ( 0.2444444 0.2444444 -0.0000000), wk = 0.0030960 k( 91) = ( 0.2333333 0.2333333 -0.0000000), wk = 0.0030960 k( 92) = ( 0.2222222 0.2222222 -0.0000000), wk = 0.0030960 k( 93) = ( 0.2111111 0.2111111 -0.0000000), wk = 0.0030960 k( 94) = ( 0.2000000 0.2000000 -0.0000000), wk = 0.0030960 k( 95) = ( 0.1888889 0.1888889 -0.0000000), wk = 0.0030960 k( 96) = ( 0.1777778 0.1777778 -0.0000000), wk = 0.0030960 k( 97) = ( 0.1666667 0.1666667 -0.0000000), wk = 0.0030960 k( 98) = ( 0.1555556 0.1555556 -0.0000000), wk = 0.0030960 k( 99) = ( 0.1444444 0.1444444 -0.0000000), wk = 0.0030960 k( 100) = ( 0.1333333 0.1333333 -0.0000000), wk = 0.0030960 k( 101) = ( 0.1222222 0.1222222 -0.0000000), wk = 0.0030960 k( 102) = ( 0.1111111 0.1111111 -0.0000000), wk = 0.0030960 k( 103) = ( 0.1000000 0.1000000 -0.0000000), wk = 0.0030960 k( 104) = ( 0.0888889 0.0888889 -0.0000000), wk = 0.0030960 k( 105) = ( 0.0777778 0.0777778 -0.0000000), wk = 0.0030960 k( 106) = ( 0.0666667 0.0666667 -0.0000000), wk = 0.0030960 k( 107) = ( 0.0555556 0.0555556 -0.0000000), wk = 0.0030960 k( 108) = ( 0.0444444 0.0444444 -0.0000000), wk = 0.0030960 k( 109) = ( 0.0333333 0.0333333 -0.0000000), wk = 0.0030960 k( 110) = ( 0.0222222 0.0222222 -0.0000000), wk = 0.0030960 k( 111) = ( 0.0111111 0.0111111 -0.0000000), wk = 0.0030960 k( 112) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0030960 k( 113) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0030960 k( 114) = ( 0.0000000 0.0000000 0.0154415), wk = 0.0030960 k( 115) = ( 0.0000000 0.0000000 0.0308830), wk = 0.0030960 k( 116) = ( 0.0000000 0.0000000 0.0463245), wk = 0.0030960 k( 117) = ( 0.0000000 0.0000000 0.0617660), wk = 0.0030960 k( 118) = ( 0.0000000 0.0000000 0.0772075), wk = 0.0030960 k( 119) = ( 0.0000000 0.0000000 0.0926490), wk = 0.0030960 k( 120) = ( 0.0000000 0.0000000 0.1080905), wk = 0.0030960 k( 121) = ( 0.0000000 0.0000000 0.1235320), wk = 0.0030960 k( 122) = ( 0.0000000 0.0000000 0.1389736), wk = 0.0030960 k( 123) = ( 0.0000000 0.0000000 0.1544151), wk = 0.0030960 k( 124) = ( 0.0000000 0.0000000 0.1698566), wk = 0.0030960 k( 125) = ( 0.0000000 0.0000000 0.1852981), wk = 0.0030960 k( 126) = ( 0.0000000 0.0000000 0.2007396), wk = 0.0030960 k( 127) = ( 0.0000000 0.0000000 0.2161811), wk = 0.0030960 k( 128) = ( 0.0000000 0.0000000 0.2316226), wk = 0.0030960 k( 129) = ( 0.0000000 0.0000000 0.2470641), wk = 0.0030960 k( 130) = ( 0.0000000 0.0000000 0.2625056), wk = 0.0030960 k( 131) = ( 0.0000000 0.0000000 0.2779471), wk = 0.0030960 k( 132) = ( 0.0000000 0.0000000 0.2933886), wk = 0.0030960 k( 133) = ( 0.0000000 0.0000000 0.3088301), wk = 0.0030960 k( 134) = ( 0.0000000 0.0000000 0.3242716), wk = 0.0030960 k( 135) = ( 0.0000000 0.0000000 0.3397131), wk = 0.0030960 k( 136) = ( 0.0000000 0.0000000 0.3551546), wk = 0.0030960 k( 137) = ( 0.0000000 0.0000000 0.3705961), wk = 0.0030960 k( 138) = ( 0.0000000 0.0000000 0.3860376), wk = 0.0030960 k( 139) = ( 0.0000000 0.0000000 0.4014792), wk = 0.0030960 k( 140) = ( 0.0000000 0.0000000 0.4169207), wk = 0.0030960 k( 141) = ( 0.0000000 0.0000000 0.4323622), wk = 0.0030960 k( 142) = ( 0.0000000 0.0000000 0.4478037), wk = 0.0030960 k( 143) = ( 0.0000000 0.0000000 0.4632452), wk = 0.0030960 k( 144) = ( 0.0000000 0.0000000 0.4786867), wk = 0.0030960 k( 145) = ( 0.0000000 0.0000000 0.4941282), wk = 0.0030960 k( 146) = ( 0.0000000 0.0000000 0.4941282), wk = 0.0030960 k( 147) = ( 0.0000000 0.0156250 0.4941282), wk = 0.0030960 k( 148) = ( 0.0000000 0.0312500 0.4941282), wk = 0.0030960 k( 149) = ( 0.0000000 0.0468750 0.4941282), wk = 0.0030960 k( 150) = ( 0.0000000 0.0625000 0.4941282), wk = 0.0030960 k( 151) = ( 0.0000000 0.0781250 0.4941282), wk = 0.0030960 k( 152) = ( 0.0000000 0.0937500 0.4941282), wk = 0.0030960 k( 153) = ( 0.0000000 0.1093750 0.4941282), wk = 0.0030960 k( 154) = ( 0.0000000 0.1250000 0.4941282), wk = 0.0030960 k( 155) = ( 0.0000000 0.1406250 0.4941282), wk = 0.0030960 k( 156) = ( 0.0000000 0.1562500 0.4941282), wk = 0.0030960 k( 157) = ( 0.0000000 0.1718750 0.4941282), wk = 0.0030960 k( 158) = ( 0.0000000 0.1875000 0.4941282), wk = 0.0030960 k( 159) = ( 0.0000000 0.2031250 0.4941282), wk = 0.0030960 k( 160) = ( 0.0000000 0.2187500 0.4941282), wk = 0.0030960 k( 161) = ( 0.0000000 0.2343750 0.4941282), wk = 0.0030960 k( 162) = ( 0.0000000 0.2500000 0.4941282), wk = 0.0030960 k( 163) = ( 0.0000000 0.2656250 0.4941282), wk = 0.0030960 k( 164) = ( 0.0000000 0.2812500 0.4941282), wk = 0.0030960 k( 165) = ( 0.0000000 0.2968750 0.4941282), wk = 0.0030960 k( 166) = ( 0.0000000 0.3125000 0.4941282), wk = 0.0030960 k( 167) = ( 0.0000000 0.3281250 0.4941282), wk = 0.0030960 k( 168) = ( 0.0000000 0.3437500 0.4941282), wk = 0.0030960 k( 169) = ( 0.0000000 0.3593750 0.4941282), wk = 0.0030960 k( 170) = ( 0.0000000 0.3750000 0.4941282), wk = 0.0030960 k( 171) = ( 0.0000000 0.3906250 0.4941282), wk = 0.0030960 k( 172) = ( 0.0000000 0.4062500 0.4941282), wk = 0.0030960 k( 173) = ( 0.0000000 0.4218750 0.4941282), wk = 0.0030960 k( 174) = ( 0.0000000 0.4375000 0.4941282), wk = 0.0030960 k( 175) = ( 0.0000000 0.4531250 0.4941282), wk = 0.0030960 k( 176) = ( 0.0000000 0.4687500 0.4941282), wk = 0.0030960 k( 177) = ( 0.0000000 0.4843750 0.4941282), wk = 0.0030960 k( 178) = ( 0.0000000 0.5000000 0.4941282), wk = 0.0030960 k( 179) = ( 0.0000000 0.5000000 0.4941282), wk = 0.0030960 k( 180) = ( 0.0156250 0.5000000 0.4941282), wk = 0.0030960 k( 181) = ( 0.0312500 0.5000000 0.4941282), wk = 0.0030960 k( 182) = ( 0.0468750 0.5000000 0.4941282), wk = 0.0030960 k( 183) = ( 0.0625000 0.5000000 0.4941282), wk = 0.0030960 k( 184) = ( 0.0781250 0.5000000 0.4941282), wk = 0.0030960 k( 185) = ( 0.0937500 0.5000000 0.4941282), wk = 0.0030960 k( 186) = ( 0.1093750 0.5000000 0.4941282), wk = 0.0030960 k( 187) = ( 0.1250000 0.5000000 0.4941282), wk = 0.0030960 k( 188) = ( 0.1406250 0.5000000 0.4941282), wk = 0.0030960 k( 189) = ( 0.1562500 0.5000000 0.4941282), wk = 0.0030960 k( 190) = ( 0.1718750 0.5000000 0.4941282), wk = 0.0030960 k( 191) = ( 0.1875000 0.5000000 0.4941282), wk = 0.0030960 k( 192) = ( 0.2031250 0.5000000 0.4941282), wk = 0.0030960 k( 193) = ( 0.2187500 0.5000000 0.4941282), wk = 0.0030960 k( 194) = ( 0.2343750 0.5000000 0.4941282), wk = 0.0030960 k( 195) = ( 0.2500000 0.5000000 0.4941282), wk = 0.0030960 k( 196) = ( 0.2656250 0.5000000 0.4941282), wk = 0.0030960 k( 197) = ( 0.2812500 0.5000000 0.4941282), wk = 0.0030960 k( 198) = ( 0.2968750 0.5000000 0.4941282), wk = 0.0030960 k( 199) = ( 0.3125000 0.5000000 0.4941282), wk = 0.0030960 k( 200) = ( 0.3281250 0.5000000 0.4941282), wk = 0.0030960 k( 201) = ( 0.3437500 0.5000000 0.4941282), wk = 0.0030960 k( 202) = ( 0.3593750 0.5000000 0.4941282), wk = 0.0030960 k( 203) = ( 0.3750000 0.5000000 0.4941282), wk = 0.0030960 k( 204) = ( 0.3906250 0.5000000 0.4941282), wk = 0.0030960 k( 205) = ( 0.4062500 0.5000000 0.4941282), wk = 0.0030960 k( 206) = ( 0.4218750 0.5000000 0.4941282), wk = 0.0030960 k( 207) = ( 0.4375000 0.5000000 0.4941282), wk = 0.0030960 k( 208) = ( 0.4531250 0.5000000 0.4941282), wk = 0.0030960 k( 209) = ( 0.4687500 0.5000000 0.4941282), wk = 0.0030960 k( 210) = ( 0.4843750 0.5000000 0.4941282), wk = 0.0030960 k( 211) = ( 0.5000000 0.5000000 0.4941282), wk = 0.0030960 k( 212) = ( 0.5000000 0.5000000 0.4941282), wk = 0.0030960 k( 213) = ( 0.4888889 0.4888889 0.4941282), wk = 0.0030960 k( 214) = ( 0.4777778 0.4777778 0.4941282), wk = 0.0030960 k( 215) = ( 0.4666667 0.4666667 0.4941282), wk = 0.0030960 k( 216) = ( 0.4555556 0.4555556 0.4941282), wk = 0.0030960 k( 217) = ( 0.4444444 0.4444444 0.4941282), wk = 0.0030960 k( 218) = ( 0.4333333 0.4333333 0.4941282), wk = 0.0030960 k( 219) = ( 0.4222222 0.4222222 0.4941282), wk = 0.0030960 k( 220) = ( 0.4111111 0.4111111 0.4941282), wk = 0.0030960 k( 221) = ( 0.4000000 0.4000000 0.4941282), wk = 0.0030960 k( 222) = ( 0.3888889 0.3888889 0.4941282), wk = 0.0030960 k( 223) = ( 0.3777778 0.3777778 0.4941282), wk = 0.0030960 k( 224) = ( 0.3666667 0.3666667 0.4941282), wk = 0.0030960 k( 225) = ( 0.3555556 0.3555556 0.4941282), wk = 0.0030960 k( 226) = ( 0.3444444 0.3444444 0.4941282), wk = 0.0030960 k( 227) = ( 0.3333333 0.3333333 0.4941282), wk = 0.0030960 k( 228) = ( 0.3222222 0.3222222 0.4941282), wk = 0.0030960 k( 229) = ( 0.3111111 0.3111111 0.4941282), wk = 0.0030960 k( 230) = ( 0.3000000 0.3000000 0.4941282), wk = 0.0030960 k( 231) = ( 0.2888889 0.2888889 0.4941282), wk = 0.0030960 k( 232) = ( 0.2777778 0.2777778 0.4941282), wk = 0.0030960 k( 233) = ( 0.2666667 0.2666667 0.4941282), wk = 0.0030960 k( 234) = ( 0.2555556 0.2555556 0.4941282), wk = 0.0030960 k( 235) = ( 0.2444444 0.2444444 0.4941282), wk = 0.0030960 k( 236) = ( 0.2333333 0.2333333 0.4941282), wk = 0.0030960 k( 237) = ( 0.2222222 0.2222222 0.4941282), wk = 0.0030960 k( 238) = ( 0.2111111 0.2111111 0.4941282), wk = 0.0030960 k( 239) = ( 0.2000000 0.2000000 0.4941282), wk = 0.0030960 k( 240) = ( 0.1888889 0.1888889 0.4941282), wk = 0.0030960 k( 241) = ( 0.1777778 0.1777778 0.4941282), wk = 0.0030960 k( 242) = ( 0.1666667 0.1666667 0.4941282), wk = 0.0030960 k( 243) = ( 0.1555556 0.1555556 0.4941282), wk = 0.0030960 k( 244) = ( 0.1444444 0.1444444 0.4941282), wk = 0.0030960 k( 245) = ( 0.1333333 0.1333333 0.4941282), wk = 0.0030960 k( 246) = ( 0.1222222 0.1222222 0.4941282), wk = 0.0030960 k( 247) = ( 0.1111111 0.1111111 0.4941282), wk = 0.0030960 k( 248) = ( 0.1000000 0.1000000 0.4941282), wk = 0.0030960 k( 249) = ( 0.0888889 0.0888889 0.4941282), wk = 0.0030960 k( 250) = ( 0.0777778 0.0777778 0.4941282), wk = 0.0030960 k( 251) = ( 0.0666667 0.0666667 0.4941282), wk = 0.0030960 k( 252) = ( 0.0555556 0.0555556 0.4941282), wk = 0.0030960 k( 253) = ( 0.0444444 0.0444444 0.4941282), wk = 0.0030960 k( 254) = ( 0.0333333 0.0333333 0.4941282), wk = 0.0030960 k( 255) = ( 0.0222222 0.0222222 0.4941282), wk = 0.0030960 k( 256) = ( 0.0111111 0.0111111 0.4941282), wk = 0.0030960 k( 257) = ( 0.0000000 0.0000000 0.4941282), wk = 0.0030960 k( 258) = ( 0.0000000 0.5000000 -0.0000000), wk = 0.0030960 k( 259) = ( 0.0000000 0.5000000 0.0154415), wk = 0.0030960 k( 260) = ( 0.0000000 0.5000000 0.0308830), wk = 0.0030960 k( 261) = ( 0.0000000 0.5000000 0.0463245), wk = 0.0030960 k( 262) = ( 0.0000000 0.5000000 0.0617660), wk = 0.0030960 k( 263) = ( 0.0000000 0.5000000 0.0772075), wk = 0.0030960 k( 264) = ( 0.0000000 0.5000000 0.0926490), wk = 0.0030960 k( 265) = ( 0.0000000 0.5000000 0.1080905), wk = 0.0030960 k( 266) = ( 0.0000000 0.5000000 0.1235320), wk = 0.0030960 k( 267) = ( 0.0000000 0.5000000 0.1389736), wk = 0.0030960 k( 268) = ( 0.0000000 0.5000000 0.1544151), wk = 0.0030960 k( 269) = ( 0.0000000 0.5000000 0.1698566), wk = 0.0030960 k( 270) = ( 0.0000000 0.5000000 0.1852981), wk = 0.0030960 k( 271) = ( 0.0000000 0.5000000 0.2007396), wk = 0.0030960 k( 272) = ( 0.0000000 0.5000000 0.2161811), wk = 0.0030960 k( 273) = ( 0.0000000 0.5000000 0.2316226), wk = 0.0030960 k( 274) = ( 0.0000000 0.5000000 0.2470641), wk = 0.0030960 k( 275) = ( 0.0000000 0.5000000 0.2625056), wk = 0.0030960 k( 276) = ( 0.0000000 0.5000000 0.2779471), wk = 0.0030960 k( 277) = ( 0.0000000 0.5000000 0.2933886), wk = 0.0030960 k( 278) = ( 0.0000000 0.5000000 0.3088301), wk = 0.0030960 k( 279) = ( 0.0000000 0.5000000 0.3242716), wk = 0.0030960 k( 280) = ( 0.0000000 0.5000000 0.3397131), wk = 0.0030960 k( 281) = ( 0.0000000 0.5000000 0.3551546), wk = 0.0030960 k( 282) = ( 0.0000000 0.5000000 0.3705961), wk = 0.0030960 k( 283) = ( 0.0000000 0.5000000 0.3860376), wk = 0.0030960 k( 284) = ( 0.0000000 0.5000000 0.4014792), wk = 0.0030960 k( 285) = ( 0.0000000 0.5000000 0.4169207), wk = 0.0030960 k( 286) = ( 0.0000000 0.5000000 0.4323622), wk = 0.0030960 k( 287) = ( 0.0000000 0.5000000 0.4478037), wk = 0.0030960 k( 288) = ( 0.0000000 0.5000000 0.4632452), wk = 0.0030960 k( 289) = ( 0.0000000 0.5000000 0.4786867), wk = 0.0030960 k( 290) = ( 0.0000000 0.5000000 0.4941282), wk = 0.0030960 k( 291) = ( 0.5000000 0.5000000 -0.0000000), wk = 0.0030960 k( 292) = ( 0.5000000 0.5000000 0.0154415), wk = 0.0030960 k( 293) = ( 0.5000000 0.5000000 0.0308830), wk = 0.0030960 k( 294) = ( 0.5000000 0.5000000 0.0463245), wk = 0.0030960 k( 295) = ( 0.5000000 0.5000000 0.0617660), wk = 0.0030960 k( 296) = ( 0.5000000 0.5000000 0.0772075), wk = 0.0030960 k( 297) = ( 0.5000000 0.5000000 0.0926490), wk = 0.0030960 k( 298) = ( 0.5000000 0.5000000 0.1080905), wk = 0.0030960 k( 299) = ( 0.5000000 0.5000000 0.1235320), wk = 0.0030960 k( 300) = ( 0.5000000 0.5000000 0.1389736), wk = 0.0030960 k( 301) = ( 0.5000000 0.5000000 0.1544151), wk = 0.0030960 k( 302) = ( 0.5000000 0.5000000 0.1698566), wk = 0.0030960 k( 303) = ( 0.5000000 0.5000000 0.1852981), wk = 0.0030960 k( 304) = ( 0.5000000 0.5000000 0.2007396), wk = 0.0030960 k( 305) = ( 0.5000000 0.5000000 0.2161811), wk = 0.0030960 k( 306) = ( 0.5000000 0.5000000 0.2316226), wk = 0.0030960 k( 307) = ( 0.5000000 0.5000000 0.2470641), wk = 0.0030960 k( 308) = ( 0.5000000 0.5000000 0.2625056), wk = 0.0030960 k( 309) = ( 0.5000000 0.5000000 0.2779471), wk = 0.0030960 k( 310) = ( 0.5000000 0.5000000 0.2933886), wk = 0.0030960 k( 311) = ( 0.5000000 0.5000000 0.3088301), wk = 0.0030960 k( 312) = ( 0.5000000 0.5000000 0.3242716), wk = 0.0030960 k( 313) = ( 0.5000000 0.5000000 0.3397131), wk = 0.0030960 k( 314) = ( 0.5000000 0.5000000 0.3551546), wk = 0.0030960 k( 315) = ( 0.5000000 0.5000000 0.3705961), wk = 0.0030960 k( 316) = ( 0.5000000 0.5000000 0.3860376), wk = 0.0030960 k( 317) = ( 0.5000000 0.5000000 0.4014792), wk = 0.0030960 k( 318) = ( 0.5000000 0.5000000 0.4169207), wk = 0.0030960 k( 319) = ( 0.5000000 0.5000000 0.4323622), wk = 0.0030960 k( 320) = ( 0.5000000 0.5000000 0.4478037), wk = 0.0030960 k( 321) = ( 0.5000000 0.5000000 0.4632452), wk = 0.0030960 k( 322) = ( 0.5000000 0.5000000 0.4786867), wk = 0.0030960 k( 323) = ( 0.5000000 0.5000000 0.4941282), wk = 0.0030960 cryst. coord. k( 1) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0030960 k( 2) = ( 0.0000000 0.0156250 0.0000000), wk = 0.0030960 k( 3) = ( 0.0000000 0.0312500 0.0000000), wk = 0.0030960 k( 4) = ( 0.0000000 0.0468750 -0.0000000), wk = 0.0030960 k( 5) = ( 0.0000000 0.0625000 0.0000000), wk = 0.0030960 k( 6) = ( 0.0000000 0.0781250 0.0000000), wk = 0.0030960 k( 7) = ( 0.0000000 0.0937500 -0.0000000), wk = 0.0030960 k( 8) = ( 0.0000000 0.1093750 -0.0000000), wk = 0.0030960 k( 9) = ( 0.0000000 0.1250000 0.0000000), wk = 0.0030960 k( 10) = ( 0.0000000 0.1406250 0.0000000), wk = 0.0030960 k( 11) = ( 0.0000000 0.1562500 0.0000000), wk = 0.0030960 k( 12) = ( 0.0000000 0.1718750 0.0000000), wk = 0.0030960 k( 13) = ( 0.0000000 0.1875000 -0.0000000), wk = 0.0030960 k( 14) = ( 0.0000000 0.2031250 0.0000000), wk = 0.0030960 k( 15) = ( 0.0000000 0.2187500 -0.0000000), wk = 0.0030960 k( 16) = ( 0.0000000 0.2343750 0.0000000), wk = 0.0030960 k( 17) = ( 0.0000000 0.2500000 0.0000000), wk = 0.0030960 k( 18) = ( 0.0000000 0.2656250 -0.0000000), wk = 0.0030960 k( 19) = ( 0.0000000 0.2812500 0.0000000), wk = 0.0030960 k( 20) = ( 0.0000000 0.2968750 0.0000000), wk = 0.0030960 k( 21) = ( 0.0000000 0.3125000 0.0000000), wk = 0.0030960 k( 22) = ( 0.0000000 0.3281250 0.0000000), wk = 0.0030960 k( 23) = ( 0.0000000 0.3437500 0.0000000), wk = 0.0030960 k( 24) = ( 0.0000000 0.3593750 0.0000000), wk = 0.0030960 k( 25) = ( 0.0000000 0.3750000 -0.0000000), wk = 0.0030960 k( 26) = ( 0.0000000 0.3906250 0.0000000), wk = 0.0030960 k( 27) = ( 0.0000000 0.4062500 0.0000000), wk = 0.0030960 k( 28) = ( 0.0000000 0.4218750 0.0000000), wk = 0.0030960 k( 29) = ( 0.0000000 0.4375000 -0.0000000), wk = 0.0030960 k( 30) = ( 0.0000000 0.4531250 -0.0000000), wk = 0.0030960 k( 31) = ( 0.0000000 0.4687500 0.0000000), wk = 0.0030960 k( 32) = ( 0.0000000 0.4843750 0.0000000), wk = 0.0030960 k( 33) = ( 0.0000000 0.5000000 0.0000000), wk = 0.0030960 k( 34) = ( 0.0000000 0.5000000 0.0000000), wk = 0.0030960 k( 35) = ( 0.0156250 0.5000000 -0.0000000), wk = 0.0030960 k( 36) = ( 0.0312500 0.5000000 -0.0000000), wk = 0.0030960 k( 37) = ( 0.0468750 0.5000000 -0.0000000), wk = 0.0030960 k( 38) = ( 0.0625000 0.5000000 0.0000000), wk = 0.0030960 k( 39) = ( 0.0781250 0.5000000 -0.0000000), wk = 0.0030960 k( 40) = ( 0.0937500 0.5000000 -0.0000000), wk = 0.0030960 k( 41) = ( 0.1093750 0.5000000 0.0000000), wk = 0.0030960 k( 42) = ( 0.1250000 0.5000000 0.0000000), wk = 0.0030960 k( 43) = ( 0.1406250 0.5000000 0.0000000), wk = 0.0030960 k( 44) = ( 0.1562500 0.5000000 0.0000000), wk = 0.0030960 k( 45) = ( 0.1718750 0.5000000 0.0000000), wk = 0.0030960 k( 46) = ( 0.1875000 0.5000000 0.0000000), wk = 0.0030960 k( 47) = ( 0.2031250 0.5000000 0.0000000), wk = 0.0030960 k( 48) = ( 0.2187500 0.5000000 0.0000000), wk = 0.0030960 k( 49) = ( 0.2343750 0.5000000 0.0000000), wk = 0.0030960 k( 50) = ( 0.2500000 0.5000000 -0.0000000), wk = 0.0030960 k( 51) = ( 0.2656250 0.5000000 0.0000000), wk = 0.0030960 k( 52) = ( 0.2812500 0.5000000 -0.0000000), wk = 0.0030960 k( 53) = ( 0.2968750 0.5000000 -0.0000000), wk = 0.0030960 k( 54) = ( 0.3125000 0.5000000 0.0000000), wk = 0.0030960 k( 55) = ( 0.3281250 0.5000000 -0.0000000), wk = 0.0030960 k( 56) = ( 0.3437500 0.5000000 0.0000000), wk = 0.0030960 k( 57) = ( 0.3593750 0.5000000 0.0000000), wk = 0.0030960 k( 58) = ( 0.3750000 0.5000000 -0.0000000), wk = 0.0030960 k( 59) = ( 0.3906250 0.5000000 0.0000000), wk = 0.0030960 k( 60) = ( 0.4062500 0.5000000 -0.0000000), wk = 0.0030960 k( 61) = ( 0.4218750 0.5000000 0.0000000), wk = 0.0030960 k( 62) = ( 0.4375000 0.5000000 -0.0000000), wk = 0.0030960 k( 63) = ( 0.4531250 0.5000000 -0.0000000), wk = 0.0030960 k( 64) = ( 0.4687500 0.5000000 -0.0000000), wk = 0.0030960 k( 65) = ( 0.4843750 0.5000000 -0.0000000), wk = 0.0030960 k( 66) = ( 0.5000000 0.5000000 0.0000000), wk = 0.0030960 k( 67) = ( 0.5000000 0.5000000 0.0000000), wk = 0.0030960 k( 68) = ( 0.4888889 0.4888889 -0.0000000), wk = 0.0030960 k( 69) = ( 0.4777778 0.4777778 -0.0000000), wk = 0.0030960 k( 70) = ( 0.4666667 0.4666667 0.0000000), wk = 0.0030960 k( 71) = ( 0.4555556 0.4555556 -0.0000000), wk = 0.0030960 k( 72) = ( 0.4444444 0.4444444 0.0000000), wk = 0.0030960 k( 73) = ( 0.4333333 0.4333333 -0.0000000), wk = 0.0030960 k( 74) = ( 0.4222222 0.4222222 0.0000000), wk = 0.0030960 k( 75) = ( 0.4111111 0.4111111 0.0000000), wk = 0.0030960 k( 76) = ( 0.4000000 0.4000000 -0.0000000), wk = 0.0030960 k( 77) = ( 0.3888889 0.3888889 -0.0000000), wk = 0.0030960 k( 78) = ( 0.3777778 0.3777778 0.0000000), wk = 0.0030960 k( 79) = ( 0.3666667 0.3666667 0.0000000), wk = 0.0030960 k( 80) = ( 0.3555556 0.3555556 0.0000000), wk = 0.0030960 k( 81) = ( 0.3444444 0.3444444 0.0000000), wk = 0.0030960 k( 82) = ( 0.3333333 0.3333333 -0.0000000), wk = 0.0030960 k( 83) = ( 0.3222222 0.3222222 0.0000000), wk = 0.0030960 k( 84) = ( 0.3111111 0.3111111 -0.0000000), wk = 0.0030960 k( 85) = ( 0.3000000 0.3000000 -0.0000000), wk = 0.0030960 k( 86) = ( 0.2888889 0.2888889 -0.0000000), wk = 0.0030960 k( 87) = ( 0.2777778 0.2777778 0.0000000), wk = 0.0030960 k( 88) = ( 0.2666667 0.2666667 0.0000000), wk = 0.0030960 k( 89) = ( 0.2555556 0.2555556 0.0000000), wk = 0.0030960 k( 90) = ( 0.2444444 0.2444444 0.0000000), wk = 0.0030960 k( 91) = ( 0.2333333 0.2333333 0.0000000), wk = 0.0030960 k( 92) = ( 0.2222222 0.2222222 0.0000000), wk = 0.0030960 k( 93) = ( 0.2111111 0.2111111 0.0000000), wk = 0.0030960 k( 94) = ( 0.2000000 0.2000000 -0.0000000), wk = 0.0030960 k( 95) = ( 0.1888889 0.1888889 0.0000000), wk = 0.0030960 k( 96) = ( 0.1777778 0.1777778 0.0000000), wk = 0.0030960 k( 97) = ( 0.1666667 0.1666667 0.0000000), wk = 0.0030960 k( 98) = ( 0.1555556 0.1555556 0.0000000), wk = 0.0030960 k( 99) = ( 0.1444444 0.1444444 0.0000000), wk = 0.0030960 k( 100) = ( 0.1333333 0.1333333 0.0000000), wk = 0.0030960 k( 101) = ( 0.1222222 0.1222222 0.0000000), wk = 0.0030960 k( 102) = ( 0.1111111 0.1111111 0.0000000), wk = 0.0030960 k( 103) = ( 0.1000000 0.1000000 -0.0000000), wk = 0.0030960 k( 104) = ( 0.0888889 0.0888889 0.0000000), wk = 0.0030960 k( 105) = ( 0.0777778 0.0777778 0.0000000), wk = 0.0030960 k( 106) = ( 0.0666667 0.0666667 -0.0000000), wk = 0.0030960 k( 107) = ( 0.0555556 0.0555556 0.0000000), wk = 0.0030960 k( 108) = ( 0.0444444 0.0444444 -0.0000000), wk = 0.0030960 k( 109) = ( 0.0333333 0.0333333 0.0000000), wk = 0.0030960 k( 110) = ( 0.0222222 0.0222222 -0.0000000), wk = 0.0030960 k( 111) = ( 0.0111111 0.0111111 -0.0000000), wk = 0.0030960 k( 112) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0030960 k( 113) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0030960 k( 114) = ( 0.0000000 0.0000000 0.0156250), wk = 0.0030960 k( 115) = ( 0.0000000 0.0000000 0.0312500), wk = 0.0030960 k( 116) = ( 0.0000000 0.0000000 0.0468750), wk = 0.0030960 k( 117) = ( 0.0000000 0.0000000 0.0625000), wk = 0.0030960 k( 118) = ( 0.0000000 0.0000000 0.0781250), wk = 0.0030960 k( 119) = ( 0.0000000 0.0000000 0.0937500), wk = 0.0030960 k( 120) = ( 0.0000000 0.0000000 0.1093750), wk = 0.0030960 k( 121) = ( 0.0000000 0.0000000 0.1250000), wk = 0.0030960 k( 122) = ( 0.0000000 0.0000000 0.1406250), wk = 0.0030960 k( 123) = ( 0.0000000 0.0000000 0.1562500), wk = 0.0030960 k( 124) = ( 0.0000000 0.0000000 0.1718750), wk = 0.0030960 k( 125) = ( 0.0000000 0.0000000 0.1875000), wk = 0.0030960 k( 126) = ( 0.0000000 0.0000000 0.2031250), wk = 0.0030960 k( 127) = ( 0.0000000 0.0000000 0.2187500), wk = 0.0030960 k( 128) = ( 0.0000000 0.0000000 0.2343750), wk = 0.0030960 k( 129) = ( 0.0000000 0.0000000 0.2500000), wk = 0.0030960 k( 130) = ( 0.0000000 0.0000000 0.2656250), wk = 0.0030960 k( 131) = ( 0.0000000 0.0000000 0.2812500), wk = 0.0030960 k( 132) = ( 0.0000000 0.0000000 0.2968750), wk = 0.0030960 k( 133) = ( 0.0000000 0.0000000 0.3125000), wk = 0.0030960 k( 134) = ( 0.0000000 0.0000000 0.3281250), wk = 0.0030960 k( 135) = ( 0.0000000 0.0000000 0.3437500), wk = 0.0030960 k( 136) = ( 0.0000000 0.0000000 0.3593750), wk = 0.0030960 k( 137) = ( 0.0000000 0.0000000 0.3750000), wk = 0.0030960 k( 138) = ( 0.0000000 0.0000000 0.3906250), wk = 0.0030960 k( 139) = ( 0.0000000 0.0000000 0.4062500), wk = 0.0030960 k( 140) = ( 0.0000000 0.0000000 0.4218750), wk = 0.0030960 k( 141) = ( 0.0000000 0.0000000 0.4375000), wk = 0.0030960 k( 142) = ( 0.0000000 0.0000000 0.4531250), wk = 0.0030960 k( 143) = ( 0.0000000 0.0000000 0.4687500), wk = 0.0030960 k( 144) = ( 0.0000000 0.0000000 0.4843750), wk = 0.0030960 k( 145) = ( 0.0000000 0.0000000 0.5000000), wk = 0.0030960 k( 146) = ( 0.0000000 0.0000000 0.5000000), wk = 0.0030960 k( 147) = ( 0.0000000 0.0156250 0.5000000), wk = 0.0030960 k( 148) = ( 0.0000000 0.0312500 0.5000000), wk = 0.0030960 k( 149) = ( 0.0000000 0.0468750 0.5000000), wk = 0.0030960 k( 150) = ( 0.0000000 0.0625000 0.5000000), wk = 0.0030960 k( 151) = ( 0.0000000 0.0781250 0.5000000), wk = 0.0030960 k( 152) = ( 0.0000000 0.0937500 0.5000000), wk = 0.0030960 k( 153) = ( 0.0000000 0.1093750 0.5000000), wk = 0.0030960 k( 154) = ( 0.0000000 0.1250000 0.5000000), wk = 0.0030960 k( 155) = ( 0.0000000 0.1406250 0.5000000), wk = 0.0030960 k( 156) = ( 0.0000000 0.1562500 0.5000000), wk = 0.0030960 k( 157) = ( 0.0000000 0.1718750 0.5000000), wk = 0.0030960 k( 158) = ( 0.0000000 0.1875000 0.5000000), wk = 0.0030960 k( 159) = ( 0.0000000 0.2031250 0.5000000), wk = 0.0030960 k( 160) = ( 0.0000000 0.2187500 0.5000000), wk = 0.0030960 k( 161) = ( 0.0000000 0.2343750 0.5000000), wk = 0.0030960 k( 162) = ( 0.0000000 0.2500000 0.5000000), wk = 0.0030960 k( 163) = ( 0.0000000 0.2656250 0.5000000), wk = 0.0030960 k( 164) = ( 0.0000000 0.2812500 0.5000000), wk = 0.0030960 k( 165) = ( 0.0000000 0.2968750 0.5000000), wk = 0.0030960 k( 166) = ( 0.0000000 0.3125000 0.5000000), wk = 0.0030960 k( 167) = ( 0.0000000 0.3281250 0.5000000), wk = 0.0030960 k( 168) = ( 0.0000000 0.3437500 0.5000000), wk = 0.0030960 k( 169) = ( 0.0000000 0.3593750 0.5000000), wk = 0.0030960 k( 170) = ( 0.0000000 0.3750000 0.5000000), wk = 0.0030960 k( 171) = ( 0.0000000 0.3906250 0.5000000), wk = 0.0030960 k( 172) = ( 0.0000000 0.4062500 0.5000000), wk = 0.0030960 k( 173) = ( 0.0000000 0.4218750 0.5000000), wk = 0.0030960 k( 174) = ( 0.0000000 0.4375000 0.5000000), wk = 0.0030960 k( 175) = ( 0.0000000 0.4531250 0.5000000), wk = 0.0030960 k( 176) = ( 0.0000000 0.4687500 0.5000000), wk = 0.0030960 k( 177) = ( 0.0000000 0.4843750 0.5000000), wk = 0.0030960 k( 178) = ( 0.0000000 0.5000000 0.5000000), wk = 0.0030960 k( 179) = ( 0.0000000 0.5000000 0.5000000), wk = 0.0030960 k( 180) = ( 0.0156250 0.5000000 0.5000000), wk = 0.0030960 k( 181) = ( 0.0312500 0.5000000 0.5000000), wk = 0.0030960 k( 182) = ( 0.0468750 0.5000000 0.5000000), wk = 0.0030960 k( 183) = ( 0.0625000 0.5000000 0.5000000), wk = 0.0030960 k( 184) = ( 0.0781250 0.5000000 0.5000000), wk = 0.0030960 k( 185) = ( 0.0937500 0.5000000 0.5000000), wk = 0.0030960 k( 186) = ( 0.1093750 0.5000000 0.5000000), wk = 0.0030960 k( 187) = ( 0.1250000 0.5000000 0.5000000), wk = 0.0030960 k( 188) = ( 0.1406250 0.5000000 0.5000000), wk = 0.0030960 k( 189) = ( 0.1562500 0.5000000 0.5000000), wk = 0.0030960 k( 190) = ( 0.1718750 0.5000000 0.5000000), wk = 0.0030960 k( 191) = ( 0.1875000 0.5000000 0.5000000), wk = 0.0030960 k( 192) = ( 0.2031250 0.5000000 0.5000000), wk = 0.0030960 k( 193) = ( 0.2187500 0.5000000 0.5000000), wk = 0.0030960 k( 194) = ( 0.2343750 0.5000000 0.5000000), wk = 0.0030960 k( 195) = ( 0.2500000 0.5000000 0.5000000), wk = 0.0030960 k( 196) = ( 0.2656250 0.5000000 0.5000000), wk = 0.0030960 k( 197) = ( 0.2812500 0.5000000 0.5000000), wk = 0.0030960 k( 198) = ( 0.2968750 0.5000000 0.5000000), wk = 0.0030960 k( 199) = ( 0.3125000 0.5000000 0.5000000), wk = 0.0030960 k( 200) = ( 0.3281250 0.5000000 0.5000000), wk = 0.0030960 k( 201) = ( 0.3437500 0.5000000 0.5000000), wk = 0.0030960 k( 202) = ( 0.3593750 0.5000000 0.5000000), wk = 0.0030960 k( 203) = ( 0.3750000 0.5000000 0.5000000), wk = 0.0030960 k( 204) = ( 0.3906250 0.5000000 0.5000000), wk = 0.0030960 k( 205) = ( 0.4062500 0.5000000 0.5000000), wk = 0.0030960 k( 206) = ( 0.4218750 0.5000000 0.5000000), wk = 0.0030960 k( 207) = ( 0.4375000 0.5000000 0.5000000), wk = 0.0030960 k( 208) = ( 0.4531250 0.5000000 0.5000000), wk = 0.0030960 k( 209) = ( 0.4687500 0.5000000 0.5000000), wk = 0.0030960 k( 210) = ( 0.4843750 0.5000000 0.5000000), wk = 0.0030960 k( 211) = ( 0.5000000 0.5000000 0.5000000), wk = 0.0030960 k( 212) = ( 0.5000000 0.5000000 0.5000000), wk = 0.0030960 k( 213) = ( 0.4888889 0.4888889 0.5000000), wk = 0.0030960 k( 214) = ( 0.4777778 0.4777778 0.5000000), wk = 0.0030960 k( 215) = ( 0.4666667 0.4666667 0.5000000), wk = 0.0030960 k( 216) = ( 0.4555556 0.4555556 0.5000000), wk = 0.0030960 k( 217) = ( 0.4444444 0.4444444 0.5000000), wk = 0.0030960 k( 218) = ( 0.4333333 0.4333333 0.5000000), wk = 0.0030960 k( 219) = ( 0.4222222 0.4222222 0.5000000), wk = 0.0030960 k( 220) = ( 0.4111111 0.4111111 0.5000000), wk = 0.0030960 k( 221) = ( 0.4000000 0.4000000 0.5000000), wk = 0.0030960 k( 222) = ( 0.3888889 0.3888889 0.5000000), wk = 0.0030960 k( 223) = ( 0.3777778 0.3777778 0.5000000), wk = 0.0030960 k( 224) = ( 0.3666667 0.3666667 0.5000000), wk = 0.0030960 k( 225) = ( 0.3555556 0.3555556 0.5000000), wk = 0.0030960 k( 226) = ( 0.3444444 0.3444444 0.5000000), wk = 0.0030960 k( 227) = ( 0.3333333 0.3333333 0.5000000), wk = 0.0030960 k( 228) = ( 0.3222222 0.3222222 0.5000000), wk = 0.0030960 k( 229) = ( 0.3111111 0.3111111 0.5000000), wk = 0.0030960 k( 230) = ( 0.3000000 0.3000000 0.5000000), wk = 0.0030960 k( 231) = ( 0.2888889 0.2888889 0.5000000), wk = 0.0030960 k( 232) = ( 0.2777778 0.2777778 0.5000000), wk = 0.0030960 k( 233) = ( 0.2666667 0.2666667 0.5000000), wk = 0.0030960 k( 234) = ( 0.2555556 0.2555556 0.5000000), wk = 0.0030960 k( 235) = ( 0.2444444 0.2444444 0.5000000), wk = 0.0030960 k( 236) = ( 0.2333333 0.2333333 0.5000000), wk = 0.0030960 k( 237) = ( 0.2222222 0.2222222 0.5000000), wk = 0.0030960 k( 238) = ( 0.2111111 0.2111111 0.5000000), wk = 0.0030960 k( 239) = ( 0.2000000 0.2000000 0.5000000), wk = 0.0030960 k( 240) = ( 0.1888889 0.1888889 0.5000000), wk = 0.0030960 k( 241) = ( 0.1777778 0.1777778 0.5000000), wk = 0.0030960 k( 242) = ( 0.1666667 0.1666667 0.5000000), wk = 0.0030960 k( 243) = ( 0.1555556 0.1555556 0.5000000), wk = 0.0030960 k( 244) = ( 0.1444444 0.1444444 0.5000000), wk = 0.0030960 k( 245) = ( 0.1333333 0.1333333 0.5000000), wk = 0.0030960 k( 246) = ( 0.1222222 0.1222222 0.5000000), wk = 0.0030960 k( 247) = ( 0.1111111 0.1111111 0.5000000), wk = 0.0030960 k( 248) = ( 0.1000000 0.1000000 0.5000000), wk = 0.0030960 k( 249) = ( 0.0888889 0.0888889 0.5000000), wk = 0.0030960 k( 250) = ( 0.0777778 0.0777778 0.5000000), wk = 0.0030960 k( 251) = ( 0.0666667 0.0666667 0.5000000), wk = 0.0030960 k( 252) = ( 0.0555556 0.0555556 0.5000000), wk = 0.0030960 k( 253) = ( 0.0444444 0.0444444 0.5000000), wk = 0.0030960 k( 254) = ( 0.0333333 0.0333333 0.5000000), wk = 0.0030960 k( 255) = ( 0.0222222 0.0222222 0.5000000), wk = 0.0030960 k( 256) = ( 0.0111111 0.0111111 0.5000000), wk = 0.0030960 k( 257) = ( 0.0000000 0.0000000 0.5000000), wk = 0.0030960 k( 258) = ( 0.0000000 0.5000000 0.0000000), wk = 0.0030960 k( 259) = ( 0.0000000 0.5000000 0.0156250), wk = 0.0030960 k( 260) = ( 0.0000000 0.5000000 0.0312500), wk = 0.0030960 k( 261) = ( 0.0000000 0.5000000 0.0468750), wk = 0.0030960 k( 262) = ( 0.0000000 0.5000000 0.0625000), wk = 0.0030960 k( 263) = ( 0.0000000 0.5000000 0.0781250), wk = 0.0030960 k( 264) = ( 0.0000000 0.5000000 0.0937500), wk = 0.0030960 k( 265) = ( 0.0000000 0.5000000 0.1093750), wk = 0.0030960 k( 266) = ( 0.0000000 0.5000000 0.1250000), wk = 0.0030960 k( 267) = ( 0.0000000 0.5000000 0.1406250), wk = 0.0030960 k( 268) = ( 0.0000000 0.5000000 0.1562500), wk = 0.0030960 k( 269) = ( 0.0000000 0.5000000 0.1718750), wk = 0.0030960 k( 270) = ( 0.0000000 0.5000000 0.1875000), wk = 0.0030960 k( 271) = ( 0.0000000 0.5000000 0.2031250), wk = 0.0030960 k( 272) = ( 0.0000000 0.5000000 0.2187500), wk = 0.0030960 k( 273) = ( 0.0000000 0.5000000 0.2343750), wk = 0.0030960 k( 274) = ( 0.0000000 0.5000000 0.2500000), wk = 0.0030960 k( 275) = ( 0.0000000 0.5000000 0.2656250), wk = 0.0030960 k( 276) = ( 0.0000000 0.5000000 0.2812500), wk = 0.0030960 k( 277) = ( 0.0000000 0.5000000 0.2968750), wk = 0.0030960 k( 278) = ( 0.0000000 0.5000000 0.3125000), wk = 0.0030960 k( 279) = ( 0.0000000 0.5000000 0.3281250), wk = 0.0030960 k( 280) = ( 0.0000000 0.5000000 0.3437500), wk = 0.0030960 k( 281) = ( 0.0000000 0.5000000 0.3593750), wk = 0.0030960 k( 282) = ( 0.0000000 0.5000000 0.3750000), wk = 0.0030960 k( 283) = ( 0.0000000 0.5000000 0.3906250), wk = 0.0030960 k( 284) = ( 0.0000000 0.5000000 0.4062500), wk = 0.0030960 k( 285) = ( 0.0000000 0.5000000 0.4218750), wk = 0.0030960 k( 286) = ( 0.0000000 0.5000000 0.4375000), wk = 0.0030960 k( 287) = ( 0.0000000 0.5000000 0.4531250), wk = 0.0030960 k( 288) = ( 0.0000000 0.5000000 0.4687500), wk = 0.0030960 k( 289) = ( 0.0000000 0.5000000 0.4843750), wk = 0.0030960 k( 290) = ( 0.0000000 0.5000000 0.5000000), wk = 0.0030960 k( 291) = ( 0.5000000 0.5000000 0.0000000), wk = 0.0030960 k( 292) = ( 0.5000000 0.5000000 0.0156250), wk = 0.0030960 k( 293) = ( 0.5000000 0.5000000 0.0312500), wk = 0.0030960 k( 294) = ( 0.5000000 0.5000000 0.0468750), wk = 0.0030960 k( 295) = ( 0.5000000 0.5000000 0.0625000), wk = 0.0030960 k( 296) = ( 0.5000000 0.5000000 0.0781250), wk = 0.0030960 k( 297) = ( 0.5000000 0.5000000 0.0937500), wk = 0.0030960 k( 298) = ( 0.5000000 0.5000000 0.1093750), wk = 0.0030960 k( 299) = ( 0.5000000 0.5000000 0.1250000), wk = 0.0030960 k( 300) = ( 0.5000000 0.5000000 0.1406250), wk = 0.0030960 k( 301) = ( 0.5000000 0.5000000 0.1562500), wk = 0.0030960 k( 302) = ( 0.5000000 0.5000000 0.1718750), wk = 0.0030960 k( 303) = ( 0.5000000 0.5000000 0.1875000), wk = 0.0030960 k( 304) = ( 0.5000000 0.5000000 0.2031250), wk = 0.0030960 k( 305) = ( 0.5000000 0.5000000 0.2187500), wk = 0.0030960 k( 306) = ( 0.5000000 0.5000000 0.2343750), wk = 0.0030960 k( 307) = ( 0.5000000 0.5000000 0.2500000), wk = 0.0030960 k( 308) = ( 0.5000000 0.5000000 0.2656250), wk = 0.0030960 k( 309) = ( 0.5000000 0.5000000 0.2812500), wk = 0.0030960 k( 310) = ( 0.5000000 0.5000000 0.2968750), wk = 0.0030960 k( 311) = ( 0.5000000 0.5000000 0.3125000), wk = 0.0030960 k( 312) = ( 0.5000000 0.5000000 0.3281250), wk = 0.0030960 k( 313) = ( 0.5000000 0.5000000 0.3437500), wk = 0.0030960 k( 314) = ( 0.5000000 0.5000000 0.3593750), wk = 0.0030960 k( 315) = ( 0.5000000 0.5000000 0.3750000), wk = 0.0030960 k( 316) = ( 0.5000000 0.5000000 0.3906250), wk = 0.0030960 k( 317) = ( 0.5000000 0.5000000 0.4062500), wk = 0.0030960 k( 318) = ( 0.5000000 0.5000000 0.4218750), wk = 0.0030960 k( 319) = ( 0.5000000 0.5000000 0.4375000), wk = 0.0030960 k( 320) = ( 0.5000000 0.5000000 0.4531250), wk = 0.0030960 k( 321) = ( 0.5000000 0.5000000 0.4687500), wk = 0.0030960 k( 322) = ( 0.5000000 0.5000000 0.4843750), wk = 0.0030960 k( 323) = ( 0.5000000 0.5000000 0.5000000), wk = 0.0030960 Dense grid: 60245 G-vectors FFT dimensions: ( 50, 50, 50) Smooth grid: 36417 G-vectors FFT dimensions: ( 45, 45, 45) Largest allocated arrays est. size (Mb) dimensions Kohn-Sham Wavefunctions 0.26 Mb ( 272, 62) NL pseudopotentials 0.28 Mb ( 136, 136) Each V/rho on FFT grid 0.08 Mb ( 5000) Each G-vector array 0.01 Mb ( 1673) G-vector shells 0.01 Mb ( 815) Largest temporary arrays est. size (Mb) dimensions Auxiliary wavefunctions 1.03 Mb ( 272, 248) Each subspace H/S matrix 0.06 Mb ( 62, 62) Each matrix 0.26 Mb ( 136, 2, 62) Check: negative/imaginary core charge= -0.000001 0.000000 The potential is recalculated from file : ./SrPb3.save/charge-density.dat Starting wfc are 70 randomized atomic wfcs Band Structure Calculation Davidson diagonalization with overlap Computing kpt #: 1 total cpu time spent up to now is 2.6 secs Computing kpt #: 2 total cpu time spent up to now is 3.2 secs Computing kpt #: 3 total cpu time spent up to now is 3.9 secs Computing kpt #: 4 total cpu time spent up to now is 4.5 secs Computing kpt #: 5 total cpu time spent up to now is 5.2 secs Computing kpt #: 6 total cpu time spent up to now is 5.9 secs Computing kpt #: 7 total cpu time spent up to now is 6.6 secs Computing kpt #: 8 total cpu time spent up to now is 7.2 secs Computing kpt #: 9 total cpu time spent up to now is 7.8 secs Computing kpt #: 10 total cpu time spent up to now is 8.4 secs Computing kpt #: 11 total cpu time spent up to now is 9.0 secs Computing kpt #: 12 total cpu time spent up to now is 9.6 secs Computing kpt #: 13 total cpu time spent up to now is 10.3 secs Computing kpt #: 14 total cpu time spent up to now is 10.9 secs Computing kpt #: 15 total cpu time spent up to now is 11.6 secs Computing kpt #: 16 total cpu time spent up to now is 12.2 secs Computing kpt #: 17 total cpu time spent up to now is 12.8 secs Computing kpt #: 18 total cpu time spent up to now is 13.5 secs Computing kpt #: 19 total cpu time spent up to now is 14.1 secs Computing kpt #: 20 total cpu time spent up to now is 14.7 secs Computing kpt #: 21 total cpu time spent up to now is 15.3 secs Computing kpt #: 22 total cpu time spent up to now is 15.9 secs Computing kpt #: 23 total cpu time spent up to now is 16.5 secs Computing kpt #: 24 total cpu time spent up to now is 17.1 secs Computing kpt #: 25 total cpu time spent up to now is 17.8 secs Computing kpt #: 26 total cpu time spent up to now is 18.4 secs Computing kpt #: 27 total cpu time spent up to now is 19.0 secs Computing kpt #: 28 total cpu time spent up to now is 19.6 secs Computing kpt #: 29 total cpu time spent up to now is 20.2 secs Computing kpt #: 30 total cpu time spent up to now is 20.8 secs Computing kpt #: 31 total cpu time spent up to now is 21.4 secs Computing kpt #: 32 total cpu time spent up to now is 22.1 secs Computing kpt #: 33 total cpu time spent up to now is 22.7 secs Computing kpt #: 34 total cpu time spent up to now is 23.3 secs Computing kpt #: 35 total cpu time spent up to now is 23.9 secs Computing kpt #: 36 total cpu time spent up to now is 24.5 secs Computing kpt #: 37 total cpu time spent up to now is 25.1 secs Computing kpt #: 38 total cpu time spent up to now is 25.7 secs Computing kpt #: 39 total cpu time spent up to now is 26.4 secs Computing kpt #: 40 total cpu time spent up to now is 27.0 secs Computing kpt #: 41 total cpu time spent up to now is 27.6 secs Computing kpt #: 42 total cpu time spent up to now is 28.2 secs Computing kpt #: 43 total cpu time spent up to now is 28.7 secs Computing kpt #: 44 total cpu time spent up to now is 29.3 secs Computing kpt #: 45 total cpu time spent up to now is 29.9 secs Computing kpt #: 46 total cpu time spent up to now is 30.4 secs Computing kpt #: 47 total cpu time spent up to now is 31.0 secs Computing kpt #: 48 total cpu time spent up to now is 31.6 secs Computing kpt #: 49 total cpu time spent up to now is 32.1 secs Computing kpt #: 50 total cpu time spent up to now is 32.7 secs Computing kpt #: 51 total cpu time spent up to now is 33.2 secs Computing kpt #: 52 total cpu time spent up to now is 33.8 secs Computing kpt #: 53 total cpu time spent up to now is 34.4 secs Computing kpt #: 54 total cpu time spent up to now is 35.0 secs Computing kpt #: 55 total cpu time spent up to now is 35.6 secs Computing kpt #: 56 total cpu time spent up to now is 36.2 secs Computing kpt #: 57 total cpu time spent up to now is 36.8 secs Computing kpt #: 58 total cpu time spent up to now is 37.4 secs Computing kpt #: 59 total cpu time spent up to now is 38.0 secs Computing kpt #: 60 total cpu time spent up to now is 38.5 secs Computing kpt #: 61 total cpu time spent up to now is 39.1 secs Computing kpt #: 62 total cpu time spent up to now is 39.6 secs Computing kpt #: 63 total cpu time spent up to now is 40.2 secs Computing kpt #: 64 total cpu time spent up to now is 40.7 secs Computing kpt #: 65 total cpu time spent up to now is 41.3 secs Computing kpt #: 66 total cpu time spent up to now is 41.8 secs Computing kpt #: 67 total cpu time spent up to now is 42.3 secs Computing kpt #: 68 total cpu time spent up to now is 42.9 secs Computing kpt #: 69 total cpu time spent up to now is 43.4 secs Computing kpt #: 70 total cpu time spent up to now is 44.0 secs Computing kpt #: 71 total cpu time spent up to now is 44.5 secs Computing kpt #: 72 total cpu time spent up to now is 45.1 secs Computing kpt #: 73 total cpu time spent up to now is 45.6 secs Computing kpt #: 74 total cpu time spent up to now is 46.2 secs Computing kpt #: 75 total cpu time spent up to now is 46.7 secs Computing kpt #: 76 total cpu time spent up to now is 47.3 secs Computing kpt #: 77 total cpu time spent up to now is 47.9 secs Computing kpt #: 78 total cpu time spent up to now is 48.5 secs Computing kpt #: 79 total cpu time spent up to now is 49.1 secs Computing kpt #: 80 total cpu time spent up to now is 49.7 secs Computing kpt #: 81 total cpu time spent up to now is 50.3 secs Computing kpt #: 82 total cpu time spent up to now is 50.9 secs Computing kpt #: 83 total cpu time spent up to now is 51.5 secs Computing kpt #: 84 total cpu time spent up to now is 52.1 secs Computing kpt #: 85 total cpu time spent up to now is 52.7 secs Computing kpt #: 86 total cpu time spent up to now is 53.3 secs Computing kpt #: 87 total cpu time spent up to now is 53.9 secs Computing kpt #: 88 total cpu time spent up to now is 54.5 secs Computing kpt #: 89 total cpu time spent up to now is 55.1 secs Computing kpt #: 90 total cpu time spent up to now is 55.6 secs Computing kpt #: 91 total cpu time spent up to now is 56.2 secs Computing kpt #: 92 total cpu time spent up to now is 56.8 secs Computing kpt #: 93 total cpu time spent up to now is 57.4 secs Computing kpt #: 94 total cpu time spent up to now is 58.0 secs Computing kpt #: 95 total cpu time spent up to now is 58.6 secs Computing kpt #: 96 total cpu time spent up to now is 59.2 secs Computing kpt #: 97 total cpu time spent up to now is 59.8 secs Computing kpt #: 98 total cpu time spent up to now is 60.5 secs Computing kpt #: 99 total cpu time spent up to now is 61.1 secs Computing kpt #: 100 total cpu time spent up to now is 61.7 secs Computing kpt #: 101 total cpu time spent up to now is 62.3 secs Computing kpt #: 102 total cpu time spent up to now is 63.0 secs Computing kpt #: 103 total cpu time spent up to now is 63.6 secs Computing kpt #: 104 total cpu time spent up to now is 64.2 secs Computing kpt #: 105 total cpu time spent up to now is 64.9 secs Computing kpt #: 106 total cpu time spent up to now is 65.5 secs Computing kpt #: 107 total cpu time spent up to now is 66.2 secs Computing kpt #: 108 total cpu time spent up to now is 66.8 secs Computing kpt #: 109 total cpu time spent up to now is 67.5 secs Computing kpt #: 110 total cpu time spent up to now is 68.1 secs Computing kpt #: 111 total cpu time spent up to now is 68.7 secs Computing kpt #: 112 total cpu time spent up to now is 69.3 secs Computing kpt #: 113 total cpu time spent up to now is 69.9 secs Computing kpt #: 114 total cpu time spent up to now is 70.5 secs Computing kpt #: 115 total cpu time spent up to now is 71.2 secs Computing kpt #: 116 total cpu time spent up to now is 71.8 secs Computing kpt #: 117 total cpu time spent up to now is 72.4 secs Computing kpt #: 118 total cpu time spent up to now is 73.1 secs Computing kpt #: 119 total cpu time spent up to now is 73.7 secs Computing kpt #: 120 total cpu time spent up to now is 74.3 secs Computing kpt #: 121 total cpu time spent up to now is 74.9 secs Computing kpt #: 122 total cpu time spent up to now is 75.5 secs Computing kpt #: 123 total cpu time spent up to now is 76.1 secs Computing kpt #: 124 total cpu time spent up to now is 76.7 secs Computing kpt #: 125 total cpu time spent up to now is 77.3 secs Computing kpt #: 126 total cpu time spent up to now is 78.0 secs Computing kpt #: 127 total cpu time spent up to now is 78.7 secs Computing kpt #: 128 total cpu time spent up to now is 79.3 secs Computing kpt #: 129 total cpu time spent up to now is 79.9 secs Computing kpt #: 130 total cpu time spent up to now is 80.5 secs Computing kpt #: 131 total cpu time spent up to now is 81.1 secs Computing kpt #: 132 total cpu time spent up to now is 81.8 secs Computing kpt #: 133 total cpu time spent up to now is 82.4 secs Computing kpt #: 134 total cpu time spent up to now is 83.0 secs Computing kpt #: 135 total cpu time spent up to now is 83.6 secs Computing kpt #: 136 total cpu time spent up to now is 84.2 secs Computing kpt #: 137 total cpu time spent up to now is 84.8 secs Computing kpt #: 138 total cpu time spent up to now is 85.5 secs Computing kpt #: 139 total cpu time spent up to now is 86.2 secs Computing kpt #: 140 total cpu time spent up to now is 86.9 secs Computing kpt #: 141 total cpu time spent up to now is 87.5 secs Computing kpt #: 142 total cpu time spent up to now is 88.1 secs Computing kpt #: 143 total cpu time spent up to now is 88.7 secs Computing kpt #: 144 total cpu time spent up to now is 89.3 secs Computing kpt #: 145 total cpu time spent up to now is 89.9 secs Computing kpt #: 146 total cpu time spent up to now is 90.5 secs Computing kpt #: 147 total cpu time spent up to now is 91.1 secs Computing kpt #: 148 total cpu time spent up to now is 91.8 secs Computing kpt #: 149 total cpu time spent up to now is 92.4 secs Computing kpt #: 150 total cpu time spent up to now is 93.0 secs Computing kpt #: 151 total cpu time spent up to now is 93.6 secs Computing kpt #: 152 total cpu time spent up to now is 94.3 secs Computing kpt #: 153 total cpu time spent up to now is 94.9 secs Computing kpt #: 154 total cpu time spent up to now is 95.5 secs Computing kpt #: 155 total cpu time spent up to now is 96.0 secs Computing kpt #: 156 total cpu time spent up to now is 96.6 secs Computing kpt #: 157 total cpu time spent up to now is 97.2 secs Computing kpt #: 158 total cpu time spent up to now is 97.8 secs Computing kpt #: 159 total cpu time spent up to now is 98.3 secs Computing kpt #: 160 total cpu time spent up to now is 98.9 secs Computing kpt #: 161 total cpu time spent up to now is 99.4 secs Computing kpt #: 162 total cpu time spent up to now is 100.0 secs Computing kpt #: 163 total cpu time spent up to now is 100.6 secs Computing kpt #: 164 total cpu time spent up to now is 101.1 secs Computing kpt #: 165 total cpu time spent up to now is 101.7 secs Computing kpt #: 166 total cpu time spent up to now is 102.3 secs Computing kpt #: 167 total cpu time spent up to now is 102.9 secs Computing kpt #: 168 total cpu time spent up to now is 103.5 secs Computing kpt #: 169 total cpu time spent up to now is 104.1 secs Computing kpt #: 170 total cpu time spent up to now is 104.7 secs Computing kpt #: 171 total cpu time spent up to now is 105.3 secs Computing kpt #: 172 total cpu time spent up to now is 105.9 secs Computing kpt #: 173 total cpu time spent up to now is 106.4 secs Computing kpt #: 174 total cpu time spent up to now is 107.0 secs Computing kpt #: 175 total cpu time spent up to now is 107.5 secs Computing kpt #: 176 total cpu time spent up to now is 108.1 secs Computing kpt #: 177 total cpu time spent up to now is 108.6 secs Computing kpt #: 178 total cpu time spent up to now is 109.2 secs Computing kpt #: 179 total cpu time spent up to now is 109.7 secs Computing kpt #: 180 total cpu time spent up to now is 110.3 secs Computing kpt #: 181 total cpu time spent up to now is 110.8 secs Computing kpt #: 182 total cpu time spent up to now is 111.4 secs Computing kpt #: 183 total cpu time spent up to now is 111.9 secs Computing kpt #: 184 total cpu time spent up to now is 112.4 secs Computing kpt #: 185 total cpu time spent up to now is 113.0 secs Computing kpt #: 186 total cpu time spent up to now is 113.5 secs Computing kpt #: 187 total cpu time spent up to now is 114.1 secs Computing kpt #: 188 total cpu time spent up to now is 114.6 secs Computing kpt #: 189 total cpu time spent up to now is 115.2 secs Computing kpt #: 190 total cpu time spent up to now is 115.7 secs Computing kpt #: 191 total cpu time spent up to now is 116.2 secs Computing kpt #: 192 total cpu time spent up to now is 116.8 secs Computing kpt #: 193 total cpu time spent up to now is 117.3 secs Computing kpt #: 194 total cpu time spent up to now is 117.8 secs Computing kpt #: 195 total cpu time spent up to now is 118.4 secs Computing kpt #: 196 total cpu time spent up to now is 118.9 secs Computing kpt #: 197 total cpu time spent up to now is 119.5 secs Computing kpt #: 198 total cpu time spent up to now is 120.1 secs Computing kpt #: 199 total cpu time spent up to now is 120.6 secs Computing kpt #: 200 total cpu time spent up to now is 121.2 secs Computing kpt #: 201 total cpu time spent up to now is 121.8 secs Computing kpt #: 202 total cpu time spent up to now is 122.4 secs Computing kpt #: 203 total cpu time spent up to now is 123.0 secs Computing kpt #: 204 total cpu time spent up to now is 123.7 secs Computing kpt #: 205 total cpu time spent up to now is 124.3 secs Computing kpt #: 206 total cpu time spent up to now is 124.9 secs Computing kpt #: 207 total cpu time spent up to now is 125.5 secs Computing kpt #: 208 total cpu time spent up to now is 126.2 secs Computing kpt #: 209 total cpu time spent up to now is 126.9 secs Computing kpt #: 210 total cpu time spent up to now is 127.6 secs Computing kpt #: 211 total cpu time spent up to now is 128.4 secs Computing kpt #: 212 total cpu time spent up to now is 129.0 secs Computing kpt #: 213 total cpu time spent up to now is 129.7 secs Computing kpt #: 214 total cpu time spent up to now is 130.5 secs Computing kpt #: 215 total cpu time spent up to now is 131.1 secs Computing kpt #: 216 total cpu time spent up to now is 131.9 secs Computing kpt #: 217 total cpu time spent up to now is 132.6 secs Computing kpt #: 218 total cpu time spent up to now is 133.3 secs Computing kpt #: 219 total cpu time spent up to now is 134.0 secs Computing kpt #: 220 total cpu time spent up to now is 134.6 secs Computing kpt #: 221 total cpu time spent up to now is 135.2 secs Computing kpt #: 222 total cpu time spent up to now is 135.8 secs Computing kpt #: 223 total cpu time spent up to now is 136.5 secs Computing kpt #: 224 total cpu time spent up to now is 137.1 secs Computing kpt #: 225 total cpu time spent up to now is 137.7 secs Computing kpt #: 226 total cpu time spent up to now is 138.3 secs Computing kpt #: 227 total cpu time spent up to now is 138.9 secs Computing kpt #: 228 total cpu time spent up to now is 139.5 secs Computing kpt #: 229 total cpu time spent up to now is 140.2 secs Computing kpt #: 230 total cpu time spent up to now is 140.8 secs Computing kpt #: 231 total cpu time spent up to now is 141.4 secs Computing kpt #: 232 total cpu time spent up to now is 142.0 secs Computing kpt #: 233 total cpu time spent up to now is 142.6 secs Computing kpt #: 234 total cpu time spent up to now is 143.2 secs Computing kpt #: 235 total cpu time spent up to now is 143.8 secs Computing kpt #: 236 total cpu time spent up to now is 144.4 secs Computing kpt #: 237 total cpu time spent up to now is 145.0 secs Computing kpt #: 238 total cpu time spent up to now is 145.6 secs Computing kpt #: 239 total cpu time spent up to now is 146.2 secs Computing kpt #: 240 total cpu time spent up to now is 146.8 secs Computing kpt #: 241 total cpu time spent up to now is 147.4 secs Computing kpt #: 242 total cpu time spent up to now is 148.0 secs Computing kpt #: 243 total cpu time spent up to now is 148.6 secs Computing kpt #: 244 total cpu time spent up to now is 149.2 secs Computing kpt #: 245 total cpu time spent up to now is 149.9 secs Computing kpt #: 246 total cpu time spent up to now is 150.5 secs Computing kpt #: 247 total cpu time spent up to now is 151.1 secs Computing kpt #: 248 total cpu time spent up to now is 151.7 secs Computing kpt #: 249 total cpu time spent up to now is 152.3 secs Computing kpt #: 250 total cpu time spent up to now is 152.9 secs Computing kpt #: 251 total cpu time spent up to now is 153.6 secs Computing kpt #: 252 total cpu time spent up to now is 154.2 secs Computing kpt #: 253 total cpu time spent up to now is 154.8 secs Computing kpt #: 254 total cpu time spent up to now is 155.4 secs Computing kpt #: 255 total cpu time spent up to now is 156.2 secs Computing kpt #: 256 total cpu time spent up to now is 156.8 secs Computing kpt #: 257 total cpu time spent up to now is 157.4 secs Computing kpt #: 258 total cpu time spent up to now is 158.0 secs Computing kpt #: 259 total cpu time spent up to now is 158.6 secs Computing kpt #: 260 total cpu time spent up to now is 159.2 secs Computing kpt #: 261 total cpu time spent up to now is 159.8 secs Computing kpt #: 262 total cpu time spent up to now is 160.5 secs Computing kpt #: 263 total cpu time spent up to now is 161.1 secs Computing kpt #: 264 total cpu time spent up to now is 161.7 secs Computing kpt #: 265 total cpu time spent up to now is 162.3 secs Computing kpt #: 266 total cpu time spent up to now is 162.9 secs Computing kpt #: 267 total cpu time spent up to now is 163.5 secs Computing kpt #: 268 total cpu time spent up to now is 164.1 secs Computing kpt #: 269 total cpu time spent up to now is 164.7 secs Computing kpt #: 270 total cpu time spent up to now is 165.2 secs Computing kpt #: 271 total cpu time spent up to now is 165.8 secs Computing kpt #: 272 total cpu time spent up to now is 166.3 secs Computing kpt #: 273 total cpu time spent up to now is 166.9 secs Computing kpt #: 274 total cpu time spent up to now is 167.4 secs Computing kpt #: 275 total cpu time spent up to now is 168.0 secs Computing kpt #: 276 total cpu time spent up to now is 168.6 secs Computing kpt #: 277 total cpu time spent up to now is 169.1 secs Computing kpt #: 278 total cpu time spent up to now is 169.8 secs Computing kpt #: 279 total cpu time spent up to now is 170.4 secs Computing kpt #: 280 total cpu time spent up to now is 171.0 secs Computing kpt #: 281 total cpu time spent up to now is 171.6 secs Computing kpt #: 282 total cpu time spent up to now is 172.2 secs Computing kpt #: 283 total cpu time spent up to now is 172.7 secs Computing kpt #: 284 total cpu time spent up to now is 173.3 secs Computing kpt #: 285 total cpu time spent up to now is 173.9 secs Computing kpt #: 286 total cpu time spent up to now is 174.5 secs Computing kpt #: 287 total cpu time spent up to now is 175.0 secs Computing kpt #: 288 total cpu time spent up to now is 175.6 secs Computing kpt #: 289 total cpu time spent up to now is 176.1 secs Computing kpt #: 290 total cpu time spent up to now is 176.7 secs Computing kpt #: 291 total cpu time spent up to now is 177.2 secs Computing kpt #: 292 total cpu time spent up to now is 177.8 secs Computing kpt #: 293 total cpu time spent up to now is 178.3 secs Computing kpt #: 294 total cpu time spent up to now is 178.8 secs Computing kpt #: 295 total cpu time spent up to now is 179.4 secs Computing kpt #: 296 total cpu time spent up to now is 179.9 secs Computing kpt #: 297 total cpu time spent up to now is 180.4 secs Computing kpt #: 298 total cpu time spent up to now is 181.0 secs Computing kpt #: 299 total cpu time spent up to now is 181.5 secs Computing kpt #: 300 total cpu time spent up to now is 182.1 secs Computing kpt #: 301 total cpu time spent up to now is 182.6 secs Computing kpt #: 302 total cpu time spent up to now is 183.1 secs Computing kpt #: 303 total cpu time spent up to now is 183.7 secs Computing kpt #: 304 total cpu time spent up to now is 184.2 secs Computing kpt #: 305 total cpu time spent up to now is 184.8 secs Computing kpt #: 306 total cpu time spent up to now is 185.3 secs Computing kpt #: 307 total cpu time spent up to now is 185.8 secs Computing kpt #: 308 total cpu time spent up to now is 186.4 secs Computing kpt #: 309 total cpu time spent up to now is 187.0 secs Computing kpt #: 310 total cpu time spent up to now is 187.5 secs Computing kpt #: 311 total cpu time spent up to now is 188.1 secs Computing kpt #: 312 total cpu time spent up to now is 188.7 secs Computing kpt #: 313 total cpu time spent up to now is 189.3 secs Computing kpt #: 314 total cpu time spent up to now is 189.9 secs Computing kpt #: 315 total cpu time spent up to now is 190.5 secs Computing kpt #: 316 total cpu time spent up to now is 191.1 secs Computing kpt #: 317 total cpu time spent up to now is 191.7 secs Computing kpt #: 318 total cpu time spent up to now is 192.3 secs Computing kpt #: 319 total cpu time spent up to now is 193.0 secs Computing kpt #: 320 total cpu time spent up to now is 193.7 secs Computing kpt #: 321 total cpu time spent up to now is 194.4 secs Computing kpt #: 322 total cpu time spent up to now is 195.1 secs Computing kpt #: 323 total cpu time spent up to now is 195.8 secs ethr = 1.92E-08, avg # of iterations = 18.5 total cpu time spent up to now is 195.8 secs End of band structure calculation k = 0.0000 0.0000 0.0000 ( 4545 PWs) bands (ev): -25.1099 -25.1099 -7.9500 -7.9500 -7.5180 -7.5180 -7.5125 -7.5125 -7.4872 -7.4872 -7.4629 -7.4629 -7.4580 -7.4580 -7.4487 -7.4487 -6.8159 -6.8159 -6.8131 -6.8131 -5.0237 -5.0237 -5.0153 -5.0153 -5.0118 -5.0118 -4.9447 -4.9447 -4.9413 -4.9413 -4.9377 -4.9377 -4.8241 -4.8241 -4.7629 -4.7629 -4.7624 -4.7624 -0.1193 -0.1193 3.9314 3.9314 4.0218 4.0218 7.9479 7.9479 7.9907 7.9907 8.6297 8.6297 12.2966 12.2966 12.3002 12.3002 12.9271 12.9271 13.2081 13.2081 13.2403 13.2403 13.3463 13.3463 k = 0.0000 0.0156-0.0000 ( 4549 PWs) bands (ev): -25.1099 -25.1099 -7.9500 -7.9500 -7.5180 -7.5180 -7.5125 -7.5125 -7.4872 -7.4872 -7.4630 -7.4630 -7.4580 -7.4580 -7.4488 -7.4488 -6.8159 -6.8159 -6.8131 -6.8131 -5.0236 -5.0236 -5.0152 -5.0152 -5.0117 -5.0117 -4.9446 -4.9446 -4.9412 -4.9412 -4.9377 -4.9377 -4.8242 -4.8242 -4.7630 -4.7630 -4.7626 -4.7626 -0.1177 -0.1177 3.9306 3.9306 4.0183 4.0183 7.9490 7.9490 7.9934 7.9934 8.6315 8.6315 12.2796 12.2796 12.2877 12.2877 12.9329 12.9329 13.1375 13.1375 13.2586 13.2586 13.4011 13.4011 k = 0.0000 0.0312-0.0000 ( 4545 PWs) bands (ev): -25.1099 -25.1099 -7.9503 -7.9503 -7.5178 -7.5178 -7.5124 -7.5124 -7.4873 -7.4873 -7.4631 -7.4631 -7.4582 -7.4582 -7.4489 -7.4489 -6.8157 -6.8157 -6.8131 -6.8131 -5.0233 -5.0233 -5.0149 -5.0149 -5.0115 -5.0115 -4.9445 -4.9445 -4.9412 -4.9412 -4.9376 -4.9376 -4.8243 -4.8243 -4.7633 -4.7633 -4.7629 -4.7629 -0.1131 -0.1131 3.9274 3.9274 4.0085 4.0085 7.9521 7.9521 8.0017 8.0017 8.6371 8.6371 12.2253 12.2253 12.2583 12.2583 12.9497 12.9497 13.0372 13.0372 13.2648 13.2648 13.5030 13.5030 k = 0.0000 0.0469-0.0000 ( 4551 PWs) bands (ev): -25.1099 -25.1099 -7.9507 -7.9507 -7.5175 -7.5175 -7.5123 -7.5123 -7.4875 -7.4875 -7.4632 -7.4632 -7.4584 -7.4584 -7.4491 -7.4491 -6.8155 -6.8155 -6.8129 -6.8129 -5.0228 -5.0228 -5.0144 -5.0144 -5.0111 -5.0111 -4.9443 -4.9443 -4.9412 -4.9412 -4.9374 -4.9374 -4.8245 -4.8245 -4.7641 -4.7641 -4.7634 -4.7634 -0.1054 -0.1054 3.9192 3.9192 3.9955 3.9955 7.9566 7.9566 8.0160 8.0160 8.6463 8.6463 12.1438 12.1438 12.2128 12.2128 12.9339 12.9339 12.9768 12.9768 13.2685 13.2685 13.6166 13.6166 k = 0.0000 0.0625-0.0000 ( 4551 PWs) bands (ev): -25.1099 -25.1099 -7.9512 -7.9512 -7.5172 -7.5172 -7.5121 -7.5121 -7.4877 -7.4877 -7.4635 -7.4635 -7.4588 -7.4588 -7.4494 -7.4494 -6.8152 -6.8152 -6.8127 -6.8127 -5.0222 -5.0222 -5.0137 -5.0137 -5.0106 -5.0106 -4.9440 -4.9440 -4.9411 -4.9411 -4.9372 -4.9372 -4.8248 -4.8248 -4.7652 -4.7652 -4.7640 -4.7640 -0.0947 -0.0947 3.9009 3.9009 3.9845 3.9845 7.9619 7.9619 8.0365 8.0365 8.6592 8.6592 12.0438 12.0438 12.1544 12.1544 12.8314 12.8314 13.0130 13.0130 13.2718 13.2718 13.7213 13.7213 k = 0.0000 0.0781-0.0000 ( 4551 PWs) bands (ev): -25.1099 -25.1099 -7.9519 -7.9519 -7.5168 -7.5168 -7.5118 -7.5118 -7.4880 -7.4880 -7.4638 -7.4638 -7.4592 -7.4592 -7.4498 -7.4498 -6.8149 -6.8149 -6.8123 -6.8123 -5.0214 -5.0214 -5.0128 -5.0128 -5.0100 -5.0100 -4.9436 -4.9436 -4.9411 -4.9411 -4.9369 -4.9369 -4.8251 -4.8251 -4.7667 -4.7667 -4.7647 -4.7647 -0.0808 -0.0808 3.8694 3.8694 3.9793 3.9793 7.9679 7.9679 8.0628 8.0628 8.6757 8.6757 11.9322 11.9322 12.0865 12.0865 12.7309 12.7309 13.0572 13.0572 13.2749 13.2749 13.7256 13.7256 k = 0.0000 0.0938-0.0000 ( 4551 PWs) bands (ev): -25.1098 -25.1098 -7.9528 -7.9528 -7.5162 -7.5162 -7.5115 -7.5115 -7.4884 -7.4884 -7.4642 -7.4642 -7.4598 -7.4598 -7.4502 -7.4502 -6.8147 -6.8147 -6.8117 -6.8117 -5.0204 -5.0204 -5.0117 -5.0117 -5.0092 -5.0092 -4.9431 -4.9431 -4.9410 -4.9410 -4.9366 -4.9366 -4.8255 -4.8255 -4.7685 -4.7685 -4.7655 -4.7655 -0.0640 -0.0640 3.8258 3.8258 3.9791 3.9791 7.9746 7.9746 8.0945 8.0945 8.6960 8.6960 11.8140 11.8140 12.0118 12.0118 12.6330 12.6330 13.1068 13.1068 13.2783 13.2783 13.7285 13.7285 k = 0.0000 0.1094-0.0000 ( 4547 PWs) bands (ev): -25.1098 -25.1098 -7.9537 -7.9537 -7.5157 -7.5157 -7.5111 -7.5111 -7.4888 -7.4888 -7.4646 -7.4646 -7.4605 -7.4605 -7.4506 -7.4506 -6.8146 -6.8146 -6.8110 -6.8110 -5.0194 -5.0194 -5.0104 -5.0104 -5.0082 -5.0082 -4.9426 -4.9426 -4.9409 -4.9409 -4.9362 -4.9362 -4.8260 -4.8260 -4.7706 -4.7706 -4.7665 -4.7665 -0.0442 -0.0442 3.7727 3.7727 3.9819 3.9819 7.9820 7.9820 8.1307 8.1307 8.7200 8.7200 11.6924 11.6924 11.9323 11.9323 12.5382 12.5382 13.1557 13.1557 13.2860 13.2860 13.7207 13.7207 k = 0.0000 0.1250-0.0000 ( 4549 PWs) bands (ev): -25.1098 -25.1098 -7.9548 -7.9548 -7.5151 -7.5151 -7.5106 -7.5106 -7.4893 -7.4893 -7.4651 -7.4651 -7.4614 -7.4614 -7.4510 -7.4510 -6.8145 -6.8145 -6.8100 -6.8100 -5.0183 -5.0183 -5.0088 -5.0088 -5.0071 -5.0071 -4.9419 -4.9419 -4.9408 -4.9408 -4.9357 -4.9357 -4.8266 -4.8266 -4.7730 -4.7730 -4.7676 -4.7676 -0.0213 -0.0213 3.7118 3.7118 3.9867 3.9867 7.9901 7.9901 8.1710 8.1710 8.7477 8.7477 11.5697 11.5697 11.8498 11.8498 12.4466 12.4466 13.1872 13.1872 13.3113 13.3113 13.7043 13.7043 k = 0.0000 0.1406-0.0000 ( 4549 PWs) bands (ev): -25.1098 -25.1098 -7.9560 -7.9560 -7.5145 -7.5145 -7.5100 -7.5100 -7.4898 -7.4898 -7.4656 -7.4656 -7.4623 -7.4623 -7.4514 -7.4514 -6.8145 -6.8145 -6.8089 -6.8089 -5.0171 -5.0171 -5.0071 -5.0071 -5.0057 -5.0057 -4.9413 -4.9413 -4.9406 -4.9406 -4.9351 -4.9351 -4.8272 -4.8272 -4.7758 -4.7758 -4.7689 -4.7689 0.0045 0.0045 3.6444 3.6444 3.9929 3.9929 7.9988 7.9988 8.2146 8.2146 8.7790 8.7790 11.4475 11.4475 11.7653 11.7653 12.3584 12.3584 13.1875 13.1875 13.3637 13.3637 13.6968 13.6968 k = 0.0000 0.1562-0.0000 ( 4553 PWs) bands (ev): -25.1097 -25.1097 -7.9573 -7.9573 -7.5139 -7.5139 -7.5093 -7.5093 -7.4905 -7.4905 -7.4662 -7.4662 -7.4634 -7.4634 -7.4519 -7.4519 -6.8145 -6.8145 -6.8076 -6.8076 -5.0159 -5.0159 -5.0054 -5.0054 -5.0041 -5.0041 -4.9409 -4.9409 -4.9402 -4.9402 -4.9345 -4.9345 -4.8280 -4.8280 -4.7787 -4.7787 -4.7703 -4.7703 0.0331 0.0331 3.5713 3.5713 4.0001 4.0001 8.0082 8.0082 8.2611 8.2611 8.8140 8.8140 11.3270 11.3270 11.6799 11.6799 12.2738 12.2738 13.1649 13.1649 13.4287 13.4287 13.7047 13.7047 k = 0.0000 0.1719-0.0000 ( 4557 PWs) bands (ev): -25.1097 -25.1097 -7.9587 -7.9587 -7.5133 -7.5133 -7.5085 -7.5085 -7.4911 -7.4911 -7.4669 -7.4669 -7.4646 -7.4646 -7.4523 -7.4523 -6.8145 -6.8145 -6.8063 -6.8063 -5.0147 -5.0147 -5.0036 -5.0036 -5.0020 -5.0020 -4.9407 -4.9407 -4.9394 -4.9394 -4.9339 -4.9339 -4.8287 -4.8287 -4.7820 -4.7820 -4.7718 -4.7718 0.0647 0.0647 3.4935 3.4935 4.0082 4.0082 8.0181 8.0181 8.3098 8.3098 8.8525 8.8525 11.2089 11.2089 11.5940 11.5940 12.1929 12.1929 13.1275 13.1275 13.4896 13.4896 13.7363 13.7363 k = 0.0000 0.1875-0.0000 ( 4561 PWs) bands (ev): -25.1097 -25.1097 -7.9602 -7.9602 -7.5127 -7.5127 -7.5075 -7.5075 -7.4918 -7.4918 -7.4676 -7.4676 -7.4657 -7.4657 -7.4527 -7.4527 -6.8145 -6.8145 -6.8049 -6.8049 -5.0135 -5.0135 -5.0019 -5.0019 -4.9995 -4.9995 -4.9405 -4.9405 -4.9385 -4.9385 -4.9332 -4.9332 -4.8296 -4.8296 -4.7855 -4.7855 -4.7734 -4.7734 0.0991 0.0991 3.4115 3.4115 4.0169 4.0169 8.0283 8.0283 8.3603 8.3603 8.8945 8.8945 11.0941 11.0941 11.5083 11.5083 12.1156 12.1156 13.0787 13.0787 13.5356 13.5356 13.7540 13.7540 k = 0.0000 0.2031-0.0000 ( 4557 PWs) bands (ev): -25.1096 -25.1096 -7.9617 -7.9617 -7.5123 -7.5123 -7.5065 -7.5065 -7.4925 -7.4925 -7.4686 -7.4686 -7.4668 -7.4668 -7.4532 -7.4532 -6.8145 -6.8145 -6.8034 -6.8034 -5.0124 -5.0124 -5.0002 -5.0002 -4.9968 -4.9968 -4.9403 -4.9403 -4.9375 -4.9375 -4.9324 -4.9324 -4.8305 -4.8305 -4.7892 -4.7892 -4.7751 -4.7751 0.1362 0.1362 3.3262 3.3262 4.0262 4.0262 8.0389 8.0389 8.4121 8.4121 8.9399 8.9399 10.9829 10.9829 11.4231 11.4231 12.0422 12.0422 13.0212 13.0212 13.5664 13.5664 13.7593 13.7593 k = 0.0000 0.2188-0.0000 ( 4555 PWs) bands (ev): -25.1096 -25.1096 -7.9632 -7.9632 -7.5118 -7.5118 -7.5053 -7.5053 -7.4932 -7.4932 -7.4698 -7.4698 -7.4677 -7.4677 -7.4536 -7.4536 -6.8146 -6.8146 -6.8019 -6.8019 -5.0113 -5.0113 -4.9984 -4.9984 -4.9938 -4.9938 -4.9401 -4.9401 -4.9364 -4.9364 -4.9316 -4.9316 -4.8315 -4.8315 -4.7931 -4.7931 -4.7768 -4.7768 0.1761 0.1761 3.2380 3.2380 4.0360 4.0360 8.0497 8.0497 8.4650 8.4650 8.9883 8.9883 10.8758 10.8758 11.3386 11.3386 11.9725 11.9725 12.9569 12.9569 13.5876 13.5876 13.7648 13.7648 k = 0.0000 0.2344-0.0000 ( 4563 PWs) bands (ev): -25.1095 -25.1095 -7.9648 -7.9648 -7.5115 -7.5115 -7.5042 -7.5042 -7.4938 -7.4938 -7.4712 -7.4712 -7.4685 -7.4685 -7.4540 -7.4540 -6.8146 -6.8146 -6.8003 -6.8003 -5.0103 -5.0103 -4.9965 -4.9965 -4.9905 -4.9905 -4.9399 -4.9399 -4.9353 -4.9353 -4.9308 -4.9308 -4.8326 -4.8326 -4.7972 -4.7972 -4.7787 -4.7787 0.2186 0.2186 3.1475 3.1475 4.0461 4.0461 8.0605 8.0605 8.5185 8.5185 9.0398 9.0398 10.7731 10.7731 11.2550 11.2550 11.9068 11.9068 12.8876 12.8876 13.6026 13.6026 13.7705 13.7705 k = 0.0000 0.2500-0.0000 ( 4558 PWs) bands (ev): -25.1095 -25.1095 -7.9664 -7.9664 -7.5112 -7.5112 -7.5030 -7.5030 -7.4944 -7.4944 -7.4727 -7.4727 -7.4691 -7.4691 -7.4545 -7.4545 -6.8146 -6.8146 -6.7987 -6.7987 -5.0093 -5.0093 -4.9946 -4.9946 -4.9870 -4.9870 -4.9396 -4.9396 -4.9341 -4.9341 -4.9300 -4.9300 -4.8337 -4.8337 -4.8015 -4.8015 -4.7806 -4.7806 0.2636 0.2636 3.0553 3.0553 4.0565 4.0565 8.0713 8.0713 8.5725 8.5725 9.0939 9.0939 10.6753 10.6753 11.1726 11.1726 11.8449 11.8449 12.8146 12.8146 13.6118 13.6118 13.7762 13.7762 k = 0.0000 0.2656-0.0000 ( 4574 PWs) bands (ev): -25.1095 -25.1095 -7.9680 -7.9680 -7.5109 -7.5109 -7.5018 -7.5018 -7.4949 -7.4949 -7.4742 -7.4742 -7.4697 -7.4697 -7.4550 -7.4550 -6.8146 -6.8146 -6.7972 -6.7972 -5.0084 -5.0084 -4.9928 -4.9928 -4.9833 -4.9833 -4.9393 -4.9393 -4.9329 -4.9329 -4.9292 -4.9292 -4.8350 -4.8350 -4.8058 -4.8058 -4.7826 -4.7826 0.3110 0.3110 2.9619 2.9619 4.0670 4.0670 8.0819 8.0819 8.6267 8.6267 9.1504 9.1504 10.5825 10.5825 11.0913 11.0913 11.7869 11.7869 12.7390 12.7390 13.6139 13.6139 13.7820 13.7820 k = 0.0000 0.2812-0.0000 ( 4570 PWs) bands (ev): -25.1094 -25.1094 -7.9696 -7.9696 -7.5107 -7.5107 -7.5008 -7.5008 -7.4951 -7.4951 -7.4758 -7.4758 -7.4703 -7.4703 -7.4556 -7.4556 -6.8146 -6.8146 -6.7956 -6.7956 -5.0075 -5.0075 -4.9909 -4.9909 -4.9795 -4.9795 -4.9389 -4.9389 -4.9317 -4.9317 -4.9284 -4.9284 -4.8364 -4.8364 -4.8102 -4.8102 -4.7845 -4.7845 0.3608 0.3608 2.8677 2.8677 4.0776 4.0776 8.0922 8.0922 8.6809 8.6809 9.2089 9.2089 10.4950 10.4950 11.0114 11.0114 11.7329 11.7329 12.6621 12.6621 13.6070 13.6070 13.7878 13.7878 k = 0.0000 0.2969-0.0000 ( 4564 PWs) bands (ev): -25.1094 -25.1094 -7.9711 -7.9711 -7.5106 -7.5106 -7.5001 -7.5001 -7.4949 -7.4949 -7.4773 -7.4773 -7.4708 -7.4708 -7.4561 -7.4561 -6.8146 -6.8146 -6.7941 -6.7941 -5.0067 -5.0067 -4.9891 -4.9891 -4.9754 -4.9754 -4.9385 -4.9385 -4.9305 -4.9305 -4.9275 -4.9275 -4.8379 -4.8379 -4.8146 -4.8146 -4.7865 -4.7865 0.4127 0.4127 2.7733 2.7733 4.0881 4.0881 8.1021 8.1021 8.7349 8.7349 9.2692 9.2692 10.4130 10.4130 10.9328 10.9328 11.6827 11.6827 12.5845 12.5845 13.5900 13.5900 13.7935 13.7935 k = 0.0000 0.3125-0.0000 ( 4560 PWs) bands (ev): -25.1093 -25.1093 -7.9726 -7.9726 -7.5106 -7.5106 -7.4997 -7.4997 -7.4944 -7.4944 -7.4788 -7.4788 -7.4713 -7.4713 -7.4567 -7.4567 -6.8146 -6.8146 -6.7926 -6.7926 -5.0059 -5.0059 -4.9873 -4.9873 -4.9713 -4.9713 -4.9380 -4.9380 -4.9294 -4.9294 -4.9267 -4.9267 -4.8397 -4.8397 -4.8189 -4.8189 -4.7885 -4.7885 0.4666 0.4666 2.6790 2.6790 4.0984 4.0984 8.1115 8.1115 8.7884 8.7884 9.3307 9.3307 10.3366 10.3366 10.8556 10.8556 11.6364 11.6364 12.5072 12.5072 13.5628 13.5628 13.7991 13.7991 k = 0.0000 0.3281-0.0000 ( 4556 PWs) bands (ev): -25.1093 -25.1093 -7.9740 -7.9740 -7.5107 -7.5107 -7.4996 -7.4996 -7.4934 -7.4934 -7.4803 -7.4803 -7.4717 -7.4717 -7.4573 -7.4573 -6.8146 -6.8146 -6.7912 -6.7912 -5.0052 -5.0052 -4.9857 -4.9857 -4.9670 -4.9670 -4.9374 -4.9374 -4.9283 -4.9283 -4.9258 -4.9258 -4.8417 -4.8417 -4.8229 -4.8229 -4.7904 -4.7904 0.5223 0.5223 2.5853 2.5853 4.1084 4.1084 8.1203 8.1203 8.8413 8.8413 9.3931 9.3931 10.2661 10.2661 10.7799 10.7799 11.5941 11.5941 12.4310 12.4310 13.5271 13.5271 13.8045 13.8045 k = 0.0000 0.3438-0.0000 ( 4566 PWs) bands (ev): -25.1093 -25.1093 -7.9754 -7.9754 -7.5109 -7.5109 -7.4996 -7.4996 -7.4923 -7.4923 -7.4816 -7.4816 -7.4722 -7.4722 -7.4580 -7.4580 -6.8146 -6.8146 -6.7899 -6.7899 -5.0045 -5.0045 -4.9841 -4.9841 -4.9626 -4.9626 -4.9367 -4.9367 -4.9274 -4.9274 -4.9248 -4.9248 -4.8442 -4.8442 -4.8266 -4.8266 -4.7923 -4.7923 0.5795 0.5795 2.4928 2.4928 4.1180 4.1180 8.1284 8.1284 8.8931 8.8931 9.4561 9.4561 10.2016 10.2016 10.7058 10.7058 11.5556 11.5556 12.3567 12.3567 13.4856 13.4856 13.8096 13.8096 k = 0.0000 0.3594-0.0000 ( 4568 PWs) bands (ev): -25.1092 -25.1092 -7.9766 -7.9766 -7.5112 -7.5112 -7.4996 -7.4996 -7.4912 -7.4912 -7.4827 -7.4827 -7.4726 -7.4726 -7.4587 -7.4587 -6.8146 -6.8146 -6.7887 -6.7887 -5.0040 -5.0040 -4.9827 -4.9827 -4.9581 -4.9581 -4.9361 -4.9361 -4.9266 -4.9266 -4.9238 -4.9238 -4.8472 -4.8472 -4.8297 -4.8297 -4.7941 -4.7941 0.6379 0.6379 2.4019 2.4019 4.1271 4.1271 8.1357 8.1357 8.9436 8.9436 9.5190 9.5190 10.1432 10.1432 10.6333 10.6333 11.5209 11.5209 12.2851 12.2851 13.4415 13.4415 13.8144 13.8144 k = 0.0000 0.3750-0.0000 ( 4564 PWs) bands (ev): -25.1092 -25.1092 -7.9778 -7.9778 -7.5115 -7.5115 -7.4996 -7.4996 -7.4902 -7.4902 -7.4836 -7.4836 -7.4729 -7.4729 -7.4594 -7.4594 -6.8146 -6.8146 -6.7875 -6.7875 -5.0035 -5.0035 -4.9814 -4.9814 -4.9536 -4.9536 -4.9353 -4.9353 -4.9260 -4.9260 -4.9228 -4.9228 -4.8507 -4.8507 -4.8323 -4.8323 -4.7958 -4.7958 0.6969 0.6969 2.3134 2.3134 4.1356 4.1356 8.1423 8.1423 8.9921 8.9921 9.5816 9.5816 10.0911 10.0911 10.5625 10.5625 11.4900 11.4900 12.2171 12.2171 13.3971 13.3971 13.8189 13.8189 k = 0.0000 0.3906-0.0000 ( 4554 PWs) bands (ev): -25.1092 -25.1092 -7.9788 -7.9788 -7.5118 -7.5118 -7.4996 -7.4996 -7.4895 -7.4895 -7.4841 -7.4841 -7.4732 -7.4732 -7.4601 -7.4601 -6.8146 -6.8146 -6.7865 -6.7865 -5.0030 -5.0030 -4.9802 -4.9802 -4.9491 -4.9491 -4.9346 -4.9346 -4.9254 -4.9254 -4.9218 -4.9218 -4.8546 -4.8546 -4.8343 -4.8343 -4.7974 -4.7974 0.7560 0.7560 2.2280 2.2280 4.1433 4.1433 8.1481 8.1481 9.0382 9.0382 9.6434 9.6434 10.0453 10.0453 10.4935 10.4935 11.4628 11.4628 12.1536 12.1536 13.3547 13.3547 13.8229 13.8229 k = 0.0000 0.4062-0.0000 ( 4550 PWs) bands (ev): -25.1091 -25.1091 -7.9797 -7.9797 -7.5121 -7.5121 -7.4996 -7.4996 -7.4892 -7.4892 -7.4841 -7.4841 -7.4735 -7.4735 -7.4608 -7.4608 -6.8145 -6.8145 -6.7856 -6.7856 -5.0026 -5.0026 -4.9792 -4.9792 -4.9447 -4.9447 -4.9338 -4.9338 -4.9251 -4.9251 -4.9208 -4.9208 -4.8587 -4.8587 -4.8359 -4.8359 -4.7989 -4.7989 0.8142 0.8142 2.1467 2.1467 4.1502 4.1502 8.1530 8.1530 9.0811 9.0811 9.7039 9.7039 10.0060 10.0060 10.4264 10.4264 11.4394 11.4394 12.0956 12.0956 13.3156 13.3156 13.8265 13.8265 k = 0.0000 0.4219-0.0000 ( 4558 PWs) bands (ev): -25.1091 -25.1091 -7.9806 -7.9806 -7.5124 -7.5124 -7.4995 -7.4995 -7.4894 -7.4894 -7.4836 -7.4836 -7.4738 -7.4738 -7.4615 -7.4615 -6.8145 -6.8145 -6.7848 -6.7848 -5.0023 -5.0023 -4.9784 -4.9784 -4.9405 -4.9405 -4.9331 -4.9331 -4.9248 -4.9248 -4.9200 -4.9200 -4.8629 -4.8629 -4.8372 -4.8372 -4.8001 -4.8001 0.8704 0.8704 2.0709 2.0709 4.1563 4.1563 8.1571 8.1571 9.1199 9.1199 9.7624 9.7624 9.9736 9.9736 10.3612 10.3612 11.4196 11.4196 12.0441 12.0441 13.2811 13.2811 13.8296 13.8296 k = 0.0000 0.4375-0.0000 ( 4552 PWs) bands (ev): -25.1091 -25.1091 -7.9812 -7.9812 -7.5127 -7.5127 -7.4994 -7.4994 -7.4898 -7.4898 -7.4830 -7.4830 -7.4739 -7.4739 -7.4622 -7.4622 -6.8145 -6.8145 -6.7841 -6.7841 -5.0020 -5.0020 -4.9777 -4.9777 -4.9367 -4.9367 -4.9323 -4.9323 -4.9246 -4.9246 -4.9192 -4.9192 -4.8668 -4.8668 -4.8381 -4.8381 -4.8012 -4.8012 0.9227 0.9227 2.0023 2.0023 4.1613 4.1613 8.1605 8.1605 9.1536 9.1536 9.8177 9.8177 9.9494 9.9494 10.2980 10.2980 11.4035 11.4035 12.0001 12.0001 13.2520 13.2520 13.8322 13.8322 k = 0.0000 0.4531-0.0000 ( 4546 PWs) bands (ev): -25.1091 -25.1091 -7.9817 -7.9817 -7.5130 -7.5130 -7.4994 -7.4994 -7.4901 -7.4901 -7.4823 -7.4823 -7.4741 -7.4741 -7.4627 -7.4627 -6.8145 -6.8145 -6.7836 -6.7836 -5.0018 -5.0018 -4.9771 -4.9771 -4.9336 -4.9336 -4.9313 -4.9313 -4.9244 -4.9244 -4.9186 -4.9186 -4.8704 -4.8704 -4.8388 -4.8388 -4.8020 -4.8020 0.9689 0.9689 1.9434 1.9434 4.1653 4.1653 8.1630 8.1630 9.1814 9.1814 9.8639 9.8639 9.9392 9.9392 10.2369 10.2369 11.3910 11.3910 11.9647 11.9647 13.2288 13.2288 13.8342 13.8342 k = 0.0000 0.4688-0.0000 ( 4548 PWs) bands (ev): -25.1091 -25.1091 -7.9821 -7.9821 -7.5131 -7.5131 -7.4993 -7.4993 -7.4904 -7.4904 -7.4818 -7.4818 -7.4742 -7.4742 -7.4632 -7.4632 -6.8145 -6.8145 -6.7832 -6.7832 -5.0016 -5.0016 -4.9768 -4.9768 -4.9321 -4.9321 -4.9296 -4.9296 -4.9244 -4.9244 -4.9181 -4.9181 -4.8732 -4.8732 -4.8393 -4.8393 -4.8027 -4.8027 1.0059 1.0059 1.8973 1.8973 4.1682 4.1682 8.1648 8.1648 9.2020 9.2020 9.8830 9.8830 9.9611 9.9611 10.1779 10.1779 11.3820 11.3820 11.9386 11.9386 13.2120 13.2120 13.8356 13.8356 k = 0.0000 0.4844-0.0000 ( 4538 PWs) bands (ev): -25.1091 -25.1091 -7.9823 -7.9823 -7.5132 -7.5132 -7.4993 -7.4993 -7.4906 -7.4906 -7.4814 -7.4814 -7.4742 -7.4742 -7.4635 -7.4635 -6.8145 -6.8145 -6.7830 -6.7830 -5.0016 -5.0016 -4.9765 -4.9765 -4.9316 -4.9316 -4.9281 -4.9281 -4.9243 -4.9243 -4.9178 -4.9178 -4.8751 -4.8751 -4.8396 -4.8396 -4.8030 -4.8030 1.0301 1.0301 1.8676 1.8676 4.1699 4.1699 8.1659 8.1659 9.2148 9.2148 9.8825 9.8825 10.0071 10.0071 10.1215 10.1215 11.3767 11.3767 11.9227 11.9227 13.2018 13.2018 13.8365 13.8365 k = 0.0000 0.5000-0.0000 ( 4544 PWs) bands (ev): -25.1091 -25.1091 -7.9824 -7.9824 -7.5133 -7.5133 -7.4993 -7.4993 -7.4907 -7.4907 -7.4813 -7.4813 -7.4743 -7.4743 -7.4636 -7.4636 -6.8145 -6.8145 -6.7829 -6.7829 -5.0015 -5.0015 -4.9764 -4.9764 -4.9315 -4.9315 -4.9275 -4.9275 -4.9243 -4.9243 -4.9176 -4.9176 -4.8758 -4.8758 -4.8397 -4.8397 -4.8032 -4.8032 1.0386 1.0386 1.8573 1.8573 4.1705 4.1705 8.1662 8.1662 9.2192 9.2192 9.8812 9.8812 10.0463 10.0463 10.0800 10.0800 11.3749 11.3749 11.9173 11.9173 13.1983 13.1983 13.8368 13.8368 k = 0.0000 0.5000-0.0000 ( 4544 PWs) bands (ev): -25.1091 -25.1091 -7.9824 -7.9824 -7.5133 -7.5133 -7.4993 -7.4993 -7.4907 -7.4907 -7.4813 -7.4813 -7.4743 -7.4743 -7.4636 -7.4636 -6.8145 -6.8145 -6.7829 -6.7829 -5.0015 -5.0015 -4.9764 -4.9764 -4.9315 -4.9315 -4.9275 -4.9275 -4.9243 -4.9243 -4.9176 -4.9176 -4.8758 -4.8758 -4.8397 -4.8397 -4.8032 -4.8032 1.0386 1.0386 1.8573 1.8573 4.1705 4.1705 8.1662 8.1662 9.2192 9.2192 9.8812 9.8812 10.0463 10.0463 10.0800 10.0800 11.3749 11.3749 11.9173 11.9173 13.1983 13.1983 13.8368 13.8368 k = 0.0156 0.5000-0.0000 ( 4540 PWs) bands (ev): -25.1091 -25.1091 -7.9824 -7.9824 -7.5133 -7.5133 -7.4993 -7.4993 -7.4906 -7.4906 -7.4813 -7.4813 -7.4744 -7.4744 -7.4635 -7.4635 -6.8145 -6.8145 -6.7829 -6.7829 -5.0015 -5.0015 -4.9765 -4.9765 -4.9318 -4.9318 -4.9274 -4.9274 -4.9242 -4.9242 -4.9174 -4.9174 -4.8757 -4.8757 -4.8398 -4.8398 -4.8033 -4.8033 1.0398 1.0398 1.8584 1.8584 4.1671 4.1671 8.1679 8.1679 9.2200 9.2200 9.8596 9.8596 9.9887 9.9887 10.1491 10.1491 11.3836 11.3836 11.9198 11.9198 13.1969 13.1969 13.8419 13.8419 k = 0.0312 0.5000-0.0000 ( 4540 PWs) bands (ev): -25.1091 -25.1091 -7.9825 -7.9825 -7.5133 -7.5133 -7.4992 -7.4992 -7.4906 -7.4906 -7.4813 -7.4813 -7.4747 -7.4747 -7.4632 -7.4632 -6.8145 -6.8145 -6.7831 -6.7831 -5.0013 -5.0013 -4.9767 -4.9767 -4.9326 -4.9326 -4.9272 -4.9272 -4.9238 -4.9238 -4.9168 -4.9168 -4.8755 -4.8755 -4.8400 -4.8400 -4.8037 -4.8037 1.0433 1.0433 1.8619 1.8619 4.1569 4.1569 8.1729 8.1729 9.2222 9.2222 9.7840 9.7840 9.9585 9.9585 10.2252 10.2252 11.4086 11.4086 11.9277 11.9277 13.1925 13.1925 13.8570 13.8570 k = 0.0469 0.5000-0.0000 ( 4538 PWs) bands (ev): -25.1090 -25.1090 -7.9825 -7.9825 -7.5132 -7.5132 -7.4991 -7.4991 -7.4904 -7.4904 -7.4812 -7.4812 -7.4753 -7.4753 -7.4628 -7.4628 -6.8146 -6.8146 -6.7832 -6.7832 -5.0010 -5.0010 -4.9771 -4.9771 -4.9337 -4.9337 -4.9269 -4.9269 -4.9232 -4.9232 -4.9160 -4.9160 -4.8753 -4.8753 -4.8402 -4.8402 -4.8044 -4.8044 1.0491 1.0491 1.8675 1.8675 4.1401 4.1401 8.1810 8.1810 9.2253 9.2253 9.6762 9.6762 9.9547 9.9547 10.2894 10.2894 11.4470 11.4470 11.9426 11.9426 13.1852 13.1852 13.8817 13.8817 k = 0.0625 0.5000-0.0000 ( 4542 PWs) bands (ev): -25.1090 -25.1090 -7.9826 -7.9826 -7.5132 -7.5132 -7.4989 -7.4989 -7.4902 -7.4902 -7.4812 -7.4812 -7.4760 -7.4760 -7.4624 -7.4624 -6.8148 -6.8148 -6.7834 -6.7834 -5.0005 -5.0005 -4.9775 -4.9775 -4.9350 -4.9350 -4.9266 -4.9266 -4.9225 -4.9225 -4.9149 -4.9149 -4.8749 -4.8749 -4.8406 -4.8406 -4.8054 -4.8054 1.0573 1.0573 1.8754 1.8754 4.1169 4.1169 8.1921 8.1921 9.2276 9.2276 9.5590 9.5590 9.9599 9.9599 10.3398 10.3398 11.4938 11.4938 11.9672 11.9672 13.1750 13.1750 13.9154 13.9154 k = 0.0781 0.5000-0.0000 ( 4548 PWs) bands (ev): -25.1090 -25.1090 -7.9827 -7.9827 -7.5132 -7.5132 -7.4988 -7.4988 -7.4900 -7.4900 -7.4811 -7.4811 -7.4768 -7.4768 -7.4619 -7.4619 -6.8149 -6.8149 -6.7837 -6.7837 -5.0000 -5.0000 -4.9780 -4.9780 -4.9364 -4.9364 -4.9262 -4.9262 -4.9216 -4.9216 -4.9137 -4.9137 -4.8744 -4.8744 -4.8410 -4.8410 -4.8066 -4.8066 1.0679 1.0679 1.8855 1.8855 4.0874 4.0874 8.2058 8.2058 9.2237 9.2237 9.4450 9.4450 9.9696 9.9696 10.3770 10.3770 11.5419 11.5419 12.0050 12.0050 13.1619 13.1619 13.9561 13.9561 k = 0.0938 0.5000-0.0000 ( 4546 PWs) bands (ev): -25.1090 -25.1090 -7.9829 -7.9829 -7.5132 -7.5132 -7.4985 -7.4985 -7.4897 -7.4897 -7.4811 -7.4811 -7.4777 -7.4777 -7.4613 -7.4613 -6.8152 -6.8152 -6.7840 -6.7840 -4.9993 -4.9993 -4.9786 -4.9786 -4.9379 -4.9379 -4.9257 -4.9257 -4.9207 -4.9207 -4.9124 -4.9124 -4.8738 -4.8738 -4.8416 -4.8416 -4.8081 -4.8081 1.0807 1.0807 1.8977 1.8977 4.0520 4.0520 8.2216 8.2216 9.1933 9.1933 9.3577 9.3577 9.9824 9.9824 10.4024 10.4024 11.5840 11.5840 12.0596 12.0596 13.1455 13.1455 13.9956 13.9956 k = 0.1094 0.5000-0.0000 ( 4546 PWs) bands (ev): -25.1090 -25.1090 -7.9830 -7.9830 -7.5132 -7.5132 -7.4983 -7.4983 -7.4895 -7.4895 -7.4810 -7.4810 -7.4785 -7.4785 -7.4609 -7.4609 -6.8155 -6.8155 -6.7843 -6.7843 -4.9986 -4.9986 -4.9792 -4.9792 -4.9394 -4.9394 -4.9253 -4.9253 -4.9197 -4.9197 -4.9111 -4.9111 -4.8730 -4.8730 -4.8422 -4.8422 -4.8098 -4.8098 1.0959 1.0959 1.9120 1.9120 4.0111 4.0111 8.2386 8.2386 9.1096 9.1096 9.3263 9.3263 9.9980 9.9980 10.4179 10.4179 11.6152 11.6152 12.1321 12.1321 13.1255 13.1255 14.0010 14.0010 k = 0.1250 0.5000-0.0000 ( 4538 PWs) bands (ev): -25.1090 -25.1090 -7.9832 -7.9832 -7.5132 -7.5132 -7.4980 -7.4980 -7.4892 -7.4892 -7.4808 -7.4808 -7.4793 -7.4793 -7.4604 -7.4604 -6.8160 -6.8160 -6.7846 -6.7846 -4.9977 -4.9977 -4.9798 -4.9798 -4.9408 -4.9408 -4.9247 -4.9247 -4.9187 -4.9187 -4.9099 -4.9099 -4.8722 -4.8722 -4.8429 -4.8429 -4.8117 -4.8117 1.1134 1.1134 1.9282 1.9282 3.9650 3.9650 8.2555 8.2555 8.9979 8.9979 9.3278 9.3278 10.0158 10.0158 10.4253 10.4253 11.6339 11.6339 12.2199 12.2199 13.1012 13.1012 13.9798 13.9798 k = 0.1406 0.5000-0.0000 ( 4540 PWs) bands (ev): -25.1089 -25.1089 -7.9834 -7.9834 -7.5133 -7.5133 -7.4976 -7.4976 -7.4889 -7.4889 -7.4807 -7.4807 -7.4801 -7.4801 -7.4600 -7.4600 -6.8165 -6.8165 -6.7849 -6.7849 -4.9968 -4.9968 -4.9804 -4.9804 -4.9422 -4.9422 -4.9242 -4.9242 -4.9177 -4.9177 -4.9087 -4.9087 -4.8712 -4.8712 -4.8436 -4.8436 -4.8139 -4.8139 1.1332 1.1332 1.9463 1.9463 3.9141 3.9141 8.2698 8.2698 8.8833 8.8833 9.3403 9.3403 10.0355 10.0355 10.4264 10.4264 11.6413 11.6413 12.3183 12.3183 13.0718 13.0718 13.9597 13.9597 k = 0.1562 0.5000-0.0000 ( 4544 PWs) bands (ev): -25.1089 -25.1089 -7.9836 -7.9836 -7.5134 -7.5134 -7.4972 -7.4972 -7.4887 -7.4887 -7.4808 -7.4808 -7.4805 -7.4805 -7.4597 -7.4597 -6.8171 -6.8171 -6.7851 -6.7851 -4.9957 -4.9957 -4.9809 -4.9809 -4.9435 -4.9435 -4.9236 -4.9236 -4.9168 -4.9168 -4.9076 -4.9076 -4.8701 -4.8701 -4.8444 -4.8444 -4.8163 -4.8163 1.1553 1.1553 1.9662 1.9662 3.8588 3.8588 8.2765 8.2765 8.7770 8.7770 9.3580 9.3580 10.0569 10.0569 10.4228 10.4228 11.6391 11.6391 12.4221 12.4221 13.0367 13.0367 13.9486 13.9486 k = 0.1719 0.5000-0.0000 ( 4556 PWs) bands (ev): -25.1089 -25.1089 -7.9838 -7.9838 -7.5135 -7.5135 -7.4968 -7.4968 -7.4885 -7.4885 -7.4813 -7.4813 -7.4802 -7.4802 -7.4594 -7.4594 -6.8179 -6.8179 -6.7852 -6.7852 -4.9947 -4.9947 -4.9813 -4.9813 -4.9448 -4.9448 -4.9229 -4.9229 -4.9160 -4.9160 -4.9066 -4.9066 -4.8689 -4.8689 -4.8452 -4.8452 -4.8189 -4.8189 1.1797 1.1797 1.9876 1.9876 3.7997 3.7997 8.2670 8.2670 8.6901 8.6901 9.3789 9.3789 10.0792 10.0792 10.4161 10.4161 11.6288 11.6288 12.5253 12.5253 12.9973 12.9973 13.9501 13.9501 k = 0.1875 0.5000-0.0000 ( 4550 PWs) bands (ev): -25.1089 -25.1089 -7.9841 -7.9841 -7.5137 -7.5137 -7.4963 -7.4963 -7.4886 -7.4886 -7.4816 -7.4816 -7.4799 -7.4799 -7.4592 -7.4592 -6.8188 -6.8188 -6.7853 -6.7853 -4.9936 -4.9936 -4.9816 -4.9816 -4.9459 -4.9459 -4.9222 -4.9222 -4.9152 -4.9152 -4.9057 -4.9057 -4.8676 -4.8676 -4.8461 -4.8461 -4.8216 -4.8216 1.2064 1.2064 2.0106 2.0106 3.7371 3.7371 8.2299 8.2299 8.6350 8.6350 9.4023 9.4023 10.1019 10.1019 10.4076 10.4076 11.6116 11.6116 12.6193 12.6193 12.9588 12.9588 13.9662 13.9662 k = 0.2031 0.5000-0.0000 ( 4548 PWs) bands (ev): -25.1088 -25.1088 -7.9843 -7.9843 -7.5139 -7.5139 -7.4959 -7.4959 -7.4887 -7.4887 -7.4818 -7.4818 -7.4795 -7.4795 -7.4591 -7.4591 -6.8198 -6.8198 -6.7853 -6.7853 -4.9926 -4.9926 -4.9817 -4.9817 -4.9470 -4.9470 -4.9215 -4.9215 -4.9146 -4.9146 -4.9048 -4.9048 -4.8662 -4.8662 -4.8470 -4.8470 -4.8245 -4.8245 1.2353 1.2353 2.0348 2.0348 3.6714 3.6714 8.1616 8.1616 8.6157 8.6157 9.4277 9.4277 10.1238 10.1238 10.3989 10.3989 11.5887 11.5887 12.6835 12.6835 12.9401 12.9401 13.9976 13.9976 k = 0.2188 0.5000-0.0000 ( 4540 PWs) bands (ev): -25.1088 -25.1088 -7.9846 -7.9846 -7.5141 -7.5141 -7.4954 -7.4954 -7.4890 -7.4890 -7.4818 -7.4818 -7.4790 -7.4790 -7.4590 -7.4590 -6.8209 -6.8209 -6.7853 -6.7853 -4.9916 -4.9916 -4.9816 -4.9816 -4.9479 -4.9479 -4.9207 -4.9207 -4.9142 -4.9142 -4.9041 -4.9041 -4.8647 -4.8647 -4.8479 -4.8479 -4.8274 -4.8274 1.2665 1.2665 2.0602 2.0602 3.6031 3.6031 8.0716 8.0716 8.6233 8.6233 9.4549 9.4549 10.1439 10.1439 10.3916 10.3916 11.5612 11.5612 12.6867 12.6867 12.9717 12.9717 14.0441 14.0441 k = 0.2344 0.5000-0.0000 ( 4538 PWs) bands (ev): -25.1088 -25.1088 -7.9848 -7.9848 -7.5144 -7.5144 -7.4949 -7.4949 -7.4893 -7.4893 -7.4817 -7.4817 -7.4784 -7.4784 -7.4590 -7.4590 -6.8222 -6.8222 -6.7852 -6.7852 -4.9907 -4.9907 -4.9812 -4.9812 -4.9487 -4.9487 -4.9199 -4.9199 -4.9139 -4.9139 -4.9035 -4.9035 -4.8632 -4.8632 -4.8489 -4.8489 -4.8304 -4.8304 1.2998 1.2998 2.0865 2.0865 3.5326 3.5326 7.9710 7.9710 8.6468 8.6468 9.4836 9.4836 10.1604 10.1604 10.3874 10.3874 11.5301 11.5301 12.6383 12.6383 13.0445 13.0445 14.1043 14.1043 k = 0.2500 0.5000-0.0000 ( 4542 PWs) bands (ev): -25.1087 -25.1087 -7.9851 -7.9851 -7.5148 -7.5148 -7.4945 -7.4945 -7.4896 -7.4896 -7.4816 -7.4816 -7.4777 -7.4777 -7.4591 -7.4591 -6.8235 -6.8235 -6.7850 -6.7850 -4.9900 -4.9900 -4.9806 -4.9806 -4.9493 -4.9493 -4.9190 -4.9190 -4.9137 -4.9137 -4.9031 -4.9031 -4.8617 -4.8617 -4.8501 -4.8501 -4.8333 -4.8333 1.3353 1.3353 2.1136 2.1136 3.4602 3.4602 7.8667 7.8667 8.6795 8.6795 9.5137 9.5137 10.1722 10.1722 10.3874 10.3874 11.4967 11.4967 12.5671 12.5671 13.1304 13.1304 14.1768 14.1768 k = 0.2656 0.5000-0.0000 ( 4538 PWs) bands (ev): -25.1087 -25.1087 -7.9854 -7.9854 -7.5151 -7.5151 -7.4942 -7.4942 -7.4897 -7.4897 -7.4815 -7.4815 -7.4770 -7.4770 -7.4593 -7.4593 -6.8248 -6.8248 -6.7847 -6.7847 -4.9894 -4.9894 -4.9797 -4.9797 -4.9497 -4.9497 -4.9181 -4.9181 -4.9138 -4.9138 -4.9027 -4.9027 -4.8601 -4.8601 -4.8514 -4.8514 -4.8360 -4.8360 1.3730 1.3730 2.1411 2.1411 3.3863 3.3863 7.7626 7.7626 8.7178 8.7178 9.5449 9.5449 10.1787 10.1787 10.3920 10.3920 11.4626 11.4626 12.4858 12.4858 13.2175 13.2175 14.2595 14.2595 k = 0.2812 0.5000-0.0000 ( 4538 PWs) bands (ev): -25.1087 -25.1087 -7.9856 -7.9856 -7.5155 -7.5155 -7.4940 -7.4940 -7.4896 -7.4896 -7.4813 -7.4813 -7.4763 -7.4763 -7.4595 -7.4595 -6.8262 -6.8262 -6.7844 -6.7844 -4.9890 -4.9890 -4.9787 -4.9787 -4.9499 -4.9499 -4.9171 -4.9171 -4.9139 -4.9139 -4.9025 -4.9025 -4.8585 -4.8585 -4.8531 -4.8531 -4.8384 -4.8384 1.4128 1.4128 2.1689 2.1689 3.3113 3.3113 7.6606 7.6606 8.7597 8.7597 9.5771 9.5771 10.1806 10.1806 10.3998 10.3998 11.4291 11.4291 12.3994 12.3994 13.3018 13.3018 14.3503 14.3503 k = 0.2969 0.5000-0.0000 ( 4544 PWs) bands (ev): -25.1086 -25.1086 -7.9859 -7.9859 -7.5159 -7.5159 -7.4941 -7.4941 -7.4893 -7.4893 -7.4812 -7.4812 -7.4755 -7.4755 -7.4597 -7.4597 -6.8277 -6.8277 -6.7840 -6.7840 -4.9886 -4.9886 -4.9776 -4.9776 -4.9498 -4.9498 -4.9162 -4.9162 -4.9142 -4.9142 -4.9025 -4.9025 -4.8570 -4.8570 -4.8552 -4.8552 -4.8404 -4.8404 1.4546 1.4546 2.1967 2.1967 3.2355 3.2355 7.5623 7.5623 8.8038 8.8038 9.6099 9.6099 10.1795 10.1795 10.4086 10.4086 11.3981 11.3981 12.3106 12.3106 13.3817 13.3817 14.4466 14.4466 k = 0.3125 0.5000-0.0000 ( 4540 PWs) bands (ev): -25.1086 -25.1086 -7.9862 -7.9862 -7.5162 -7.5162 -7.4943 -7.4943 -7.4888 -7.4888 -7.4810 -7.4810 -7.4748 -7.4748 -7.4600 -7.4600 -6.8291 -6.8291 -6.7837 -6.7837 -4.9883 -4.9883 -4.9765 -4.9765 -4.9493 -4.9493 -4.9154 -4.9154 -4.9145 -4.9145 -4.9026 -4.9026 -4.8578 -4.8578 -4.8555 -4.8555 -4.8419 -4.8419 1.4983 1.4983 2.2242 2.2242 3.1592 3.1592 7.4684 7.4684 8.8493 8.8493 9.6432 9.6432 10.1773 10.1773 10.4157 10.4157 11.3711 11.3711 12.2210 12.2210 13.4565 13.4565 14.4992 14.4992 k = 0.3281 0.5000-0.0000 ( 4556 PWs) bands (ev): -25.1086 -25.1086 -7.9864 -7.9864 -7.5166 -7.5166 -7.4945 -7.4945 -7.4882 -7.4882 -7.4809 -7.4809 -7.4742 -7.4742 -7.4602 -7.4602 -6.8305 -6.8305 -6.7833 -6.7833 -4.9879 -4.9879 -4.9754 -4.9754 -4.9486 -4.9486 -4.9154 -4.9154 -4.9140 -4.9140 -4.9028 -4.9028 -4.8608 -4.8608 -4.8540 -4.8540 -4.8429 -4.8429 1.5440 1.5440 2.2511 2.2511 3.0829 3.0829 7.3797 7.3797 8.8954 8.8954 9.6765 9.6765 10.1754 10.1754 10.4186 10.4186 11.3496 11.3496 12.1321 12.1321 13.5258 13.5258 14.4317 14.4317 k = 0.3438 0.5000-0.0000 ( 4552 PWs) bands (ev): -25.1085 -25.1085 -7.9867 -7.9867 -7.5170 -7.5170 -7.4949 -7.4949 -7.4874 -7.4874 -7.4808 -7.4808 -7.4736 -7.4736 -7.4605 -7.4605 -6.8319 -6.8319 -6.7829 -6.7829 -4.9876 -4.9876 -4.9745 -4.9745 -4.9475 -4.9475 -4.9160 -4.9160 -4.9131 -4.9131 -4.9031 -4.9031 -4.8640 -4.8640 -4.8527 -4.8527 -4.8436 -4.8436 1.5914 1.5914 2.2771 2.2771 3.0067 3.0067 7.2968 7.2968 8.9414 8.9414 9.7098 9.7098 10.1752 10.1752 10.4153 10.4153 11.3349 11.3349 12.0449 12.0449 13.5895 13.5895 14.3584 14.3584 k = 0.3594 0.5000-0.0000 ( 4548 PWs) bands (ev): -25.1085 -25.1085 -7.9869 -7.9869 -7.5174 -7.5174 -7.4952 -7.4952 -7.4866 -7.4866 -7.4806 -7.4806 -7.4732 -7.4732 -7.4607 -7.4607 -6.8332 -6.8332 -6.7825 -6.7825 -4.9873 -4.9873 -4.9737 -4.9737 -4.9461 -4.9461 -4.9166 -4.9166 -4.9122 -4.9122 -4.9035 -4.9035 -4.8675 -4.8675 -4.8515 -4.8515 -4.8440 -4.8440 1.6404 1.6404 2.3019 2.3019 2.9311 2.9311 7.2201 7.2201 8.9865 8.9865 9.7428 9.7428 10.1776 10.1776 10.4046 10.4046 11.3275 11.3275 11.9605 11.9605 13.6476 13.6476 14.2829 14.2829 k = 0.3750 0.5000-0.0000 ( 4550 PWs) bands (ev): -25.1085 -25.1085 -7.9871 -7.9871 -7.5177 -7.5177 -7.4955 -7.4955 -7.4857 -7.4857 -7.4805 -7.4805 -7.4729 -7.4729 -7.4609 -7.4609 -6.8344 -6.8344 -6.7821 -6.7821 -4.9870 -4.9870 -4.9731 -4.9731 -4.9443 -4.9443 -4.9173 -4.9173 -4.9115 -4.9115 -4.9038 -4.9038 -4.8710 -4.8710 -4.8504 -4.8504 -4.8442 -4.8442 1.6909 1.6909 2.3251 2.3251 2.8564 2.8564 7.1501 7.1501 9.0300 9.0300 9.7755 9.7755 10.1829 10.1829 10.3861 10.3861 11.3271 11.3271 11.8800 11.8800 13.6999 13.6999 14.2079 14.2079 k = 0.3906 0.5000-0.0000 ( 4564 PWs) bands (ev): -25.1085 -25.1085 -7.9873 -7.9873 -7.5181 -7.5181 -7.4958 -7.4958 -7.4848 -7.4848 -7.4804 -7.4804 -7.4728 -7.4728 -7.4610 -7.4610 -6.8355 -6.8355 -6.7818 -6.7818 -4.9867 -4.9867 -4.9726 -4.9726 -4.9422 -4.9422 -4.9180 -4.9180 -4.9113 -4.9113 -4.9039 -4.9039 -4.8745 -4.8745 -4.8494 -4.8494 -4.8442 -4.8442 1.7424 1.7424 2.3466 2.3466 2.7831 2.7831 7.0873 7.0873 9.0711 9.0711 9.8079 9.8079 10.1912 10.1912 10.3602 10.3602 11.3328 11.3328 11.8046 11.8046 13.7464 13.7464 14.1356 14.1356 k = 0.4062 0.5000-0.0000 ( 4552 PWs) bands (ev): -25.1085 -25.1085 -7.9875 -7.9875 -7.5183 -7.5183 -7.4960 -7.4960 -7.4838 -7.4838 -7.4803 -7.4803 -7.4729 -7.4729 -7.4611 -7.4611 -6.8365 -6.8365 -6.7814 -6.7814 -4.9864 -4.9864 -4.9722 -4.9722 -4.9398 -4.9398 -4.9186 -4.9186 -4.9115 -4.9115 -4.9035 -4.9035 -4.8779 -4.8779 -4.8486 -4.8486 -4.8441 -4.8441 1.7947 1.7947 2.3659 2.3659 2.7118 2.7118 7.0320 7.0320 9.1090 9.1090 9.8405 9.8405 10.2022 10.2022 10.3279 10.3279 11.3428 11.3428 11.7355 11.7355 13.7869 13.7869 14.0681 14.0681 k = 0.4219 0.5000-0.0000 ( 4544 PWs) bands (ev): -25.1084 -25.1084 -7.9876 -7.9876 -7.5186 -7.5186 -7.4962 -7.4962 -7.4829 -7.4829 -7.4803 -7.4803 -7.4731 -7.4731 -7.4611 -7.4611 -6.8374 -6.8374 -6.7812 -6.7812 -4.9862 -4.9862 -4.9720 -4.9720 -4.9373 -4.9373 -4.9192 -4.9192 -4.9124 -4.9124 -4.9028 -4.9028 -4.8813 -4.8813 -4.8480 -4.8480 -4.8439 -4.8439 1.8469 1.8469 2.3827 2.3827 2.6432 2.6432 6.9846 6.9846 9.1427 9.1427 9.8737 9.8737 10.2149 10.2149 10.2905 10.2905 11.3553 11.3553 11.6740 11.6740 13.8215 13.8215 14.0073 14.0073 k = 0.4375 0.5000-0.0000 ( 4552 PWs) bands (ev): -25.1084 -25.1084 -7.9877 -7.9877 -7.5188 -7.5188 -7.4964 -7.4964 -7.4821 -7.4821 -7.4802 -7.4802 -7.4735 -7.4735 -7.4610 -7.4610 -6.8382 -6.8382 -6.7809 -6.7809 -4.9859 -4.9859 -4.9718 -4.9718 -4.9346 -4.9346 -4.9198 -4.9198 -4.9137 -4.9137 -4.9017 -4.9017 -4.8844 -4.8844 -4.8475 -4.8475 -4.8437 -4.8437 1.8981 1.8981 2.3969 2.3969 2.5787 2.5787 6.9453 6.9453 9.1715 9.1715 9.9079 9.9079 10.2272 10.2272 10.2504 10.2504 11.3681 11.3681 11.6216 11.6216 13.8500 13.8500 13.9548 13.9548 k = 0.4531 0.5000-0.0000 ( 4552 PWs) bands (ev): -25.1084 -25.1084 -7.9878 -7.9878 -7.5190 -7.5190 -7.4966 -7.4966 -7.4813 -7.4813 -7.4801 -7.4801 -7.4739 -7.4739 -7.4610 -7.4610 -6.8387 -6.8387 -6.7807 -6.7807 -4.9857 -4.9857 -4.9717 -4.9717 -4.9318 -4.9318 -4.9202 -4.9202 -4.9155 -4.9155 -4.9003 -4.9003 -4.8873 -4.8873 -4.8471 -4.8471 -4.8435 -4.8435 1.9462 1.9462 2.4081 2.4081 2.5201 2.5201 6.9145 6.9145 9.1947 9.1947 9.9438 9.9438 10.2044 10.2044 10.2425 10.2425 11.3792 11.3792 11.5799 11.5799 13.8722 13.8722 13.9123 13.9123 k = 0.4688 0.5000-0.0000 ( 4552 PWs) bands (ev): -25.1084 -25.1084 -7.9879 -7.9879 -7.5191 -7.5191 -7.4967 -7.4967 -7.4806 -7.4806 -7.4801 -7.4801 -7.4743 -7.4743 -7.4609 -7.4609 -6.8392 -6.8392 -6.7806 -6.7806 -4.9856 -4.9856 -4.9716 -4.9716 -4.9290 -4.9290 -4.9206 -4.9206 -4.9174 -4.9174 -4.8986 -4.8986 -4.8901 -4.8901 -4.8469 -4.8469 -4.8433 -4.8433 1.9879 1.9879 2.4159 2.4159 2.4711 2.4711 6.8923 6.8923 9.2116 9.2116 9.9812 9.9812 10.1608 10.1608 10.2524 10.2524 11.3872 11.3872 11.5502 11.5502 13.8805 13.8805 13.8885 13.8885 k = 0.4844 0.5000-0.0000 ( 4544 PWs) bands (ev): -25.1084 -25.1084 -7.9879 -7.9879 -7.5192 -7.5192 -7.4967 -7.4967 -7.4802 -7.4802 -7.4799 -7.4799 -7.4746 -7.4746 -7.4609 -7.4609 -6.8394 -6.8394 -6.7805 -6.7805 -4.9855 -4.9855 -4.9715 -4.9715 -4.9265 -4.9265 -4.9211 -4.9211 -4.9193 -4.9193 -4.8968 -4.8968 -4.8925 -4.8925 -4.8468 -4.8468 -4.8431 -4.8431 2.0178 2.0178 2.4192 2.4192 2.4384 2.4384 6.8789 6.8789 9.2220 9.2220 10.0190 10.0190 10.1187 10.1187 10.2592 10.2592 11.3916 11.3916 11.5327 11.5327 13.8615 13.8615 13.8979 13.8979 k = 0.5000 0.5000-0.0000 ( 4540 PWs) bands (ev): -25.1084 -25.1084 -7.9880 -7.9880 -7.5192 -7.5192 -7.4968 -7.4968 -7.4802 -7.4802 -7.4798 -7.4798 -7.4748 -7.4748 -7.4608 -7.4608 -6.8395 -6.8395 -6.7805 -6.7805 -4.9855 -4.9855 -4.9715 -4.9715 -4.9250 -4.9250 -4.9217 -4.9217 -4.9201 -4.9201 -4.8950 -4.8950 -4.8945 -4.8945 -4.8468 -4.8468 -4.8431 -4.8431 2.0290 2.0290 2.4168 2.4168 2.4298 2.4298 6.8745 6.8745 9.2255 9.2255 10.0439 10.0439 10.0923 10.0923 10.2616 10.2616 11.3929 11.3929 11.5270 11.5270 13.8550 13.8550 13.9011 13.9011 k = 0.5000 0.5000-0.0000 ( 4540 PWs) bands (ev): -25.1084 -25.1084 -7.9880 -7.9880 -7.5192 -7.5192 -7.4968 -7.4968 -7.4802 -7.4802 -7.4798 -7.4798 -7.4748 -7.4748 -7.4608 -7.4608 -6.8395 -6.8395 -6.7805 -6.7805 -4.9855 -4.9855 -4.9715 -4.9715 -4.9250 -4.9250 -4.9217 -4.9217 -4.9201 -4.9201 -4.8950 -4.8950 -4.8945 -4.8945 -4.8468 -4.8468 -4.8431 -4.8431 2.0290 2.0290 2.4168 2.4168 2.4298 2.4298 6.8745 6.8745 9.2255 9.2255 10.0439 10.0439 10.0923 10.0923 10.2616 10.2616 11.3929 11.3929 11.5270 11.5270 13.8550 13.8550 13.9011 13.9011 k = 0.4889 0.4889-0.0000 ( 4540 PWs) bands (ev): -25.1084 -25.1084 -7.9879 -7.9879 -7.5192 -7.5192 -7.4967 -7.4967 -7.4802 -7.4802 -7.4799 -7.4799 -7.4746 -7.4746 -7.4609 -7.4609 -6.8394 -6.8394 -6.7805 -6.7805 -4.9855 -4.9855 -4.9715 -4.9715 -4.9265 -4.9265 -4.9211 -4.9211 -4.9193 -4.9193 -4.8968 -4.8968 -4.8925 -4.8925 -4.8468 -4.8468 -4.8431 -4.8431 2.0176 2.0176 2.4211 2.4211 2.4367 2.4367 6.8790 6.8790 9.2219 9.2219 10.0188 10.0188 10.1189 10.1189 10.2592 10.2592 11.3916 11.3916 11.5327 11.5327 13.8616 13.8616 13.8979 13.8979 k = 0.4778 0.4778-0.0000 ( 4556 PWs) bands (ev): -25.1084 -25.1084 -7.9879 -7.9879 -7.5191 -7.5191 -7.4967 -7.4967 -7.4805 -7.4805 -7.4802 -7.4802 -7.4743 -7.4743 -7.4609 -7.4609 -6.8392 -6.8392 -6.7806 -6.7806 -4.9856 -4.9856 -4.9716 -4.9716 -4.9290 -4.9290 -4.9209 -4.9209 -4.9172 -4.9172 -4.8985 -4.8985 -4.8901 -4.8901 -4.8470 -4.8470 -4.8432 -4.8432 1.9865 1.9865 2.4270 2.4270 2.4616 2.4616 6.8925 6.8925 9.2114 9.2114 9.9809 9.9809 10.1616 10.1616 10.2521 10.2521 11.3881 11.3881 11.5497 11.5497 13.8803 13.8803 13.8883 13.8883 k = 0.4667 0.4667-0.0000 ( 4548 PWs) bands (ev): -25.1084 -25.1084 -7.9878 -7.9878 -7.5190 -7.5190 -7.4966 -7.4966 -7.4811 -7.4811 -7.4804 -7.4804 -7.4738 -7.4738 -7.4610 -7.4610 -6.8387 -6.8387 -6.7807 -6.7807 -4.9857 -4.9857 -4.9717 -4.9717 -4.9317 -4.9317 -4.9210 -4.9210 -4.9150 -4.9150 -4.8999 -4.8999 -4.8876 -4.8876 -4.8473 -4.8473 -4.8433 -4.8433 1.9413 1.9413 2.4336 2.4336 2.4995 2.4995 6.9148 6.9148 9.1937 9.1937 9.9438 9.9438 10.2065 10.2065 10.2410 10.2410 11.3827 11.3827 11.5776 11.5776 13.8703 13.8703 13.9115 13.9115 k = 0.4556 0.4556-0.0000 ( 4552 PWs) bands (ev): -25.1084 -25.1084 -7.9877 -7.9877 -7.5188 -7.5188 -7.4965 -7.4965 -7.4818 -7.4818 -7.4806 -7.4806 -7.4732 -7.4732 -7.4611 -7.4611 -6.8381 -6.8381 -6.7809 -6.7809 -4.9859 -4.9859 -4.9717 -4.9717 -4.9345 -4.9345 -4.9213 -4.9213 -4.9129 -4.9129 -4.9006 -4.9006 -4.8849 -4.8849 -4.8479 -4.8479 -4.8432 -4.8432 1.8870 1.8870 2.4423 2.4423 2.5444 2.5444 6.9457 6.9457 9.1691 9.1691 9.9089 9.9089 10.2260 10.2260 10.2528 10.2528 11.3762 11.3762 11.6162 11.6162 13.8449 13.8449 13.9509 13.9509 k = 0.4444 0.4444-0.0000 ( 4544 PWs) bands (ev): -25.1084 -25.1084 -7.9876 -7.9876 -7.5186 -7.5186 -7.4963 -7.4963 -7.4826 -7.4826 -7.4809 -7.4809 -7.4726 -7.4726 -7.4612 -7.4612 -6.8374 -6.8374 -6.7812 -6.7812 -4.9862 -4.9862 -4.9719 -4.9719 -4.9372 -4.9372 -4.9219 -4.9219 -4.9112 -4.9112 -4.9007 -4.9007 -4.8822 -4.8822 -4.8488 -4.8488 -4.8430 -4.8430 1.8268 1.8268 2.4533 2.4533 2.5931 2.5931 6.9848 6.9848 9.1377 9.1377 9.8763 9.8763 10.2101 10.2101 10.2985 10.2985 11.3693 11.3693 11.6648 11.6648 13.8101 13.8101 13.9963 13.9963 k = 0.4333 0.4333-0.0000 ( 4560 PWs) bands (ev): -25.1085 -25.1085 -7.9874 -7.9874 -7.5183 -7.5183 -7.4962 -7.4962 -7.4834 -7.4834 -7.4812 -7.4812 -7.4719 -7.4719 -7.4614 -7.4614 -6.8366 -6.8366 -6.7815 -6.7815 -4.9865 -4.9865 -4.9720 -4.9720 -4.9400 -4.9400 -4.9227 -4.9227 -4.9099 -4.9099 -4.9000 -4.9000 -4.8794 -4.8794 -4.8499 -4.8499 -4.8424 -4.8424 1.7627 1.7627 2.4666 2.4666 2.6438 2.6438 7.0318 7.0318 9.1001 9.1001 9.8451 9.8451 10.1939 10.1939 10.3445 10.3445 11.3630 11.3630 11.7228 11.7228 13.7646 13.7646 14.0442 14.0442 k = 0.4222 0.4222-0.0000 ( 4564 PWs) bands (ev): -25.1085 -25.1085 -7.9872 -7.9872 -7.5180 -7.5180 -7.4961 -7.4961 -7.4842 -7.4842 -7.4815 -7.4815 -7.4713 -7.4713 -7.4616 -7.4616 -6.8356 -6.8356 -6.7819 -6.7819 -4.9868 -4.9868 -4.9722 -4.9722 -4.9427 -4.9427 -4.9238 -4.9238 -4.9090 -4.9090 -4.8986 -4.8986 -4.8767 -4.8767 -4.8512 -4.8512 -4.8417 -4.8417 1.6957 1.6957 2.4823 2.4823 2.6954 2.6954 7.0859 7.0859 9.0571 9.0571 9.8141 9.8141 10.1796 10.1796 10.3904 10.3904 11.3580 11.3580 11.7894 11.7894 13.7073 13.7073 14.0903 14.0903 k = 0.4111 0.4111-0.0000 ( 4554 PWs) bands (ev): -25.1085 -25.1085 -7.9869 -7.9869 -7.5177 -7.5177 -7.4960 -7.4960 -7.4850 -7.4850 -7.4818 -7.4818 -7.4707 -7.4707 -7.4618 -7.4618 -6.8345 -6.8345 -6.7823 -6.7823 -4.9872 -4.9872 -4.9724 -4.9724 -4.9453 -4.9453 -4.9252 -4.9252 -4.9084 -4.9084 -4.8967 -4.8967 -4.8741 -4.8741 -4.8526 -4.8526 -4.8407 -4.8407 1.6267 1.6267 2.5004 2.5004 2.7475 2.7475 7.1467 7.1467 9.0095 9.0095 9.7820 9.7820 10.1693 10.1693 10.4362 10.4362 11.3551 11.3551 11.8638 11.8638 13.6370 13.6370 14.1310 14.1310 k = 0.4000 0.4000-0.0000 ( 4556 PWs) bands (ev): -25.1085 -25.1085 -7.9866 -7.9866 -7.5173 -7.5173 -7.4961 -7.4961 -7.4857 -7.4857 -7.4821 -7.4821 -7.4701 -7.4701 -7.4621 -7.4621 -6.8333 -6.8333 -6.7827 -6.7827 -4.9876 -4.9876 -4.9727 -4.9727 -4.9478 -4.9478 -4.9268 -4.9268 -4.9081 -4.9081 -4.8945 -4.8945 -4.8719 -4.8719 -4.8537 -4.8537 -4.8395 -4.8395 1.5562 1.5562 2.5209 2.5209 2.7997 2.7997 7.2134 7.2134 8.9586 8.9586 9.7478 9.7478 10.1644 10.1644 10.4819 10.4819 11.3550 11.3550 11.9452 11.9452 13.5536 13.5536 14.1630 14.1630 k = 0.3889 0.3889-0.0000 ( 4544 PWs) bands (ev): -25.1086 -25.1086 -7.9863 -7.9863 -7.5169 -7.5169 -7.4962 -7.4962 -7.4863 -7.4863 -7.4823 -7.4823 -7.4695 -7.4695 -7.4624 -7.4624 -6.8321 -6.8321 -6.7833 -6.7833 -4.9880 -4.9880 -4.9731 -4.9731 -4.9503 -4.9503 -4.9284 -4.9284 -4.9079 -4.9079 -4.8921 -4.8921 -4.8705 -4.8705 -4.8542 -4.8542 -4.8380 -4.8380 1.4848 1.4848 2.5437 2.5437 2.8518 2.8518 7.2852 7.2852 8.9052 8.9052 9.7111 9.7111 10.1660 10.1660 10.5273 10.5273 11.3583 11.3583 12.0328 12.0328 13.4572 13.4572 14.1846 14.1846 k = 0.3778 0.3778-0.0000 ( 4544 PWs) bands (ev): -25.1086 -25.1086 -7.9858 -7.9858 -7.5164 -7.5164 -7.4965 -7.4965 -7.4868 -7.4868 -7.4825 -7.4825 -7.4690 -7.4690 -7.4626 -7.4626 -6.8308 -6.8308 -6.7838 -6.7838 -4.9885 -4.9885 -4.9735 -4.9735 -4.9527 -4.9527 -4.9302 -4.9302 -4.9079 -4.9079 -4.8895 -4.8895 -4.8701 -4.8701 -4.8537 -4.8537 -4.8363 -4.8363 1.4128 1.4128 2.5689 2.5689 2.9037 2.9037 7.3611 7.3611 8.8505 8.8505 9.6724 9.6724 10.1740 10.1740 10.5720 10.5720 11.3656 11.3656 12.1259 12.1259 13.3492 13.3492 14.1955 14.1955 k = 0.3667 0.3667-0.0000 ( 4552 PWs) bands (ev): -25.1086 -25.1086 -7.9854 -7.9854 -7.5159 -7.5159 -7.4969 -7.4969 -7.4873 -7.4873 -7.4826 -7.4826 -7.4685 -7.4685 -7.4628 -7.4628 -6.8294 -6.8294 -6.7845 -6.7845 -4.9889 -4.9889 -4.9741 -4.9741 -4.9550 -4.9550 -4.9319 -4.9319 -4.9082 -4.9082 -4.8868 -4.8868 -4.8710 -4.8710 -4.8521 -4.8521 -4.8344 -4.8344 1.3405 1.3405 2.5965 2.5965 2.9554 2.9554 7.4401 7.4401 8.7955 8.7955 9.6325 9.6325 10.1880 10.1880 10.6156 10.6156 11.3779 11.3779 12.2239 12.2239 13.2313 13.2313 14.1964 14.1964 k = 0.3556 0.3556-0.0000 ( 4552 PWs) bands (ev): -25.1087 -25.1087 -7.9848 -7.9848 -7.5154 -7.5154 -7.4974 -7.4974 -7.4877 -7.4877 -7.4825 -7.4825 -7.4682 -7.4682 -7.4630 -7.4630 -6.8281 -6.8281 -6.7851 -6.7851 -4.9894 -4.9894 -4.9747 -4.9747 -4.9572 -4.9572 -4.9336 -4.9336 -4.9088 -4.9088 -4.8841 -4.8841 -4.8728 -4.8728 -4.8497 -4.8497 -4.8323 -4.8323 1.2681 1.2681 2.6264 2.6264 3.0067 3.0067 7.5209 7.5209 8.7413 8.7413 9.5929 9.5929 10.2071 10.2071 10.6573 10.6573 11.3958 11.3958 12.3259 12.3259 13.1061 13.1061 14.1890 14.1890 k = 0.3444 0.3444-0.0000 ( 4548 PWs) bands (ev): -25.1087 -25.1087 -7.9842 -7.9842 -7.5148 -7.5148 -7.4980 -7.4980 -7.4881 -7.4881 -7.4824 -7.4824 -7.4678 -7.4678 -7.4630 -7.4630 -6.8267 -6.8267 -6.7858 -6.7858 -4.9899 -4.9899 -4.9756 -4.9756 -4.9593 -4.9593 -4.9352 -4.9352 -4.9095 -4.9095 -4.8816 -4.8816 -4.8747 -4.8747 -4.8469 -4.8469 -4.8299 -4.8299 1.1960 1.1960 2.6585 2.6585 3.0577 3.0577 7.6020 7.6020 8.6887 8.6887 9.5550 9.5550 10.2304 10.2304 10.6963 10.6963 11.4204 11.4204 12.4316 12.4316 12.9761 12.9761 14.1749 14.1749 k = 0.3333 0.3333-0.0000 ( 4548 PWs) bands (ev): -25.1087 -25.1087 -7.9835 -7.9835 -7.5142 -7.5142 -7.4986 -7.4986 -7.4886 -7.4886 -7.4821 -7.4821 -7.4677 -7.4677 -7.4630 -7.4630 -6.8254 -6.8254 -6.7866 -6.7866 -4.9903 -4.9903 -4.9766 -4.9766 -4.9613 -4.9613 -4.9367 -4.9367 -4.9105 -4.9105 -4.8807 -4.8807 -4.8753 -4.8753 -4.8438 -4.8438 -4.8274 -4.8274 1.1244 1.1244 2.6930 2.6930 3.1082 3.1082 7.6815 7.6815 8.6389 8.6389 9.5207 9.5207 10.2564 10.2564 10.7316 10.7316 11.4526 11.4526 12.5400 12.5400 12.8443 12.8443 14.1554 14.1554 k = 0.3222 0.3222-0.0000 ( 4550 PWs) bands (ev): -25.1088 -25.1088 -7.9828 -7.9828 -7.5136 -7.5136 -7.4993 -7.4993 -7.4891 -7.4891 -7.4817 -7.4817 -7.4676 -7.4676 -7.4628 -7.4628 -6.8241 -6.8241 -6.7874 -6.7874 -4.9908 -4.9908 -4.9778 -4.9778 -4.9633 -4.9633 -4.9381 -4.9381 -4.9117 -4.9117 -4.8827 -4.8827 -4.8731 -4.8731 -4.8405 -4.8405 -4.8247 -4.8247 1.0534 1.0534 2.7297 2.7297 3.1582 3.1582 7.7574 7.7574 8.5930 8.5930 9.4916 9.4916 10.2836 10.2836 10.7628 10.7628 11.4931 11.4931 12.6494 12.6494 12.7152 12.7152 14.1319 14.1319 k = 0.3111 0.3111-0.0000 ( 4548 PWs) bands (ev): -25.1088 -25.1088 -7.9819 -7.9819 -7.5130 -7.5130 -7.4999 -7.4999 -7.4897 -7.4897 -7.4812 -7.4812 -7.4676 -7.4676 -7.4625 -7.4625 -6.8229 -6.8229 -6.7883 -6.7883 -4.9914 -4.9914 -4.9791 -4.9791 -4.9652 -4.9652 -4.9394 -4.9394 -4.9131 -4.9131 -4.8857 -4.8857 -4.8701 -4.8701 -4.8372 -4.8372 -4.8219 -4.8219 0.9833 0.9833 2.7686 2.7686 3.2076 3.2076 7.8270 7.8270 8.5521 8.5521 9.4698 9.4698 10.3100 10.3100 10.7894 10.7894 11.5426 11.5426 12.5847 12.5847 12.7658 12.7658 14.1055 14.1055 k = 0.3000 0.3000-0.0000 ( 4544 PWs) bands (ev): -25.1089 -25.1089 -7.9810 -7.9810 -7.5124 -7.5124 -7.5005 -7.5005 -7.4904 -7.4904 -7.4806 -7.4806 -7.4676 -7.4676 -7.4621 -7.4621 -6.8217 -6.8217 -6.7892 -6.7892 -4.9919 -4.9919 -4.9806 -4.9806 -4.9672 -4.9672 -4.9405 -4.9405 -4.9146 -4.9146 -4.8889 -4.8889 -4.8669 -4.8669 -4.8339 -4.8339 -4.8189 -4.8189 0.9143 0.9143 2.8096 2.8096 3.2563 3.2563 7.8876 7.8876 8.5174 8.5174 9.4571 9.4571 10.3330 10.3330 10.8123 10.8123 11.6012 11.6012 12.4648 12.4648 12.8800 12.8800 14.0771 14.0771 k = 0.2889 0.2889-0.0000 ( 4542 PWs) bands (ev): -25.1089 -25.1089 -7.9800 -7.9800 -7.5117 -7.5117 -7.5010 -7.5010 -7.4911 -7.4911 -7.4799 -7.4799 -7.4676 -7.4676 -7.4616 -7.4616 -6.8206 -6.8206 -6.7901 -6.7901 -4.9925 -4.9925 -4.9822 -4.9822 -4.9691 -4.9691 -4.9414 -4.9414 -4.9163 -4.9163 -4.8922 -4.8922 -4.8637 -4.8637 -4.8306 -4.8306 -4.8158 -4.8158 0.8465 0.8465 2.8527 2.8527 3.3041 3.3041 7.9365 7.9365 8.4899 8.4899 9.4556 9.4556 10.3493 10.3493 10.8332 10.8332 11.6687 11.6687 12.3543 12.3543 12.9954 12.9954 14.0472 14.0472 k = 0.2778 0.2778-0.0000 ( 4540 PWs) bands (ev): -25.1090 -25.1090 -7.9789 -7.9789 -7.5112 -7.5112 -7.5014 -7.5014 -7.4920 -7.4920 -7.4792 -7.4792 -7.4676 -7.4676 -7.4611 -7.4611 -6.8196 -6.8196 -6.7911 -6.7911 -4.9932 -4.9932 -4.9839 -4.9839 -4.9712 -4.9712 -4.9421 -4.9421 -4.9180 -4.9180 -4.8956 -4.8956 -4.8604 -4.8604 -4.8272 -4.8272 -4.8127 -4.8127 0.7801 0.7801 2.8979 2.8979 3.3509 3.3509 7.9717 7.9717 8.4697 8.4697 9.4669 9.4669 10.3548 10.3548 10.8549 10.8549 11.7444 11.7444 12.2562 12.2562 13.1113 13.1113 14.0168 14.0168 k = 0.2667 0.2667-0.0000 ( 4548 PWs) bands (ev): -25.1090 -25.1090 -7.9778 -7.9778 -7.5107 -7.5107 -7.5016 -7.5016 -7.4929 -7.4929 -7.4785 -7.4785 -7.4676 -7.4676 -7.4606 -7.4606 -6.8187 -6.8187 -6.7922 -6.7922 -4.9939 -4.9939 -4.9856 -4.9856 -4.9733 -4.9733 -4.9427 -4.9427 -4.9198 -4.9198 -4.8989 -4.8989 -4.8572 -4.8572 -4.8238 -4.8238 -4.8096 -4.8096 0.7153 0.7153 2.9449 2.9449 3.3967 3.3967 7.9930 7.9930 8.4557 8.4557 9.4920 9.4920 10.3461 10.3461 10.8807 10.8807 11.8271 11.8271 12.1736 12.1736 13.2267 13.2267 13.9863 13.9863 k = 0.2556 0.2556-0.0000 ( 4560 PWs) bands (ev): -25.1091 -25.1091 -7.9765 -7.9765 -7.5103 -7.5103 -7.5017 -7.5017 -7.4939 -7.4939 -7.4777 -7.4777 -7.4675 -7.4675 -7.4600 -7.4600 -6.8178 -6.8178 -6.7932 -6.7932 -4.9947 -4.9947 -4.9874 -4.9874 -4.9755 -4.9755 -4.9431 -4.9431 -4.9216 -4.9216 -4.9022 -4.9022 -4.8541 -4.8541 -4.8204 -4.8204 -4.8064 -4.8064 0.6521 0.6521 2.9939 2.9939 3.4412 3.4412 8.0021 8.0021 8.4456 8.4456 9.5304 9.5304 10.3212 10.3212 10.9134 10.9134 11.9133 11.9133 12.1103 12.1103 13.3407 13.3407 13.9567 13.9567 k = 0.2444 0.2444-0.0000 ( 4564 PWs) bands (ev): -25.1091 -25.1091 -7.9752 -7.9752 -7.5101 -7.5101 -7.5015 -7.5015 -7.4950 -7.4950 -7.4770 -7.4770 -7.4674 -7.4674 -7.4594 -7.4594 -6.8171 -6.8171 -6.7944 -6.7944 -4.9957 -4.9957 -4.9891 -4.9891 -4.9777 -4.9777 -4.9433 -4.9433 -4.9235 -4.9235 -4.9054 -4.9054 -4.8512 -4.8512 -4.8170 -4.8170 -4.8032 -4.8032 0.5908 0.5908 3.0445 3.0445 3.4842 3.4842 8.0022 8.0022 8.4368 8.4368 9.5796 9.5796 10.2817 10.2817 10.9541 10.9541 11.9838 11.9838 12.0853 12.0853 13.4514 13.4514 13.9294 13.9294 k = 0.2333 0.2333-0.0000 ( 4571 PWs) bands (ev): -25.1092 -25.1092 -7.9739 -7.9739 -7.5100 -7.5100 -7.5010 -7.5010 -7.4961 -7.4961 -7.4762 -7.4762 -7.4672 -7.4672 -7.4588 -7.4588 -6.8164 -6.8164 -6.7955 -6.7955 -4.9967 -4.9967 -4.9908 -4.9908 -4.9801 -4.9801 -4.9435 -4.9435 -4.9253 -4.9253 -4.9085 -4.9085 -4.8483 -4.8483 -4.8135 -4.8135 -4.8001 -4.8001 0.5314 0.5314 3.0968 3.0968 3.5257 3.5257 7.9965 7.9965 8.4270 8.4270 9.6342 9.6342 10.2337 10.2337 11.0027 11.0027 11.9880 11.9880 12.1480 12.1480 13.5552 13.5552 13.9076 13.9076 k = 0.2222 0.2222-0.0000 ( 4567 PWs) bands (ev): -25.1092 -25.1092 -7.9724 -7.9724 -7.5101 -7.5101 -7.5004 -7.5004 -7.4973 -7.4973 -7.4754 -7.4754 -7.4669 -7.4669 -7.4582 -7.4582 -6.8158 -6.8158 -6.7967 -6.7967 -4.9980 -4.9980 -4.9924 -4.9924 -4.9825 -4.9825 -4.9435 -4.9435 -4.9271 -4.9271 -4.9115 -4.9115 -4.8456 -4.8456 -4.8101 -4.8101 -4.7970 -4.7970 0.4741 0.4741 3.1505 3.1505 3.5655 3.5655 7.9877 7.9877 8.4151 8.4151 9.6828 9.6828 10.1897 10.1897 11.0581 11.0581 11.9730 11.9730 12.2491 12.2491 13.6430 13.6430 13.8993 13.8993 k = 0.2111 0.2111-0.0000 ( 4567 PWs) bands (ev): -25.1093 -25.1093 -7.9710 -7.9710 -7.5103 -7.5103 -7.4996 -7.4996 -7.4985 -7.4985 -7.4745 -7.4745 -7.4666 -7.4666 -7.4576 -7.4576 -6.8153 -6.8153 -6.7979 -6.7979 -4.9994 -4.9994 -4.9939 -4.9939 -4.9849 -4.9849 -4.9435 -4.9435 -4.9288 -4.9288 -4.9143 -4.9143 -4.8431 -4.8431 -4.8066 -4.8066 -4.7940 -4.7940 0.4190 0.4190 3.2054 3.2054 3.6035 3.6035 7.9780 7.9780 8.4009 8.4009 9.7057 9.7057 10.1709 10.1709 11.1192 11.1192 11.9661 11.9661 12.3593 12.3593 13.6962 13.6962 13.9213 13.9213 k = 0.2000 0.2000-0.0000 ( 4571 PWs) bands (ev): -25.1094 -25.1094 -7.9695 -7.9695 -7.5106 -7.5106 -7.4998 -7.4998 -7.4986 -7.4986 -7.4737 -7.4737 -7.4662 -7.4662 -7.4569 -7.4569 -6.8149 -6.8149 -6.7991 -6.7991 -5.0010 -5.0010 -4.9954 -4.9954 -4.9874 -4.9874 -4.9434 -4.9434 -4.9305 -4.9305 -4.9170 -4.9170 -4.8408 -4.8408 -4.8030 -4.8030 -4.7911 -4.7911 0.3661 0.3661 3.2615 3.2615 3.6395 3.6395 7.9686 7.9686 8.3845 8.3845 9.6843 9.6843 10.1976 10.1976 11.1848 11.1848 11.9695 11.9695 12.4736 12.4736 13.7058 13.7058 13.9780 13.9780 k = 0.1889 0.1889-0.0000 ( 4567 PWs) bands (ev): -25.1094 -25.1094 -7.9679 -7.9679 -7.5109 -7.5109 -7.5011 -7.5011 -7.4976 -7.4976 -7.4728 -7.4728 -7.4657 -7.4657 -7.4563 -7.4563 -6.8145 -6.8145 -6.8004 -6.8004 -5.0027 -5.0027 -4.9967 -4.9967 -4.9898 -4.9898 -4.9433 -4.9433 -4.9321 -4.9321 -4.9195 -4.9195 -4.8387 -4.8387 -4.7995 -4.7995 -4.7882 -4.7882 0.3156 0.3156 3.3185 3.3185 3.6735 3.6735 7.9604 7.9604 8.3664 8.3664 9.6215 9.6215 10.2681 10.2681 11.2541 11.2541 11.9826 11.9826 12.5902 12.5902 13.6902 13.6902 14.0387 14.0387 k = 0.1778 0.1778-0.0000 ( 4559 PWs) bands (ev): -25.1095 -25.1095 -7.9663 -7.9663 -7.5113 -7.5113 -7.5024 -7.5024 -7.4966 -7.4966 -7.4720 -7.4720 -7.4653 -7.4653 -7.4557 -7.4557 -6.8142 -6.8142 -6.8016 -6.8016 -5.0044 -5.0044 -4.9980 -4.9980 -4.9922 -4.9922 -4.9431 -4.9431 -4.9336 -4.9336 -4.9219 -4.9219 -4.8367 -4.8367 -4.7960 -4.7960 -4.7855 -4.7855 0.2676 0.2676 3.3760 3.3760 3.7053 3.7053 7.9539 7.9539 8.3471 8.3471 9.5344 9.5344 10.3669 10.3669 11.3262 11.3262 12.0047 12.0047 12.7074 12.7074 13.6637 13.6637 14.0595 14.0595 k = 0.1667 0.1667-0.0000 ( 4563 PWs) bands (ev): -25.1095 -25.1095 -7.9648 -7.9648 -7.5117 -7.5117 -7.5036 -7.5036 -7.4955 -7.4955 -7.4711 -7.4711 -7.4648 -7.4648 -7.4551 -7.4551 -6.8140 -6.8140 -6.8029 -6.8029 -5.0062 -5.0062 -4.9993 -4.9993 -4.9946 -4.9946 -4.9429 -4.9429 -4.9349 -4.9349 -4.9241 -4.9241 -4.8349 -4.8349 -4.7926 -4.7926 -4.7829 -4.7829 0.2220 0.2220 3.4339 3.4339 3.7349 3.7349 7.9492 7.9492 8.3268 8.3268 9.4358 9.4358 10.4824 10.4824 11.4005 11.4005 12.0349 12.0349 12.8237 12.8237 13.6313 13.6313 14.0318 14.0318 k = 0.1556 0.1556-0.0000 ( 4563 PWs) bands (ev): -25.1096 -25.1096 -7.9632 -7.9632 -7.5121 -7.5121 -7.5048 -7.5048 -7.4945 -7.4945 -7.4702 -7.4702 -7.4642 -7.4642 -7.4545 -7.4545 -6.8139 -6.8139 -6.8041 -6.8041 -5.0080 -5.0080 -5.0006 -5.0006 -4.9970 -4.9970 -4.9427 -4.9427 -4.9362 -4.9362 -4.9261 -4.9261 -4.8333 -4.8333 -4.7892 -4.7892 -4.7805 -4.7805 0.1791 0.1791 3.4917 3.4917 3.7622 3.7622 7.9463 7.9463 8.3059 8.3059 9.3331 9.3331 10.6082 10.6082 11.4763 11.4763 12.0727 12.0727 12.9372 12.9372 13.5944 13.5944 13.9825 13.9825 k = 0.1444 0.1444-0.0000 ( 4563 PWs) bands (ev): -25.1096 -25.1096 -7.9617 -7.9617 -7.5126 -7.5126 -7.5060 -7.5060 -7.4935 -7.4935 -7.4693 -7.4693 -7.4637 -7.4637 -7.4539 -7.4539 -6.8137 -6.8137 -6.8054 -6.8054 -5.0098 -5.0098 -5.0019 -5.0019 -4.9992 -4.9992 -4.9425 -4.9425 -4.9373 -4.9373 -4.9280 -4.9280 -4.8319 -4.8319 -4.7860 -4.7860 -4.7781 -4.7781 0.1389 0.1389 3.5492 3.5492 3.7874 3.7874 7.9450 7.9450 8.2842 8.2842 9.2307 9.2307 10.7412 10.7412 11.5530 11.5530 12.1177 12.1177 13.0460 13.0460 13.5530 13.5530 13.9214 13.9214 k = 0.1333 0.1333-0.0000 ( 4567 PWs) bands (ev): -25.1096 -25.1096 -7.9602 -7.9602 -7.5131 -7.5131 -7.5071 -7.5071 -7.4925 -7.4925 -7.4684 -7.4684 -7.4631 -7.4631 -7.4534 -7.4534 -6.8137 -6.8137 -6.8066 -6.8066 -5.0116 -5.0116 -5.0032 -5.0032 -5.0013 -5.0013 -4.9424 -4.9424 -4.9383 -4.9383 -4.9297 -4.9297 -4.8306 -4.8306 -4.7829 -4.7829 -4.7759 -4.7759 0.1014 0.1014 3.6058 3.6058 3.8102 3.8102 7.9451 7.9451 8.2618 8.2618 9.1319 9.1319 10.8793 10.8793 11.6300 11.6300 12.1695 12.1695 13.1468 13.1468 13.5082 13.5082 13.8579 13.8579 k = 0.1222 0.1222-0.0000 ( 4567 PWs) bands (ev): -25.1097 -25.1097 -7.9587 -7.9587 -7.5136 -7.5136 -7.5081 -7.5081 -7.4916 -7.4916 -7.4676 -7.4676 -7.4625 -7.4625 -7.4528 -7.4528 -6.8137 -6.8137 -6.8077 -6.8077 -5.0133 -5.0133 -5.0045 -5.0045 -5.0033 -5.0033 -4.9422 -4.9422 -4.9392 -4.9392 -4.9312 -4.9312 -4.8295 -4.8295 -4.7799 -4.7799 -4.7739 -4.7739 0.0666 0.0666 3.6612 3.6612 3.8309 3.8309 7.9461 7.9461 8.2384 8.2384 9.0390 9.0390 11.0210 11.0210 11.7067 11.7067 12.2279 12.2279 13.2331 13.2331 13.4648 13.4648 13.8000 13.8000 k = 0.1111 0.1111-0.0000 ( 4567 PWs) bands (ev): -25.1097 -25.1097 -7.9574 -7.9574 -7.5141 -7.5141 -7.5090 -7.5090 -7.4908 -7.4908 -7.4668 -7.4668 -7.4619 -7.4619 -7.4522 -7.4522 -6.8137 -6.8137 -6.8088 -6.8088 -5.0149 -5.0149 -5.0059 -5.0059 -5.0050 -5.0050 -4.9422 -4.9422 -4.9400 -4.9400 -4.9326 -4.9326 -4.8285 -4.8285 -4.7770 -4.7770 -4.7720 -4.7720 0.0348 0.0348 3.7148 3.7148 3.8494 3.8494 7.9478 7.9478 8.2135 8.2135 8.9542 8.9542 11.1653 11.1653 11.7825 11.7825 12.2929 12.2929 13.2830 13.2830 13.4440 13.4440 13.7505 13.7505 k = 0.1000 0.1000-0.0000 ( 4559 PWs) bands (ev): -25.1098 -25.1098 -7.9561 -7.9561 -7.5146 -7.5146 -7.5098 -7.5098 -7.4901 -7.4901 -7.4660 -7.4660 -7.4613 -7.4613 -7.4517 -7.4517 -6.8138 -6.8138 -6.8098 -6.8098 -5.0164 -5.0164 -5.0075 -5.0075 -5.0063 -5.0063 -4.9422 -4.9422 -4.9405 -4.9405 -4.9338 -4.9338 -4.8276 -4.8276 -4.7744 -4.7744 -4.7703 -4.7703 0.0058 0.0058 3.7661 3.7661 3.8658 3.8658 7.9498 7.9498 8.1868 8.1868 8.8790 8.8790 11.3112 11.3112 11.8569 11.8569 12.3644 12.3644 13.2680 13.2680 13.4749 13.4749 13.7092 13.7092 k = 0.0889 0.0889-0.0000 ( 4557 PWs) bands (ev): -25.1098 -25.1098 -7.9549 -7.9549 -7.5152 -7.5152 -7.5104 -7.5104 -7.4895 -7.4895 -7.4654 -7.4654 -7.4607 -7.4607 -7.4512 -7.4512 -6.8139 -6.8139 -6.8108 -6.8108 -5.0178 -5.0178 -5.0090 -5.0090 -5.0074 -5.0074 -4.9425 -4.9425 -4.9408 -4.9408 -4.9348 -4.9348 -4.8268 -4.8268 -4.7720 -4.7720 -4.7687 -4.7687 -0.0203 -0.0203 3.8144 3.8144 3.8802 3.8802 7.9518 7.9518 8.1582 8.1582 8.8146 8.8146 11.4575 11.4575 11.9291 11.9291 12.4420 12.4420 13.2189 13.2189 13.5257 13.5257 13.6741 13.6741 k = 0.0778 0.0778-0.0000 ( 4553 PWs) bands (ev): -25.1098 -25.1098 -7.9538 -7.9538 -7.5157 -7.5157 -7.5110 -7.5110 -7.4889 -7.4889 -7.4648 -7.4648 -7.4602 -7.4602 -7.4507 -7.4507 -6.8141 -6.8141 -6.8115 -6.8115 -5.0191 -5.0191 -5.0105 -5.0105 -5.0084 -5.0084 -4.9428 -4.9428 -4.9410 -4.9410 -4.9356 -4.9356 -4.8262 -4.8262 -4.7699 -4.7699 -4.7674 -4.7674 -0.0433 -0.0433 3.8591 3.8591 3.8926 3.8926 7.9534 7.9534 8.1280 8.1280 8.7616 8.7616 11.6028 11.6028 11.9987 11.9987 12.5258 12.5258 13.1629 13.1629 13.5609 13.5609 13.6432 13.6432 k = 0.0667 0.0667-0.0000 ( 4555 PWs) bands (ev): -25.1098 -25.1098 -7.9528 -7.9528 -7.5163 -7.5163 -7.5114 -7.5114 -7.4884 -7.4884 -7.4643 -7.4643 -7.4596 -7.4596 -7.4502 -7.4502 -6.8144 -6.8144 -6.8121 -6.8121 -5.0203 -5.0203 -5.0117 -5.0117 -5.0093 -5.0093 -4.9432 -4.9432 -4.9411 -4.9411 -4.9362 -4.9362 -4.8256 -4.8256 -4.7679 -4.7679 -4.7662 -4.7662 -0.0634 -0.0634 3.8995 3.8995 3.9034 3.9034 7.9546 7.9546 8.0972 8.0972 8.7195 8.7195 11.7454 11.7454 12.0647 12.0647 12.6154 12.6154 13.1080 13.1080 13.5431 13.5431 13.6173 13.6173 k = 0.0556 0.0556-0.0000 ( 4555 PWs) bands (ev): -25.1099 -25.1099 -7.9519 -7.9519 -7.5168 -7.5168 -7.5118 -7.5118 -7.4880 -7.4880 -7.4638 -7.4638 -7.4591 -7.4591 -7.4498 -7.4498 -6.8147 -6.8147 -6.8125 -6.8125 -5.0213 -5.0213 -5.0128 -5.0128 -5.0100 -5.0100 -4.9436 -4.9436 -4.9411 -4.9411 -4.9368 -4.9368 -4.8252 -4.8252 -4.7663 -4.7663 -4.7651 -4.7651 -0.0804 -0.0804 3.9120 3.9120 3.9354 3.9354 7.9552 7.9552 8.0673 8.0673 8.6875 8.6875 11.8826 11.8826 12.1261 12.1261 12.7107 12.7107 13.0577 13.0577 13.4821 13.4821 13.5916 13.5916 k = 0.0444 0.0444-0.0000 ( 4565 PWs) bands (ev): -25.1099 -25.1099 -7.9512 -7.9512 -7.5172 -7.5172 -7.5120 -7.5120 -7.4877 -7.4877 -7.4635 -7.4635 -7.4587 -7.4587 -7.4494 -7.4494 -6.8151 -6.8151 -6.8128 -6.8128 -5.0221 -5.0221 -5.0137 -5.0137 -5.0106 -5.0106 -4.9440 -4.9440 -4.9411 -4.9411 -4.9371 -4.9371 -4.8248 -4.8248 -4.7650 -4.7650 -4.7643 -4.7643 -0.0944 -0.0944 3.9190 3.9190 3.9656 3.9656 7.9549 7.9549 8.0403 8.0403 8.6642 8.6642 12.0107 12.0107 12.1815 12.1815 12.8113 12.8113 13.0138 13.0138 13.4149 13.4149 13.5616 13.5616 k = 0.0333 0.0333-0.0000 ( 4549 PWs) bands (ev): -25.1099 -25.1099 -7.9507 -7.9507 -7.5175 -7.5175 -7.5122 -7.5122 -7.4875 -7.4875 -7.4632 -7.4632 -7.4584 -7.4584 -7.4491 -7.4491 -6.8154 -6.8154 -6.8130 -6.8130 -5.0228 -5.0228 -5.0144 -5.0144 -5.0111 -5.0111 -4.9443 -4.9443 -4.9412 -4.9412 -4.9374 -4.9374 -4.8245 -4.8245 -4.7639 -4.7639 -4.7636 -4.7636 -0.1053 -0.1053 3.9245 3.9245 3.9898 3.9898 7.9537 7.9537 8.0181 8.0181 8.6480 8.6480 12.1244 12.1244 12.2289 12.2289 12.9165 12.9165 12.9780 12.9780 13.3534 13.3534 13.5229 13.5229 k = 0.0222 0.0222-0.0000 ( 4553 PWs) bands (ev): -25.1099 -25.1099 -7.9503 -7.9503 -7.5178 -7.5178 -7.5124 -7.5124 -7.4873 -7.4873 -7.4631 -7.4631 -7.4582 -7.4582 -7.4489 -7.4489 -6.8157 -6.8157 -6.8131 -6.8131 -5.0233 -5.0233 -5.0149 -5.0149 -5.0115 -5.0115 -4.9445 -4.9445 -4.9412 -4.9412 -4.9376 -4.9376 -4.8243 -4.8243 -4.7633 -4.7633 -4.7630 -4.7630 -0.1130 -0.1130 3.9283 3.9283 4.0074 4.0074 7.9514 7.9514 8.0023 8.0023 8.6374 8.6374 12.2163 12.2163 12.2659 12.2659 12.9496 12.9496 13.0267 13.0267 13.3027 13.3027 13.4683 13.4683 k = 0.0111 0.0111-0.0000 ( 4557 PWs) bands (ev): -25.1099 -25.1099 -7.9500 -7.9500 -7.5180 -7.5180 -7.5125 -7.5125 -7.4872 -7.4872 -7.4630 -7.4630 -7.4580 -7.4580 -7.4488 -7.4488 -6.8159 -6.8159 -6.8131 -6.8131 -5.0236 -5.0236 -5.0152 -5.0152 -5.0117 -5.0117 -4.9446 -4.9446 -4.9412 -4.9412 -4.9377 -4.9377 -4.8242 -4.8242 -4.7630 -4.7630 -4.7626 -4.7626 -0.1177 -0.1177 3.9306 3.9306 4.0182 4.0182 7.9490 7.9490 7.9935 7.9935 8.6316 8.6316 12.2772 12.2772 12.2898 12.2898 12.9329 12.9329 13.1340 13.1340 13.2663 13.2663 13.3962 13.3962 k = 0.0000 0.0000 0.0000 ( 4545 PWs) bands (ev): -25.1099 -25.1099 -7.9500 -7.9500 -7.5180 -7.5180 -7.5125 -7.5125 -7.4872 -7.4872 -7.4629 -7.4629 -7.4580 -7.4580 -7.4487 -7.4487 -6.8159 -6.8159 -6.8131 -6.8131 -5.0237 -5.0237 -5.0153 -5.0153 -5.0118 -5.0118 -4.9447 -4.9447 -4.9413 -4.9413 -4.9377 -4.9377 -4.8241 -4.8241 -4.7629 -4.7629 -4.7624 -4.7624 -0.1193 -0.1193 3.9314 3.9314 4.0218 4.0218 7.9479 7.9479 7.9907 7.9907 8.6297 8.6297 12.2966 12.2966 12.3002 12.3002 12.9271 12.9271 13.2081 13.2081 13.2403 13.2403 13.3463 13.3463 k = 0.0000 0.0000 0.0000 ( 4545 PWs) bands (ev): -25.1099 -25.1099 -7.9500 -7.9500 -7.5180 -7.5180 -7.5125 -7.5125 -7.4872 -7.4872 -7.4629 -7.4629 -7.4580 -7.4580 -7.4487 -7.4487 -6.8159 -6.8159 -6.8131 -6.8131 -5.0237 -5.0237 -5.0153 -5.0153 -5.0118 -5.0118 -4.9447 -4.9447 -4.9413 -4.9413 -4.9377 -4.9377 -4.8241 -4.8241 -4.7629 -4.7629 -4.7624 -4.7624 -0.1193 -0.1193 3.9314 3.9314 4.0218 4.0218 7.9479 7.9479 7.9907 7.9907 8.6297 8.6297 12.2966 12.2966 12.3002 12.3002 12.9271 12.9271 13.2081 13.2081 13.2403 13.2403 13.3463 13.3463 k = 0.0000 0.0000 0.0154 ( 4545 PWs) bands (ev): -25.1099 -25.1099 -7.9500 -7.9500 -7.5180 -7.5180 -7.5124 -7.5124 -7.4872 -7.4872 -7.4630 -7.4630 -7.4580 -7.4580 -7.4488 -7.4488 -6.8160 -6.8160 -6.8131 -6.8131 -5.0236 -5.0236 -5.0152 -5.0152 -5.0117 -5.0117 -4.9447 -4.9447 -4.9412 -4.9412 -4.9377 -4.9377 -4.8242 -4.8242 -4.7630 -4.7630 -4.7625 -4.7625 -0.1178 -0.1178 3.9266 3.9266 4.0222 4.0222 7.9515 7.9515 7.9912 7.9912 8.6314 8.6314 12.2769 12.2769 12.2901 12.2901 12.9325 12.9325 13.1229 13.1229 13.3281 13.3281 13.3465 13.3465 k = 0.0000 0.0000 0.0309 ( 4553 PWs) bands (ev): -25.1099 -25.1099 -7.9503 -7.9503 -7.5180 -7.5180 -7.5123 -7.5123 -7.4873 -7.4873 -7.4631 -7.4631 -7.4581 -7.4581 -7.4489 -7.4489 -6.8160 -6.8160 -6.8128 -6.8128 -5.0235 -5.0235 -5.0150 -5.0150 -5.0113 -5.0113 -4.9446 -4.9446 -4.9411 -4.9411 -4.9375 -4.9375 -4.8243 -4.8243 -4.7635 -4.7635 -4.7627 -4.7627 -0.1133 -0.1133 3.9125 3.9125 4.0235 4.0235 7.9622 7.9622 7.9928 7.9928 8.6365 8.6365 12.2216 12.2216 12.2609 12.2609 12.9482 12.9482 13.0241 13.0241 13.3470 13.3470 13.4356 13.4356 k = 0.0000 0.0000 0.0463 ( 4537 PWs) bands (ev): -25.1099 -25.1099 -7.9506 -7.9506 -7.5179 -7.5179 -7.5119 -7.5119 -7.4875 -7.4875 -7.4634 -7.4634 -7.4582 -7.4582 -7.4490 -7.4490 -6.8160 -6.8160 -6.8125 -6.8125 -5.0233 -5.0233 -5.0146 -5.0146 -5.0107 -5.0107 -4.9446 -4.9446 -4.9409 -4.9409 -4.9373 -4.9373 -4.8245 -4.8245 -4.7643 -4.7643 -4.7631 -4.7631 -0.1058 -0.1058 3.8893 3.8893 4.0257 4.0257 7.9799 7.9799 7.9953 7.9953 8.6449 8.6449 12.1396 12.1396 12.2154 12.2154 12.9252 12.9252 12.9737 12.9737 13.3474 13.3474 13.5507 13.5507 k = 0.0000 0.0000 0.0618 ( 4537 PWs) bands (ev): -25.1099 -25.1099 -7.9511 -7.9511 -7.5178 -7.5178 -7.5115 -7.5115 -7.4878 -7.4878 -7.4638 -7.4638 -7.4584 -7.4584 -7.4492 -7.4492 -6.8160 -6.8160 -6.8120 -6.8120 -5.0230 -5.0230 -5.0140 -5.0140 -5.0098 -5.0098 -4.9446 -4.9446 -4.9406 -4.9406 -4.9370 -4.9370 -4.8248 -4.8248 -4.7655 -4.7655 -4.7637 -4.7637 -0.0953 -0.0953 3.8572 3.8572 4.0287 4.0287 7.9988 7.9988 8.0041 8.0041 8.6568 8.6568 12.0398 12.0398 12.1571 12.1571 12.8270 12.8270 13.0081 13.0081 13.3472 13.3472 13.6724 13.6724 k = 0.0000 0.0000 0.0772 ( 4549 PWs) bands (ev): -25.1099 -25.1099 -7.9518 -7.9518 -7.5178 -7.5178 -7.5110 -7.5110 -7.4881 -7.4881 -7.4642 -7.4642 -7.4586 -7.4586 -7.4494 -7.4494 -6.8161 -6.8161 -6.8113 -6.8113 -5.0227 -5.0227 -5.0133 -5.0133 -5.0087 -5.0087 -4.9445 -4.9445 -4.9402 -4.9402 -4.9365 -4.9365 -4.8252 -4.8252 -4.7669 -4.7669 -4.7644 -4.7644 -0.0819 -0.0819 3.8169 3.8169 4.0325 4.0325 8.0033 8.0033 8.0345 8.0345 8.6721 8.6721 11.9292 11.9292 12.0892 12.0892 12.7304 12.7304 13.0506 13.0506 13.3456 13.3456 13.7710 13.7710 k = 0.0000 0.0000 0.0926 ( 4549 PWs) bands (ev): -25.1099 -25.1099 -7.9526 -7.9526 -7.5177 -7.5177 -7.5103 -7.5103 -7.4885 -7.4885 -7.4648 -7.4648 -7.4589 -7.4589 -7.4497 -7.4497 -6.8161 -6.8161 -6.8106 -6.8106 -5.0223 -5.0223 -5.0124 -5.0124 -5.0073 -5.0073 -4.9444 -4.9444 -4.9397 -4.9397 -4.9360 -4.9360 -4.8257 -4.8257 -4.7687 -4.7687 -4.7652 -4.7652 -0.0655 -0.0655 3.7688 3.7688 4.0371 4.0371 8.0086 8.0086 8.0703 8.0703 8.6909 8.6909 11.8125 11.8125 12.0146 12.0146 12.6359 12.6359 13.1003 13.1003 13.3418 13.3418 13.7668 13.7668 k = 0.0000 0.0000 0.1081 ( 4553 PWs) bands (ev): -25.1098 -25.1098 -7.9535 -7.9535 -7.5175 -7.5175 -7.5095 -7.5095 -7.4890 -7.4890 -7.4655 -7.4655 -7.4592 -7.4592 -7.4501 -7.4501 -6.8162 -6.8162 -6.8097 -6.8097 -5.0218 -5.0218 -5.0114 -5.0114 -5.0057 -5.0057 -4.9443 -4.9443 -4.9391 -4.9391 -4.9354 -4.9354 -4.8263 -4.8263 -4.7707 -4.7707 -4.7662 -4.7662 -0.0462 -0.0462 3.7135 3.7135 4.0425 4.0425 8.0148 8.0148 8.1111 8.1111 8.7131 8.7131 11.6931 11.6931 11.9353 11.9353 12.5440 12.5440 13.1547 13.1547 13.3359 13.3359 13.7492 13.7492 k = 0.0000 0.0000 0.1235 ( 4553 PWs) bands (ev): -25.1098 -25.1098 -7.9545 -7.9545 -7.5174 -7.5174 -7.5087 -7.5087 -7.4896 -7.4896 -7.4664 -7.4664 -7.4595 -7.4595 -7.4504 -7.4504 -6.8162 -6.8162 -6.8087 -6.8087 -5.0213 -5.0213 -5.0103 -5.0103 -5.0039 -5.0039 -4.9443 -4.9443 -4.9385 -4.9385 -4.9347 -4.9347 -4.8269 -4.8269 -4.7731 -4.7731 -4.7673 -4.7673 -0.0240 -0.0240 3.6518 3.6518 4.0486 4.0486 8.0217 8.0217 8.1561 8.1561 8.7389 8.7389 11.5729 11.5729 11.8529 11.8529 12.4551 12.4551 13.2067 13.2067 13.3322 13.3322 13.7361 13.7361 k = 0.0000 0.0000 0.1390 ( 4545 PWs) bands (ev): -25.1098 -25.1098 -7.9557 -7.9557 -7.5173 -7.5173 -7.5077 -7.5077 -7.4902 -7.4902 -7.4673 -7.4673 -7.4598 -7.4598 -7.4508 -7.4508 -6.8163 -6.8163 -6.8076 -6.8076 -5.0207 -5.0207 -5.0091 -5.0091 -5.0018 -5.0018 -4.9442 -4.9442 -4.9378 -4.9378 -4.9339 -4.9339 -4.8276 -4.8276 -4.7757 -4.7757 -4.7686 -4.7686 0.0011 0.0011 3.5843 3.5843 4.0554 4.0554 8.0294 8.0294 8.2047 8.2047 8.7682 8.7682 11.4535 11.4535 11.7687 11.7687 12.3694 12.3694 13.2323 13.2323 13.3514 13.3514 13.7310 13.7310 k = 0.0000 0.0000 0.1544 ( 4545 PWs) bands (ev): -25.1098 -25.1098 -7.9569 -7.9569 -7.5171 -7.5171 -7.5066 -7.5066 -7.4909 -7.4909 -7.4683 -7.4683 -7.4602 -7.4602 -7.4512 -7.4512 -6.8163 -6.8163 -6.8064 -6.8064 -5.0201 -5.0201 -5.0077 -5.0077 -4.9995 -4.9995 -4.9440 -4.9440 -4.9370 -4.9370 -4.9330 -4.9330 -4.8284 -4.8284 -4.7787 -4.7787 -4.7700 -4.7700 0.0290 0.0290 3.5117 3.5117 4.0628 4.0628 8.0376 8.0376 8.2562 8.2562 8.8011 8.8011 11.3359 11.3359 11.6835 11.6835 12.2870 12.2870 13.2162 13.2162 13.4054 13.4054 13.7375 13.7375 k = 0.0000 0.0000 0.1699 ( 4549 PWs) bands (ev): -25.1097 -25.1097 -7.9582 -7.9582 -7.5170 -7.5170 -7.5054 -7.5054 -7.4916 -7.4916 -7.4695 -7.4695 -7.4606 -7.4606 -7.4516 -7.4516 -6.8164 -6.8164 -6.8051 -6.8051 -5.0195 -5.0195 -5.0063 -5.0063 -4.9969 -4.9969 -4.9439 -4.9439 -4.9361 -4.9361 -4.9321 -4.9321 -4.8293 -4.8293 -4.7818 -4.7818 -4.7715 -4.7715 0.0597 0.0597 3.4347 3.4347 4.0708 4.0708 8.0463 8.0463 8.3099 8.3099 8.8376 8.8376 11.2209 11.2209 11.5979 11.5979 12.2081 12.2081 13.1775 13.1775 13.4705 13.4705 13.7603 13.7603 k = 0.0000 0.0000 0.1853 ( 4565 PWs) bands (ev): -25.1097 -25.1097 -7.9596 -7.9596 -7.5169 -7.5169 -7.5042 -7.5042 -7.4923 -7.4923 -7.4707 -7.4707 -7.4609 -7.4609 -7.4520 -7.4520 -6.8165 -6.8165 -6.8038 -6.8038 -5.0189 -5.0189 -5.0048 -5.0048 -4.9942 -4.9942 -4.9438 -4.9438 -4.9352 -4.9352 -4.9310 -4.9310 -4.8303 -4.8303 -4.7852 -4.7852 -4.7731 -4.7731 0.0931 0.0931 3.3538 3.3538 4.0793 4.0793 8.0554 8.0554 8.3653 8.3653 8.8778 8.8778 11.1091 11.1091 11.5125 11.5125 12.1327 12.1327 13.1265 13.1265 13.5303 13.5303 13.7967 13.7967 k = 0.0000 0.0000 0.2007 ( 4573 PWs) bands (ev): -25.1097 -25.1097 -7.9610 -7.9610 -7.5167 -7.5167 -7.5028 -7.5028 -7.4931 -7.4931 -7.4720 -7.4720 -7.4613 -7.4613 -7.4525 -7.4525 -6.8165 -6.8165 -6.8024 -6.8024 -5.0182 -5.0182 -5.0033 -5.0033 -4.9912 -4.9912 -4.9436 -4.9436 -4.9342 -4.9342 -4.9299 -4.9299 -4.8313 -4.8313 -4.7889 -4.7889 -4.7749 -4.7749 0.1292 0.1292 3.2698 3.2698 4.0882 4.0882 8.0649 8.0649 8.4218 8.4218 8.9215 8.9215 11.0010 11.0010 11.4276 11.4276 12.0609 12.0609 13.0670 13.0670 13.5767 13.5767 13.8014 13.8014 k = 0.0000 0.0000 0.2162 ( 4565 PWs) bands (ev): -25.1096 -25.1096 -7.9625 -7.9625 -7.5166 -7.5166 -7.5014 -7.5014 -7.4939 -7.4939 -7.4733 -7.4733 -7.4617 -7.4617 -7.4530 -7.4530 -6.8166 -6.8166 -6.8009 -6.8009 -5.0176 -5.0176 -5.0017 -5.0017 -4.9880 -4.9880 -4.9434 -4.9434 -4.9331 -4.9331 -4.9287 -4.9287 -4.8325 -4.8325 -4.7927 -4.7927 -4.7767 -4.7767 0.1679 0.1679 3.1831 3.1831 4.0975 4.0975 8.0745 8.0745 8.4790 8.4790 8.9686 8.9686 10.8970 10.8970 11.3434 11.3434 11.9929 11.9929 13.0013 13.0013 13.6095 13.6095 13.8063 13.8063 k = 0.0000 0.0000 0.2316 ( 4565 PWs) bands (ev): -25.1096 -25.1096 -7.9640 -7.9640 -7.5165 -7.5165 -7.5000 -7.5000 -7.4947 -7.4947 -7.4747 -7.4747 -7.4620 -7.4620 -7.4535 -7.4535 -6.8166 -6.8166 -6.7995 -6.7995 -5.0169 -5.0169 -5.0000 -5.0000 -4.9846 -4.9846 -4.9431 -4.9431 -4.9321 -4.9321 -4.9274 -4.9274 -4.8337 -4.8337 -4.7967 -4.7967 -4.7785 -4.7785 0.2091 0.2091 3.0943 3.0943 4.1070 4.1070 8.0842 8.0842 8.5363 8.5363 9.0192 9.0192 10.7974 10.7974 11.2602 11.2602 11.9285 11.9285 12.9308 12.9308 13.6320 13.6320 13.8113 13.8113 k = 0.0000 0.0000 0.2471 ( 4565 PWs) bands (ev): -25.1096 -25.1096 -7.9655 -7.9655 -7.5165 -7.5165 -7.4985 -7.4985 -7.4955 -7.4955 -7.4762 -7.4762 -7.4624 -7.4624 -7.4541 -7.4541 -6.8167 -6.8167 -6.7980 -6.7980 -5.0163 -5.0163 -4.9984 -4.9984 -4.9810 -4.9810 -4.9429 -4.9429 -4.9309 -4.9309 -4.9261 -4.9261 -4.8350 -4.8350 -4.8009 -4.8009 -4.7805 -4.7805 0.2528 0.2528 3.0039 3.0039 4.1167 4.1167 8.0938 8.0938 8.5936 8.5936 9.0729 9.0729 10.7024 10.7024 11.1781 11.1781 11.8679 11.8679 12.8569 12.8569 13.6463 13.6463 13.8163 13.8163 k = 0.0000 0.0000 0.2625 ( 4561 PWs) bands (ev): -25.1095 -25.1095 -7.9670 -7.9670 -7.5164 -7.5164 -7.4970 -7.4970 -7.4962 -7.4962 -7.4776 -7.4776 -7.4627 -7.4627 -7.4547 -7.4547 -6.8167 -6.8167 -6.7966 -6.7966 -5.0157 -5.0157 -4.9968 -4.9968 -4.9772 -4.9772 -4.9426 -4.9426 -4.9298 -4.9298 -4.9247 -4.9247 -4.8364 -4.8364 -4.8052 -4.8052 -4.7825 -4.7825 0.2988 0.2988 2.9125 2.9125 4.1266 4.1266 8.1033 8.1033 8.6504 8.6504 9.1296 9.1296 10.6124 10.6124 11.0972 11.0972 11.8112 11.8112 12.7805 12.7805 13.6526 13.6526 13.8214 13.8214 k = 0.0000 0.0000 0.2779 ( 4561 PWs) bands (ev): -25.1095 -25.1095 -7.9685 -7.9685 -7.5165 -7.5165 -7.4969 -7.4969 -7.4954 -7.4954 -7.4790 -7.4790 -7.4630 -7.4630 -7.4553 -7.4553 -6.8167 -6.8167 -6.7951 -6.7951 -5.0151 -5.0151 -4.9952 -4.9952 -4.9732 -4.9732 -4.9422 -4.9422 -4.9286 -4.9286 -4.9233 -4.9233 -4.8379 -4.8379 -4.8096 -4.8096 -4.7845 -4.7845 0.3470 0.3470 2.8204 2.8204 4.1364 4.1364 8.1125 8.1125 8.7065 8.7065 9.1888 9.1888 10.5275 10.5275 11.0177 11.0177 11.7582 11.7582 12.7027 12.7027 13.6499 13.6499 13.8265 13.8265 k = 0.0000 0.0000 0.2934 ( 4561 PWs) bands (ev): -25.1094 -25.1094 -7.9699 -7.9699 -7.5165 -7.5165 -7.4976 -7.4976 -7.4938 -7.4938 -7.4803 -7.4803 -7.4633 -7.4633 -7.4560 -7.4560 -6.8168 -6.8168 -6.7937 -6.7937 -5.0145 -5.0145 -4.9937 -4.9937 -4.9691 -4.9691 -4.9419 -4.9419 -4.9275 -4.9275 -4.9218 -4.9218 -4.8395 -4.8395 -4.8139 -4.8139 -4.7865 -4.7865 0.3973 0.3973 2.7281 2.7281 4.1462 4.1462 8.1213 8.1213 8.7619 8.7619 9.2503 9.2503 10.4479 10.4479 10.9395 10.9395 11.7090 11.7090 12.6241 12.6241 13.6372 13.6372 13.8314 13.8314 k = 0.0000 0.0000 0.3088 ( 4573 PWs) bands (ev): -25.1094 -25.1094 -7.9713 -7.9713 -7.5166 -7.5166 -7.4982 -7.4982 -7.4923 -7.4923 -7.4816 -7.4816 -7.4636 -7.4636 -7.4567 -7.4567 -6.8168 -6.8168 -6.7924 -6.7924 -5.0140 -5.0140 -4.9923 -4.9923 -4.9648 -4.9648 -4.9415 -4.9415 -4.9263 -4.9263 -4.9204 -4.9204 -4.8414 -4.8414 -4.8183 -4.8183 -4.7886 -4.7886 0.4494 0.4494 2.6362 2.6362 4.1557 4.1557 8.1297 8.1297 8.8162 8.8162 9.3135 9.3135 10.3738 10.3738 10.8628 10.8628 11.6636 11.6636 12.5457 12.5457 13.6145 13.6145 13.8363 13.8363 k = 0.0000 0.0000 0.3243 ( 4565 PWs) bands (ev): -25.1094 -25.1094 -7.9727 -7.9727 -7.5167 -7.5167 -7.4988 -7.4988 -7.4909 -7.4909 -7.4826 -7.4826 -7.4638 -7.4638 -7.4575 -7.4575 -6.8168 -6.8168 -6.7911 -6.7911 -5.0134 -5.0134 -4.9909 -4.9909 -4.9605 -4.9605 -4.9411 -4.9411 -4.9251 -4.9251 -4.9189 -4.9189 -4.8435 -4.8435 -4.8224 -4.8224 -4.7905 -4.7905 0.5032 0.5032 2.5450 2.5450 4.1650 4.1650 8.1376 8.1376 8.8693 8.8693 9.3781 9.3781 10.3054 10.3054 10.7876 10.7876 11.6220 11.6220 12.4682 12.4682 13.5833 13.5833 13.8410 13.8410 k = 0.0000 0.0000 0.3397 ( 4557 PWs) bands (ev): -25.1093 -25.1093 -7.9739 -7.9739 -7.5169 -7.5169 -7.4993 -7.4993 -7.4898 -7.4898 -7.4833 -7.4833 -7.4641 -7.4641 -7.4583 -7.4583 -6.8168 -6.8168 -6.7898 -6.7898 -5.0130 -5.0130 -4.9897 -4.9897 -4.9560 -4.9560 -4.9406 -4.9406 -4.9240 -4.9240 -4.9175 -4.9175 -4.8459 -4.8459 -4.8263 -4.8263 -4.7925 -4.7925 0.5583 0.5583 2.4550 2.4550 4.1738 4.1738 8.1449 8.1449 8.9209 8.9209 9.4435 9.4435 10.2426 10.2426 10.7140 10.7140 11.5842 11.5842 12.3925 12.3925 13.5461 13.5461 13.8455 13.8455 k = 0.0000 0.0000 0.3552 ( 4548 PWs) bands (ev): -25.1093 -25.1093 -7.9751 -7.9751 -7.5171 -7.5171 -7.4997 -7.4997 -7.4892 -7.4892 -7.4835 -7.4835 -7.4643 -7.4643 -7.4592 -7.4592 -6.8168 -6.8168 -6.7887 -6.7887 -5.0126 -5.0126 -4.9885 -4.9885 -4.9514 -4.9514 -4.9402 -4.9402 -4.9229 -4.9229 -4.9161 -4.9161 -4.8487 -4.8487 -4.8299 -4.8299 -4.7944 -4.7944 0.6145 0.6145 2.3669 2.3669 4.1822 4.1822 8.1515 8.1515 8.9707 8.9707 9.5093 9.5093 10.1857 10.1857 10.6419 10.6419 11.5501 11.5501 12.3193 12.3193 13.5059 13.5059 13.8497 13.8497 k = 0.0000 0.0000 0.3706 ( 4556 PWs) bands (ev): -25.1093 -25.1093 -7.9762 -7.9762 -7.5173 -7.5173 -7.5001 -7.5001 -7.4892 -7.4892 -7.4828 -7.4828 -7.4645 -7.4645 -7.4602 -7.4602 -6.8168 -6.8168 -6.7876 -6.7876 -5.0122 -5.0122 -4.9875 -4.9875 -4.9467 -4.9467 -4.9398 -4.9398 -4.9218 -4.9218 -4.9147 -4.9147 -4.8520 -4.8520 -4.8329 -4.8329 -4.7961 -4.7961 0.6711 0.6711 2.2812 2.2812 4.1900 4.1900 8.1574 8.1574 9.0183 9.0183 9.5751 9.5751 10.1347 10.1347 10.5715 10.5715 11.5198 11.5198 12.2497 12.2497 13.4652 13.4652 13.8536 13.8536 k = 0.0000 0.0000 0.3860 ( 4548 PWs) bands (ev): -25.1093 -25.1093 -7.9772 -7.9772 -7.5175 -7.5175 -7.5003 -7.5003 -7.4897 -7.4897 -7.4817 -7.4817 -7.4646 -7.4646 -7.4612 -7.4612 -6.8168 -6.8168 -6.7867 -6.7867 -5.0118 -5.0118 -4.9865 -4.9865 -4.9421 -4.9421 -4.9393 -4.9393 -4.9208 -4.9208 -4.9135 -4.9135 -4.8557 -4.8557 -4.8354 -4.8354 -4.7978 -4.7978 0.7276 0.7276 2.1988 2.1988 4.1972 4.1972 8.1626 8.1626 9.0632 9.0632 9.6403 9.6403 10.0896 10.0896 10.5029 10.5029 11.4931 11.4931 12.1845 12.1845 13.4260 13.4260 13.8571 13.8571 k = 0.0000 0.0000 0.4015 ( 4544 PWs) bands (ev): -25.1092 -25.1092 -7.9781 -7.9781 -7.5177 -7.5177 -7.5006 -7.5006 -7.4903 -7.4903 -7.4803 -7.4803 -7.4648 -7.4648 -7.4623 -7.4623 -6.8168 -6.8168 -6.7858 -6.7858 -5.0115 -5.0115 -4.9857 -4.9857 -4.9390 -4.9390 -4.9375 -4.9375 -4.9199 -4.9199 -4.9123 -4.9123 -4.8597 -4.8597 -4.8374 -4.8374 -4.7993 -4.7993 0.7831 0.7831 2.1207 2.1207 4.2035 4.2035 8.1670 8.1670 9.1048 9.1048 9.7047 9.7047 10.0506 10.0506 10.4360 10.4360 11.4701 11.4701 12.1248 12.1248 13.3900 13.3900 13.8602 13.8602 k = 0.0000 0.0000 0.4169 ( 4544 PWs) bands (ev): -25.1092 -25.1092 -7.9788 -7.9788 -7.5180 -7.5180 -7.5008 -7.5008 -7.4910 -7.4910 -7.4788 -7.4788 -7.4649 -7.4649 -7.4634 -7.4634 -6.8168 -6.8168 -6.7851 -6.7851 -5.0113 -5.0113 -4.9850 -4.9850 -4.9386 -4.9386 -4.9330 -4.9330 -4.9191 -4.9191 -4.9113 -4.9113 -4.8638 -4.8638 -4.8390 -4.8390 -4.8006 -4.8006 0.8362 0.8362 2.0481 2.0481 4.2091 4.2091 8.1708 8.1708 9.1422 9.1422 9.7680 9.7680 10.0175 10.0175 10.3708 10.3708 11.4507 11.4507 12.0717 12.0717 13.3581 13.3581 13.8629 13.8629 k = 0.0000 0.0000 0.4324 ( 4540 PWs) bands (ev): -25.1092 -25.1092 -7.9795 -7.9795 -7.5181 -7.5181 -7.5009 -7.5009 -7.4915 -7.4915 -7.4774 -7.4774 -7.4650 -7.4650 -7.4645 -7.4645 -6.8168 -6.8168 -6.7845 -6.7845 -5.0111 -5.0111 -4.9845 -4.9845 -4.9383 -4.9383 -4.9287 -4.9287 -4.9184 -4.9184 -4.9103 -4.9103 -4.8679 -4.8679 -4.8403 -4.8403 -4.8017 -4.8017 0.8855 0.8855 1.9829 1.9829 4.2137 4.2137 8.1738 8.1738 9.1746 9.1746 9.8299 9.8299 9.9905 9.9905 10.3074 10.3074 11.4349 11.4349 12.0262 12.0262 13.3311 13.3311 13.8652 13.8652 k = 0.0000 0.0000 0.4478 ( 4544 PWs) bands (ev): -25.1092 -25.1092 -7.9799 -7.9799 -7.5183 -7.5183 -7.5010 -7.5010 -7.4920 -7.4920 -7.4759 -7.4759 -7.4656 -7.4656 -7.4651 -7.4651 -6.8168 -6.8168 -6.7840 -6.7840 -5.0109 -5.0109 -4.9841 -4.9841 -4.9380 -4.9380 -4.9249 -4.9249 -4.9178 -4.9178 -4.9096 -4.9096 -4.8717 -4.8717 -4.8412 -4.8412 -4.8026 -4.8026 0.9286 0.9286 1.9273 1.9273 4.2173 4.2173 8.1761 8.1761 9.2012 9.2012 9.8906 9.8906 9.9694 9.9694 10.2456 10.2456 11.4226 11.4226 11.9895 11.9895 13.3097 13.3097 13.8670 13.8670 k = 0.0000 0.0000 0.4632 ( 4544 PWs) bands (ev): -25.1092 -25.1092 -7.9803 -7.9803 -7.5184 -7.5184 -7.5011 -7.5011 -7.4923 -7.4923 -7.4747 -7.4747 -7.4667 -7.4667 -7.4652 -7.4652 -6.8168 -6.8168 -6.7837 -6.7837 -5.0108 -5.0108 -4.9838 -4.9838 -4.9378 -4.9378 -4.9218 -4.9218 -4.9174 -4.9174 -4.9090 -4.9090 -4.8748 -4.8748 -4.8419 -4.8419 -4.8033 -4.8033 0.9628 0.9628 1.8841 1.8841 4.2200 4.2200 8.1778 8.1778 9.2210 9.2210 9.9501 9.9501 9.9544 9.9544 10.1852 10.1852 11.4139 11.4139 11.9626 11.9626 13.2941 13.2941 13.8682 13.8682 k = 0.0000 0.0000 0.4787 ( 4536 PWs) bands (ev): -25.1092 -25.1092 -7.9805 -7.9805 -7.5185 -7.5185 -7.5011 -7.5011 -7.4925 -7.4925 -7.4737 -7.4737 -7.4676 -7.4676 -7.4652 -7.4652 -6.8167 -6.8167 -6.7835 -6.7835 -5.0107 -5.0107 -4.9836 -4.9836 -4.9377 -4.9377 -4.9197 -4.9197 -4.9171 -4.9171 -4.9086 -4.9086 -4.8770 -4.8770 -4.8423 -4.8423 -4.8037 -4.8037 0.9851 0.9851 1.8565 1.8565 4.2216 4.2216 8.1788 8.1788 9.2332 9.2332 9.9454 9.9454 10.0089 10.0089 10.1260 10.1260 11.4086 11.4086 11.9460 11.9460 13.2847 13.2847 13.8690 13.8690 k = 0.0000 0.0000 0.4941 ( 4548 PWs) bands (ev): -25.1092 -25.1092 -7.9806 -7.9806 -7.5185 -7.5185 -7.5011 -7.5011 -7.4926 -7.4926 -7.4733 -7.4733 -7.4679 -7.4679 -7.4652 -7.4652 -6.8167 -6.8167 -6.7834 -6.7834 -5.0107 -5.0107 -4.9835 -4.9835 -4.9377 -4.9377 -4.9189 -4.9189 -4.9171 -4.9171 -4.9085 -4.9085 -4.8778 -4.8778 -4.8424 -4.8424 -4.8038 -4.8038 0.9928 0.9928 1.8469 1.8469 4.2221 4.2221 8.1791 8.1791 9.2373 9.2373 9.9424 9.9424 10.0660 10.0660 10.0687 10.0687 11.4069 11.4069 11.9405 11.9405 13.2815 13.2815 13.8692 13.8692 k = 0.0000 0.0000 0.4941 ( 4548 PWs) bands (ev): -25.1092 -25.1092 -7.9806 -7.9806 -7.5185 -7.5185 -7.5011 -7.5011 -7.4926 -7.4926 -7.4733 -7.4733 -7.4679 -7.4679 -7.4652 -7.4652 -6.8167 -6.8167 -6.7834 -6.7834 -5.0107 -5.0107 -4.9835 -4.9835 -4.9377 -4.9377 -4.9189 -4.9189 -4.9171 -4.9171 -4.9085 -4.9085 -4.8778 -4.8778 -4.8424 -4.8424 -4.8038 -4.8038 0.9928 0.9928 1.8469 1.8469 4.2221 4.2221 8.1791 8.1791 9.2373 9.2373 9.9424 9.9424 10.0660 10.0660 10.0687 10.0687 11.4069 11.4069 11.9405 11.9405 13.2815 13.2815 13.8692 13.8692 k = 0.0000 0.0156 0.4941 ( 4540 PWs) bands (ev): -25.1092 -25.1092 -7.9806 -7.9806 -7.5185 -7.5185 -7.5011 -7.5011 -7.4926 -7.4926 -7.4733 -7.4733 -7.4682 -7.4682 -7.4650 -7.4650 -6.8168 -6.8168 -6.7834 -6.7834 -5.0106 -5.0106 -4.9835 -4.9835 -4.9378 -4.9378 -4.9189 -4.9189 -4.9170 -4.9170 -4.9085 -4.9085 -4.8777 -4.8777 -4.8424 -4.8424 -4.8039 -4.8039 0.9940 0.9940 1.8481 1.8481 4.2185 4.2185 8.1809 8.1809 9.2382 9.2382 9.8973 9.8973 10.0223 10.0223 10.1488 10.1488 11.4144 11.4144 11.9429 11.9429 13.2794 13.2794 13.8745 13.8745 k = 0.0000 0.0312 0.4941 ( 4534 PWs) bands (ev): -25.1092 -25.1092 -7.9807 -7.9807 -7.5184 -7.5184 -7.5011 -7.5011 -7.4925 -7.4925 -7.4733 -7.4733 -7.4689 -7.4689 -7.4644 -7.4644 -6.8168 -6.8168 -6.7835 -6.7835 -5.0104 -5.0104 -4.9836 -4.9836 -4.9380 -4.9380 -4.9188 -4.9188 -4.9168 -4.9168 -4.9084 -4.9084 -4.8774 -4.8774 -4.8426 -4.8426 -4.8044 -4.8044 0.9976 0.9976 1.8515 1.8515 4.2076 4.2076 8.1865 8.1865 9.2406 9.2406 9.7970 9.7970 10.0159 10.0159 10.2298 10.2298 11.4364 11.4364 11.9504 11.9504 13.2731 13.2731 13.8902 13.8902 k = 0.0000 0.0469 0.4941 ( 4534 PWs) bands (ev): -25.1092 -25.1092 -7.9807 -7.9807 -7.5183 -7.5183 -7.5010 -7.5010 -7.4925 -7.4925 -7.4733 -7.4733 -7.4698 -7.4698 -7.4638 -7.4638 -6.8169 -6.8169 -6.7836 -6.7836 -5.0100 -5.0100 -4.9837 -4.9837 -4.9383 -4.9383 -4.9186 -4.9186 -4.9165 -4.9165 -4.9083 -4.9083 -4.8769 -4.8769 -4.8428 -4.8428 -4.8051 -4.8051 1.0035 1.0035 1.8572 1.8572 4.1897 4.1897 8.1955 8.1955 9.2439 9.2439 9.6816 9.6816 10.0198 10.0198 10.2999 10.2999 11.4708 11.4708 11.9643 11.9643 13.2627 13.2627 13.9160 13.9160 k = 0.0000 0.0625 0.4941 ( 4528 PWs) bands (ev): -25.1092 -25.1092 -7.9809 -7.9809 -7.5181 -7.5181 -7.5009 -7.5009 -7.4923 -7.4923 -7.4733 -7.4733 -7.4707 -7.4707 -7.4631 -7.4631 -6.8170 -6.8170 -6.7837 -6.7837 -5.0095 -5.0095 -4.9839 -4.9839 -4.9388 -4.9388 -4.9183 -4.9183 -4.9162 -4.9162 -4.9082 -4.9082 -4.8763 -4.8763 -4.8431 -4.8431 -4.8061 -4.8061 1.0118 1.0118 1.8651 1.8651 4.1649 4.1649 8.2078 8.2078 9.2459 9.2459 9.5633 9.5633 10.0279 10.0279 10.3567 10.3567 11.5140 11.5140 11.9864 11.9864 13.2482 13.2482 13.9511 13.9511 k = 0.0000 0.0781 0.4941 ( 4538 PWs) bands (ev): -25.1091 -25.1091 -7.9810 -7.9810 -7.5178 -7.5178 -7.5007 -7.5007 -7.4922 -7.4922 -7.4734 -7.4734 -7.4717 -7.4717 -7.4626 -7.4626 -6.8172 -6.8172 -6.7839 -6.7839 -5.0089 -5.0089 -4.9840 -4.9840 -4.9394 -4.9394 -4.9181 -4.9181 -4.9157 -4.9157 -4.9080 -4.9080 -4.8755 -4.8755 -4.8435 -4.8435 -4.8074 -4.8074 1.0225 1.0225 1.8752 1.8752 4.1335 4.1335 8.2230 8.2230 9.2393 9.2393 9.4528 9.4528 10.0390 10.0390 10.4000 10.4000 11.5609 11.5609 12.0195 12.0195 13.2300 13.2300 13.9941 13.9941 k = 0.0000 0.0938 0.4941 ( 4540 PWs) bands (ev): -25.1091 -25.1091 -7.9812 -7.9812 -7.5176 -7.5176 -7.5005 -7.5005 -7.4920 -7.4920 -7.4734 -7.4734 -7.4726 -7.4726 -7.4620 -7.4620 -6.8175 -6.8175 -6.7840 -6.7840 -5.0081 -5.0081 -4.9842 -4.9842 -4.9400 -4.9400 -4.9178 -4.9178 -4.9152 -4.9152 -4.9078 -4.9078 -4.8745 -4.8745 -4.8440 -4.8440 -4.8089 -4.8089 1.0355 1.0355 1.8874 1.8874 4.0958 4.0958 8.2405 8.2405 9.2001 9.2001 9.3764 9.3764 10.0528 10.0528 10.4309 10.4309 11.6053 11.6053 12.0665 12.0665 13.2079 13.2079 14.0399 14.0399 k = 0.0000 0.1094 0.4941 ( 4540 PWs) bands (ev): -25.1091 -25.1091 -7.9814 -7.9814 -7.5173 -7.5173 -7.5003 -7.5003 -7.4918 -7.4918 -7.4737 -7.4737 -7.4734 -7.4734 -7.4616 -7.4616 -6.8178 -6.8178 -6.7842 -6.7842 -5.0071 -5.0071 -4.9844 -4.9844 -4.9407 -4.9407 -4.9175 -4.9175 -4.9147 -4.9147 -4.9075 -4.9075 -4.8734 -4.8734 -4.8446 -4.8446 -4.8108 -4.8108 1.0509 1.0509 1.9017 1.9017 4.0523 4.0523 8.2593 8.2593 9.1102 9.1102 9.3540 9.3540 10.0688 10.0688 10.4509 10.4509 11.6423 11.6423 12.1288 12.1288 13.1821 13.1821 14.0605 14.0605 k = 0.0000 0.1250 0.4941 ( 4544 PWs) bands (ev): -25.1091 -25.1091 -7.9817 -7.9817 -7.5170 -7.5170 -7.5001 -7.5001 -7.4916 -7.4916 -7.4746 -7.4746 -7.4735 -7.4735 -7.4612 -7.4612 -6.8182 -6.8182 -6.7844 -6.7844 -5.0060 -5.0060 -4.9845 -4.9845 -4.9414 -4.9414 -4.9172 -4.9172 -4.9143 -4.9143 -4.9072 -4.9072 -4.8722 -4.8722 -4.8451 -4.8451 -4.8128 -4.8128 1.0687 1.0687 1.9180 1.9180 4.0034 4.0034 8.2779 8.2779 8.9984 8.9984 9.3594 9.3594 10.0869 10.0869 10.4620 10.4620 11.6690 11.6690 12.2053 12.2053 13.1522 13.1522 14.0410 14.0410 k = 0.0000 0.1406 0.4941 ( 4534 PWs) bands (ev): -25.1091 -25.1091 -7.9819 -7.9819 -7.5166 -7.5166 -7.4998 -7.4998 -7.4913 -7.4913 -7.4755 -7.4755 -7.4736 -7.4736 -7.4609 -7.4609 -6.8187 -6.8187 -6.7845 -6.7845 -5.0048 -5.0048 -4.9846 -4.9846 -4.9422 -4.9422 -4.9169 -4.9169 -4.9138 -4.9138 -4.9068 -4.9068 -4.8708 -4.8708 -4.8458 -4.8458 -4.8151 -4.8151 1.0888 1.0888 1.9361 1.9361 3.9496 3.9496 8.2934 8.2934 8.8856 8.8856 9.3749 9.3749 10.1068 10.1068 10.4659 10.4659 11.6852 11.6852 12.2928 12.2928 13.1179 13.1179 14.0167 14.0167 k = 0.0000 0.1562 0.4941 ( 4540 PWs) bands (ev): -25.1090 -25.1090 -7.9822 -7.9822 -7.5163 -7.5163 -7.4994 -7.4994 -7.4910 -7.4910 -7.4764 -7.4764 -7.4737 -7.4737 -7.4607 -7.4607 -6.8193 -6.8193 -6.7845 -6.7845 -5.0035 -5.0035 -4.9846 -4.9846 -4.9430 -4.9430 -4.9167 -4.9167 -4.9135 -4.9135 -4.9064 -4.9064 -4.8694 -4.8694 -4.8464 -4.8464 -4.8176 -4.8176 1.1112 1.1112 1.9560 1.9560 3.8912 3.8912 8.3004 8.3004 8.7826 8.7826 9.3955 9.3955 10.1279 10.1279 10.4645 10.4645 11.6917 11.6917 12.3869 12.3869 13.0788 13.0788 13.9986 13.9986 k = 0.0000 0.1719 0.4941 ( 4528 PWs) bands (ev): -25.1090 -25.1090 -7.9825 -7.9825 -7.5160 -7.5160 -7.4991 -7.4991 -7.4907 -7.4907 -7.4772 -7.4772 -7.4737 -7.4737 -7.4606 -7.4606 -6.8200 -6.8200 -6.7845 -6.7845 -5.0021 -5.0021 -4.9846 -4.9846 -4.9437 -4.9437 -4.9164 -4.9164 -4.9132 -4.9132 -4.9059 -4.9059 -4.8678 -4.8678 -4.8471 -4.8471 -4.8204 -4.8204 1.1360 1.1360 1.9774 1.9774 3.8288 3.8288 8.2889 8.2889 8.7014 8.7014 9.4194 9.4194 10.1498 10.1498 10.4595 10.4595 11.6897 11.6897 12.4830 12.4830 13.0352 13.0352 13.9912 13.9912 k = 0.0000 0.1875 0.4941 ( 4536 PWs) bands (ev): -25.1090 -25.1090 -7.9829 -7.9829 -7.5157 -7.5157 -7.4986 -7.4986 -7.4904 -7.4904 -7.4779 -7.4779 -7.4738 -7.4738 -7.4606 -7.4606 -6.8208 -6.8208 -6.7844 -6.7844 -5.0005 -5.0005 -4.9844 -4.9844 -4.9444 -4.9444 -4.9162 -4.9162 -4.9129 -4.9129 -4.9055 -4.9055 -4.8662 -4.8662 -4.8478 -4.8478 -4.8232 -4.8232 1.1631 1.1631 2.0004 2.0004 3.7629 3.7629 8.2474 8.2474 8.6543 8.6543 9.4458 9.4458 10.1714 10.1714 10.4526 10.4526 11.6800 11.6800 12.5756 12.5756 12.9892 12.9892 13.9972 13.9972 k = 0.0000 0.2031 0.4941 ( 4540 PWs) bands (ev): -25.1089 -25.1089 -7.9832 -7.9832 -7.5155 -7.5155 -7.4982 -7.4982 -7.4901 -7.4901 -7.4786 -7.4786 -7.4739 -7.4739 -7.4607 -7.4607 -6.8217 -6.8217 -6.7843 -6.7843 -4.9989 -4.9989 -4.9842 -4.9842 -4.9451 -4.9451 -4.9161 -4.9161 -4.9128 -4.9128 -4.9050 -4.9050 -4.8646 -4.8646 -4.8485 -4.8485 -4.8262 -4.8262 1.1924 1.1924 2.0247 2.0247 3.6940 3.6940 8.1749 8.1749 8.6431 8.6431 9.4745 9.4745 10.1917 10.1917 10.4457 10.4457 11.6635 11.6635 12.6548 12.6548 12.9483 12.9483 14.0181 14.0181 k = 0.0000 0.2188 0.4941 ( 4528 PWs) bands (ev): -25.1089 -25.1089 -7.9836 -7.9836 -7.5153 -7.5153 -7.4976 -7.4976 -7.4898 -7.4898 -7.4791 -7.4791 -7.4739 -7.4739 -7.4609 -7.4609 -6.8227 -6.8227 -6.7841 -6.7841 -4.9972 -4.9972 -4.9838 -4.9838 -4.9458 -4.9458 -4.9159 -4.9159 -4.9127 -4.9127 -4.9046 -4.9046 -4.8629 -4.8629 -4.8493 -4.8493 -4.8293 -4.8293 1.2241 1.2241 2.0501 2.0501 3.6223 3.6223 8.0824 8.0824 8.6570 8.6570 9.5049 9.5049 10.2091 10.2091 10.4408 10.4408 11.6411 11.6411 12.6967 12.6967 12.9354 12.9354 14.0543 14.0543 k = 0.0000 0.2344 0.4941 ( 4540 PWs) bands (ev): -25.1089 -25.1089 -7.9840 -7.9840 -7.5151 -7.5151 -7.4971 -7.4971 -7.4896 -7.4896 -7.4795 -7.4795 -7.4740 -7.4740 -7.4611 -7.4611 -6.8238 -6.8238 -6.7838 -6.7838 -4.9954 -4.9954 -4.9832 -4.9832 -4.9464 -4.9464 -4.9159 -4.9159 -4.9127 -4.9127 -4.9043 -4.9043 -4.8612 -4.8612 -4.8502 -4.8502 -4.8324 -4.8324 1.2580 1.2580 2.0764 2.0764 3.5485 3.5485 7.9806 7.9806 8.6855 8.6855 9.5370 9.5370 10.2221 10.2221 10.4397 10.4397 11.6139 11.6139 12.6778 12.6778 12.9739 12.9739 14.1053 14.1053 k = 0.0000 0.2500 0.4941 ( 4536 PWs) bands (ev): -25.1088 -25.1088 -7.9843 -7.9843 -7.5150 -7.5150 -7.4964 -7.4964 -7.4894 -7.4894 -7.4797 -7.4797 -7.4740 -7.4740 -7.4615 -7.4615 -6.8249 -6.8249 -6.7835 -6.7835 -4.9937 -4.9937 -4.9825 -4.9825 -4.9469 -4.9469 -4.9160 -4.9160 -4.9127 -4.9127 -4.9040 -4.9040 -4.8595 -4.8595 -4.8512 -4.8512 -4.8354 -4.8354 1.2941 1.2941 2.1035 2.1035 3.4728 3.4728 7.8760 7.8760 8.7225 8.7225 9.5703 9.5703 10.2296 10.2296 10.4435 10.4435 11.5833 11.5833 12.6191 12.6191 13.0430 13.0430 14.1698 14.1698 k = 0.0000 0.2656 0.4941 ( 4540 PWs) bands (ev): -25.1088 -25.1088 -7.9847 -7.9847 -7.5149 -7.5149 -7.4958 -7.4958 -7.4893 -7.4893 -7.4799 -7.4799 -7.4740 -7.4740 -7.4619 -7.4619 -6.8262 -6.8262 -6.7831 -6.7831 -4.9920 -4.9920 -4.9815 -4.9815 -4.9474 -4.9474 -4.9162 -4.9162 -4.9126 -4.9126 -4.9038 -4.9038 -4.8579 -4.8579 -4.8524 -4.8524 -4.8381 -4.8381 1.3324 1.3324 2.1310 2.1310 3.3958 3.3958 7.7720 7.7720 8.7647 8.7647 9.6045 9.6045 10.2318 10.2318 10.4519 10.4519 11.5508 11.5508 12.5439 12.5439 13.1202 13.1202 14.2463 14.2463 k = 0.0000 0.2812 0.4941 ( 4540 PWs) bands (ev): -25.1088 -25.1088 -7.9851 -7.9851 -7.5149 -7.5149 -7.4950 -7.4950 -7.4893 -7.4893 -7.4799 -7.4799 -7.4740 -7.4740 -7.4624 -7.4624 -6.8274 -6.8274 -6.7827 -6.7827 -4.9904 -4.9904 -4.9803 -4.9803 -4.9477 -4.9477 -4.9166 -4.9166 -4.9125 -4.9125 -4.9037 -4.9037 -4.8564 -4.8564 -4.8539 -4.8539 -4.8404 -4.8404 1.3728 1.3728 2.1588 2.1588 3.3176 3.3176 7.6703 7.6703 8.8103 8.8103 9.6395 9.6395 10.2299 10.2299 10.4631 10.4631 11.5179 11.5179 12.4613 12.4613 13.1974 13.1974 14.3327 14.3327 k = 0.0000 0.2969 0.4941 ( 4544 PWs) bands (ev): -25.1087 -25.1087 -7.9855 -7.9855 -7.5149 -7.5149 -7.4943 -7.4943 -7.4892 -7.4892 -7.4797 -7.4797 -7.4740 -7.4740 -7.4629 -7.4629 -6.8287 -6.8287 -6.7823 -6.7823 -4.9889 -4.9889 -4.9789 -4.9789 -4.9479 -4.9479 -4.9173 -4.9173 -4.9123 -4.9123 -4.9037 -4.9037 -4.8569 -4.8569 -4.8541 -4.8541 -4.8422 -4.8422 1.4154 1.4154 2.1866 2.1866 3.2388 3.2388 7.5723 7.5723 8.8582 8.8582 9.6748 9.6748 10.2260 10.2260 10.4744 10.4744 11.4865 11.4865 12.3751 12.3751 13.2718 13.2718 14.4262 14.4262 k = 0.0000 0.3125 0.4941 ( 4540 PWs) bands (ev): -25.1087 -25.1087 -7.9858 -7.9858 -7.5150 -7.5150 -7.4936 -7.4936 -7.4892 -7.4892 -7.4795 -7.4795 -7.4740 -7.4740 -7.4636 -7.4636 -6.8299 -6.8299 -6.7818 -6.7818 -4.9875 -4.9875 -4.9772 -4.9772 -4.9480 -4.9480 -4.9181 -4.9181 -4.9121 -4.9121 -4.9038 -4.9038 -4.8596 -4.8596 -4.8528 -4.8528 -4.8433 -4.8433 1.4600 1.4600 2.2140 2.2140 3.1596 3.1596 7.4788 7.4788 8.9075 8.9075 9.7099 9.7099 10.2221 10.2221 10.4832 10.4832 11.4586 11.4586 12.2874 12.2874 13.3421 13.3421 14.4464 14.4464 k = 0.0000 0.3281 0.4941 ( 4542 PWs) bands (ev): -25.1087 -25.1087 -7.9862 -7.9862 -7.5151 -7.5151 -7.4929 -7.4929 -7.4892 -7.4892 -7.4793 -7.4793 -7.4740 -7.4740 -7.4642 -7.4642 -6.8312 -6.8312 -6.7813 -6.7813 -4.9862 -4.9862 -4.9754 -4.9754 -4.9478 -4.9478 -4.9190 -4.9190 -4.9118 -4.9118 -4.9039 -4.9039 -4.8627 -4.8627 -4.8514 -4.8514 -4.8440 -4.8440 1.5065 1.5065 2.2409 2.2409 3.0804 3.0804 7.3906 7.3906 8.9575 8.9575 9.7446 9.7446 10.2196 10.2196 10.4871 10.4871 11.4357 11.4357 12.1997 12.1997 13.4078 13.4078 14.3776 14.3776 k = 0.0000 0.3438 0.4941 ( 4542 PWs) bands (ev): -25.1086 -25.1086 -7.9865 -7.9865 -7.5152 -7.5152 -7.4923 -7.4923 -7.4891 -7.4891 -7.4790 -7.4790 -7.4739 -7.4739 -7.4650 -7.4650 -6.8324 -6.8324 -6.7809 -6.7809 -4.9851 -4.9851 -4.9735 -4.9735 -4.9475 -4.9475 -4.9200 -4.9200 -4.9116 -4.9116 -4.9042 -4.9042 -4.8661 -4.8661 -4.8502 -4.8502 -4.8444 -4.8444 1.5549 1.5549 2.2669 2.2669 3.0014 3.0014 7.3080 7.3080 9.0075 9.0075 9.7784 9.7784 10.2199 10.2199 10.4842 10.4842 11.4192 11.4192 12.1133 12.1133 13.4685 13.4685 14.3041 14.3041 k = 0.0000 0.3594 0.4941 ( 4542 PWs) bands (ev): -25.1086 -25.1086 -7.9868 -7.9868 -7.5153 -7.5153 -7.4919 -7.4919 -7.4887 -7.4887 -7.4787 -7.4787 -7.4738 -7.4738 -7.4657 -7.4657 -6.8335 -6.8335 -6.7804 -6.7804 -4.9840 -4.9840 -4.9716 -4.9716 -4.9469 -4.9469 -4.9211 -4.9211 -4.9114 -4.9114 -4.9045 -4.9045 -4.8697 -4.8697 -4.8490 -4.8490 -4.8444 -4.8444 1.6049 1.6049 2.2917 2.2917 2.9231 2.9231 7.2317 7.2317 9.0568 9.0568 9.8110 9.8110 10.2237 10.2237 10.4733 10.4733 11.4100 11.4100 12.0294 12.0294 13.5239 13.5239 14.2291 14.2291 k = 0.0000 0.3750 0.4941 ( 4536 PWs) bands (ev): -25.1086 -25.1086 -7.9871 -7.9871 -7.5155 -7.5155 -7.4916 -7.4916 -7.4881 -7.4881 -7.4784 -7.4784 -7.4737 -7.4737 -7.4665 -7.4665 -6.8346 -6.8346 -6.7800 -6.7800 -4.9830 -4.9830 -4.9698 -4.9698 -4.9459 -4.9459 -4.9222 -4.9222 -4.9114 -4.9114 -4.9048 -4.9048 -4.8731 -4.8731 -4.8481 -4.8481 -4.8442 -4.8442 1.6565 1.6565 2.3149 2.3149 2.8459 2.8459 7.1621 7.1621 9.1045 9.1045 9.8422 9.8422 10.2315 10.2315 10.4541 10.4541 11.4080 11.4080 11.9490 11.9490 13.5739 13.5739 14.1552 14.1552 k = 0.0000 0.3906 0.4941 ( 4544 PWs) bands (ev): -25.1086 -25.1086 -7.9873 -7.9873 -7.5156 -7.5156 -7.4916 -7.4916 -7.4874 -7.4874 -7.4782 -7.4782 -7.4737 -7.4737 -7.4672 -7.4672 -6.8356 -6.8356 -6.7796 -6.7796 -4.9821 -4.9821 -4.9682 -4.9682 -4.9446 -4.9446 -4.9233 -4.9233 -4.9116 -4.9116 -4.9051 -4.9051 -4.8765 -4.8765 -4.8474 -4.8474 -4.8438 -4.8438 1.7093 1.7093 2.3363 2.3363 2.7701 2.7701 7.0996 7.0996 9.1499 9.1499 9.8725 9.8725 10.2432 10.2432 10.4270 10.4270 11.4122 11.4122 11.8733 11.8733 13.6179 13.6179 14.0846 14.0846 k = 0.0000 0.4062 0.4941 ( 4540 PWs) bands (ev): -25.1085 -25.1085 -7.9876 -7.9876 -7.5157 -7.5157 -7.4916 -7.4916 -7.4866 -7.4866 -7.4780 -7.4780 -7.4736 -7.4736 -7.4680 -7.4680 -6.8365 -6.8365 -6.7792 -6.7792 -4.9812 -4.9812 -4.9668 -4.9668 -4.9429 -4.9429 -4.9244 -4.9244 -4.9123 -4.9123 -4.9053 -4.9053 -4.8796 -4.8796 -4.8469 -4.8469 -4.8433 -4.8433 1.7628 1.7628 2.3556 2.3556 2.6963 2.6963 7.0446 7.0446 9.1919 9.1919 9.9023 9.9023 10.2582 10.2582 10.3930 10.3930 11.4211 11.4211 11.8037 11.8037 13.6556 13.6556 14.0197 14.0197 k = 0.0000 0.4219 0.4941 ( 4548 PWs) bands (ev): -25.1085 -25.1085 -7.9878 -7.9878 -7.5159 -7.5159 -7.4917 -7.4917 -7.4857 -7.4857 -7.4779 -7.4779 -7.4735 -7.4735 -7.4686 -7.4686 -6.8373 -6.8373 -6.7789 -6.7789 -4.9805 -4.9805 -4.9657 -4.9657 -4.9408 -4.9408 -4.9254 -4.9254 -4.9134 -4.9134 -4.9053 -4.9053 -4.8824 -4.8824 -4.8466 -4.8466 -4.8427 -4.8427 1.8165 1.8165 2.3724 2.3724 2.6253 2.6253 6.9975 6.9975 9.2295 9.2295 9.9324 9.9324 10.2752 10.2752 10.3538 10.3538 11.4326 11.4326 11.7416 11.7416 13.6862 13.6862 13.9628 13.9628 k = 0.0000 0.4375 0.4941 ( 4544 PWs) bands (ev): -25.1085 -25.1085 -7.9879 -7.9879 -7.5160 -7.5160 -7.4917 -7.4917 -7.4849 -7.4849 -7.4778 -7.4778 -7.4735 -7.4735 -7.4692 -7.4692 -6.8379 -6.8379 -6.7786 -6.7786 -4.9798 -4.9798 -4.9649 -4.9649 -4.9384 -4.9384 -4.9263 -4.9263 -4.9149 -4.9149 -4.9053 -4.9053 -4.8847 -4.8847 -4.8463 -4.8463 -4.8422 -4.8422 1.8692 1.8692 2.3865 2.3865 2.5584 2.5584 6.9584 6.9584 9.2619 9.2619 9.9638 9.9638 10.2909 10.2909 10.3124 10.3124 11.4447 11.4447 11.6886 11.6886 13.7089 13.7089 13.9163 13.9163 k = 0.0000 0.4531 0.4941 ( 4540 PWs) bands (ev): -25.1085 -25.1085 -7.9881 -7.9881 -7.5161 -7.5161 -7.4918 -7.4918 -7.4842 -7.4842 -7.4778 -7.4778 -7.4735 -7.4735 -7.4696 -7.4696 -6.8384 -6.8384 -6.7784 -6.7784 -4.9793 -4.9793 -4.9643 -4.9643 -4.9358 -4.9358 -4.9270 -4.9270 -4.9168 -4.9168 -4.9051 -4.9051 -4.8866 -4.8866 -4.8462 -4.8462 -4.8417 -4.8417 1.9190 1.9190 2.3976 2.3976 2.4976 2.4976 6.9278 6.9278 9.2881 9.2881 9.9973 9.9973 10.2633 10.2633 10.3110 10.3110 11.4551 11.4551 11.6464 11.6464 13.7225 13.7225 13.8825 13.8825 k = 0.0000 0.4688 0.4941 ( 4540 PWs) bands (ev): -25.1085 -25.1085 -7.9882 -7.9882 -7.5161 -7.5161 -7.4918 -7.4918 -7.4835 -7.4835 -7.4779 -7.4779 -7.4736 -7.4736 -7.4700 -7.4700 -6.8388 -6.8388 -6.7782 -6.7782 -4.9789 -4.9789 -4.9638 -4.9638 -4.9332 -4.9332 -4.9275 -4.9275 -4.9190 -4.9190 -4.9050 -4.9050 -4.8880 -4.8880 -4.8460 -4.8460 -4.8414 -4.8414 1.9625 1.9625 2.4052 2.4052 2.4467 2.4467 6.9057 6.9057 9.3073 9.3073 10.0331 10.0331 10.2180 10.2180 10.3239 10.3239 11.4624 11.4624 11.6164 11.6164 13.7274 13.7274 13.8623 13.8623 k = 0.0000 0.4844 0.4941 ( 4536 PWs) bands (ev): -25.1085 -25.1085 -7.9882 -7.9882 -7.5162 -7.5162 -7.4919 -7.4919 -7.4831 -7.4831 -7.4780 -7.4780 -7.4737 -7.4737 -7.4701 -7.4701 -6.8390 -6.8390 -6.7782 -6.7782 -4.9786 -4.9786 -4.9636 -4.9636 -4.9310 -4.9310 -4.9278 -4.9278 -4.9210 -4.9210 -4.9049 -4.9049 -4.8888 -4.8888 -4.8460 -4.8460 -4.8412 -4.8412 1.9939 1.9939 2.4036 2.4036 2.4171 2.4171 6.8924 6.8924 9.3190 9.3190 10.0695 10.0695 10.1751 10.1751 10.3325 10.3325 11.4661 11.4661 11.5989 11.5989 13.7270 13.7270 13.8531 13.8531 k = 0.0000 0.5000 0.4941 ( 4532 PWs) bands (ev): -25.1085 -25.1085 -7.9882 -7.9882 -7.5162 -7.5162 -7.4919 -7.4919 -7.4829 -7.4829 -7.4780 -7.4780 -7.4737 -7.4737 -7.4702 -7.4702 -6.8391 -6.8391 -6.7781 -6.7781 -4.9786 -4.9786 -4.9635 -4.9635 -4.9300 -4.9300 -4.9278 -4.9278 -4.9220 -4.9220 -4.9048 -4.9048 -4.8890 -4.8890 -4.8459 -4.8459 -4.8411 -4.8411 2.0056 2.0056 2.3937 2.3937 2.4153 2.4153 6.8880 6.8880 9.3229 9.3229 10.0924 10.0924 10.1499 10.1499 10.3355 10.3355 11.4671 11.4671 11.5933 11.5933 13.7262 13.7262 13.8506 13.8506 k = 0.0000 0.5000 0.4941 ( 4532 PWs) bands (ev): -25.1085 -25.1085 -7.9882 -7.9882 -7.5162 -7.5162 -7.4919 -7.4919 -7.4829 -7.4829 -7.4780 -7.4780 -7.4737 -7.4737 -7.4702 -7.4702 -6.8391 -6.8391 -6.7781 -6.7781 -4.9786 -4.9786 -4.9635 -4.9635 -4.9300 -4.9300 -4.9278 -4.9278 -4.9220 -4.9220 -4.9048 -4.9048 -4.8890 -4.8890 -4.8459 -4.8459 -4.8411 -4.8411 2.0056 2.0056 2.3937 2.3937 2.4153 2.4153 6.8880 6.8880 9.3229 9.3229 10.0924 10.0924 10.1499 10.1499 10.3355 10.3355 11.4671 11.4671 11.5933 11.5933 13.7262 13.7262 13.8506 13.8506 k = 0.0156 0.5000 0.4941 ( 4536 PWs) bands (ev): -25.1085 -25.1085 -7.9882 -7.9882 -7.5161 -7.5161 -7.4920 -7.4920 -7.4828 -7.4828 -7.4780 -7.4780 -7.4737 -7.4737 -7.4701 -7.4701 -6.8391 -6.8391 -6.7783 -6.7783 -4.9787 -4.9787 -4.9637 -4.9637 -4.9303 -4.9303 -4.9279 -4.9279 -4.9216 -4.9216 -4.9048 -4.9048 -4.8891 -4.8891 -4.8458 -4.8458 -4.8410 -4.8410 2.0067 2.0067 2.3941 2.3941 2.4156 2.4156 6.8897 6.8897 9.3096 9.3096 10.0583 10.0583 10.0803 10.0803 10.4281 10.4281 11.4837 11.4837 11.6084 11.6084 13.7271 13.7271 13.8512 13.8512 k = 0.0312 0.5000 0.4941 ( 4536 PWs) bands (ev): -25.1085 -25.1085 -7.9881 -7.9881 -7.5160 -7.5160 -7.4923 -7.4923 -7.4826 -7.4826 -7.4778 -7.4778 -7.4737 -7.4737 -7.4700 -7.4700 -6.8391 -6.8391 -6.7787 -6.7787 -4.9792 -4.9792 -4.9643 -4.9643 -4.9311 -4.9311 -4.9281 -4.9281 -4.9206 -4.9206 -4.9047 -4.9047 -4.8891 -4.8891 -4.8454 -4.8454 -4.8407 -4.8407 2.0101 2.0101 2.3953 2.3953 2.4167 2.4167 6.8947 6.8947 9.2705 9.2705 9.9180 9.9180 10.0386 10.0386 10.5790 10.5790 11.5316 11.5316 11.6528 11.6528 13.7298 13.7298 13.8532 13.8532 k = 0.0469 0.5000 0.4941 ( 4536 PWs) bands (ev): -25.1085 -25.1085 -7.9879 -7.9879 -7.5158 -7.5158 -7.4929 -7.4929 -7.4822 -7.4822 -7.4776 -7.4776 -7.4738 -7.4738 -7.4697 -7.4697 -6.8391 -6.8391 -6.7794 -6.7794 -4.9800 -4.9800 -4.9653 -4.9653 -4.9322 -4.9322 -4.9282 -4.9282 -4.9193 -4.9193 -4.9046 -4.9046 -4.8892 -4.8892 -4.8448 -4.8448 -4.8401 -4.8401 2.0156 2.0156 2.3973 2.3973 2.4185 2.4185 6.9030 6.9030 9.2077 9.2077 9.7740 9.7740 9.9765 9.9765 10.7390 10.7390 11.6059 11.6059 11.7239 11.7239 13.7339 13.7339 13.8566 13.8566 k = 0.0625 0.5000 0.4941 ( 4532 PWs) bands (ev): -25.1085 -25.1085 -7.9876 -7.9876 -7.5155 -7.5155 -7.4935 -7.4935 -7.4818 -7.4818 -7.4772 -7.4772 -7.4738 -7.4738 -7.4694 -7.4694 -6.8392 -6.8392 -6.7804 -6.7804 -4.9811 -4.9811 -4.9667 -4.9667 -4.9333 -4.9333 -4.9284 -4.9284 -4.9179 -4.9179 -4.9045 -4.9045 -4.8893 -4.8893 -4.8439 -4.8439 -4.8394 -4.8394 2.0233 2.0233 2.4000 2.4000 2.4211 2.4211 6.9145 6.9145 9.1246 9.1246 9.6334 9.6334 9.8986 9.8986 10.9021 10.9021 11.7009 11.7009 11.8184 11.8184 13.7388 13.7388 13.8619 13.8619 k = 0.0781 0.5000 0.4941 ( 4532 PWs) bands (ev): -25.1085 -25.1085 -7.9872 -7.9872 -7.5151 -7.5151 -7.4942 -7.4942 -7.4813 -7.4813 -7.4767 -7.4767 -7.4737 -7.4737 -7.4689 -7.4689 -6.8393 -6.8393 -6.7817 -6.7817 -4.9825 -4.9825 -4.9683 -4.9683 -4.9345 -4.9345 -4.9287 -4.9287 -4.9165 -4.9165 -4.9043 -4.9043 -4.8895 -4.8895 -4.8428 -4.8428 -4.8384 -4.8384 2.0332 2.0332 2.4035 2.4035 2.4243 2.4243 6.9293 6.9293 9.0246 9.0246 9.4980 9.4980 9.8100 9.8100 11.0668 11.0668 11.8114 11.8114 11.9324 11.9324 13.7437 13.7437 13.8697 13.8697 k = 0.0938 0.5000 0.4941 ( 4544 PWs) bands (ev): -25.1084 -25.1084 -7.9867 -7.9867 -7.5147 -7.5147 -7.4950 -7.4950 -7.4810 -7.4810 -7.4762 -7.4762 -7.4736 -7.4736 -7.4683 -7.4683 -6.8394 -6.8394 -6.7832 -6.7832 -4.9842 -4.9842 -4.9702 -4.9702 -4.9355 -4.9355 -4.9290 -4.9290 -4.9151 -4.9151 -4.9042 -4.9042 -4.8898 -4.8898 -4.8414 -4.8414 -4.8372 -4.8372 2.0451 2.0451 2.4078 2.4078 2.4282 2.4282 6.9471 6.9471 8.9114 8.9114 9.3681 9.3681 9.7146 9.7146 11.2322 11.2322 11.9334 11.9334 12.0625 12.0625 13.7474 13.7474 13.8808 13.8808 k = 0.1094 0.5000 0.4941 ( 4544 PWs) bands (ev): -25.1084 -25.1084 -7.9862 -7.9862 -7.5143 -7.5143 -7.4959 -7.4959 -7.4806 -7.4806 -7.4757 -7.4757 -7.4733 -7.4733 -7.4677 -7.4677 -6.8395 -6.8395 -6.7850 -6.7850 -4.9860 -4.9860 -4.9723 -4.9723 -4.9365 -4.9365 -4.9294 -4.9294 -4.9139 -4.9139 -4.9040 -4.9040 -4.8901 -4.8901 -4.8399 -4.8399 -4.8358 -4.8358 2.0591 2.0591 2.4127 2.4127 2.4327 2.4327 6.9679 6.9679 8.7886 8.7886 9.2437 9.2437 9.6153 9.6153 11.3981 11.3981 12.0641 12.0641 12.2055 12.2055 13.7486 13.7486 13.8960 13.8960 k = 0.1250 0.5000 0.4941 ( 4536 PWs) bands (ev): -25.1084 -25.1084 -7.9856 -7.9856 -7.5138 -7.5138 -7.4967 -7.4967 -7.4803 -7.4803 -7.4754 -7.4754 -7.4728 -7.4728 -7.4669 -7.4669 -6.8396 -6.8396 -6.7870 -6.7870 -4.9881 -4.9881 -4.9746 -4.9746 -4.9374 -4.9374 -4.9299 -4.9299 -4.9127 -4.9127 -4.9039 -4.9039 -4.8905 -4.8905 -4.8381 -4.8381 -4.8343 -4.8343 2.0750 2.0750 2.4183 2.4183 2.4379 2.4379 6.9916 6.9916 8.6593 8.6593 9.1240 9.1240 9.5142 9.5142 11.5640 11.5640 12.2012 12.2012 12.3587 12.3587 13.7462 13.7462 13.9158 13.9158 k = 0.1406 0.5000 0.4941 ( 4532 PWs) bands (ev): -25.1084 -25.1084 -7.9849 -7.9849 -7.5133 -7.5133 -7.4976 -7.4976 -7.4800 -7.4800 -7.4753 -7.4753 -7.4719 -7.4719 -7.4660 -7.4660 -6.8397 -6.8397 -6.7892 -6.7892 -4.9902 -4.9902 -4.9770 -4.9770 -4.9382 -4.9382 -4.9304 -4.9304 -4.9116 -4.9116 -4.9038 -4.9038 -4.8909 -4.8909 -4.8362 -4.8362 -4.8326 -4.8326 2.0928 2.0928 2.4245 2.4245 2.4436 2.4436 7.0179 7.0179 8.5262 8.5262 9.0087 9.0087 9.4129 9.4129 11.7300 11.7300 12.3430 12.3430 12.5196 12.5196 13.7390 13.7390 13.9406 13.9406 k = 0.1562 0.5000 0.4941 ( 4532 PWs) bands (ev): -25.1084 -25.1084 -7.9842 -7.9842 -7.5128 -7.5128 -7.4984 -7.4984 -7.4798 -7.4798 -7.4753 -7.4753 -7.4709 -7.4709 -7.4650 -7.4650 -6.8399 -6.8399 -6.7917 -6.7917 -4.9925 -4.9925 -4.9795 -4.9795 -4.9390 -4.9390 -4.9310 -4.9310 -4.9107 -4.9107 -4.9037 -4.9037 -4.8915 -4.8915 -4.8342 -4.8342 -4.8307 -4.8307 2.1124 2.1124 2.4312 2.4312 2.4498 2.4498 7.0467 7.0467 8.3912 8.3912 8.8974 8.8974 9.3123 9.3123 11.8957 11.8957 12.4884 12.4884 12.6862 12.6862 13.7263 13.7263 13.9707 13.9707 k = 0.1719 0.5000 0.4941 ( 4536 PWs) bands (ev): -25.1083 -25.1083 -7.9834 -7.9834 -7.5123 -7.5123 -7.4993 -7.4993 -7.4795 -7.4795 -7.4754 -7.4754 -7.4698 -7.4698 -7.4639 -7.4639 -6.8400 -6.8400 -6.7943 -6.7943 -4.9949 -4.9949 -4.9821 -4.9821 -4.9396 -4.9396 -4.9316 -4.9316 -4.9100 -4.9100 -4.9037 -4.9037 -4.8920 -4.8920 -4.8320 -4.8320 -4.8288 -4.8288 2.1337 2.1337 2.4385 2.4385 2.4565 2.4565 7.0778 7.0778 8.2560 8.2560 8.7898 8.7898 9.2135 9.2135 12.0612 12.0612 12.6362 12.6362 12.8564 12.8564 13.7073 13.7073 14.0059 14.0059 k = 0.1875 0.5000 0.4941 ( 4540 PWs) bands (ev): -25.1083 -25.1083 -7.9826 -7.9826 -7.5118 -7.5118 -7.5001 -7.5001 -7.4793 -7.4793 -7.4755 -7.4755 -7.4687 -7.4687 -7.4627 -7.4627 -6.8402 -6.8402 -6.7971 -6.7971 -4.9974 -4.9974 -4.9847 -4.9847 -4.9402 -4.9402 -4.9323 -4.9323 -4.9093 -4.9093 -4.9037 -4.9037 -4.8926 -4.8926 -4.8298 -4.8298 -4.8267 -4.8267 2.1564 2.1564 2.4462 2.4462 2.4637 2.4637 7.1109 7.1109 8.1218 8.1218 8.6860 8.6860 9.1172 9.1172 12.2262 12.2262 12.7856 12.7856 13.0284 13.0284 13.6815 13.6815 14.0465 14.0465 k = 0.2031 0.5000 0.4941 ( 4544 PWs) bands (ev): -25.1083 -25.1083 -7.9818 -7.9818 -7.5113 -7.5113 -7.5009 -7.5009 -7.4791 -7.4791 -7.4756 -7.4756 -7.4675 -7.4675 -7.4613 -7.4613 -6.8404 -6.8404 -6.8000 -6.8000 -4.9998 -4.9998 -4.9873 -4.9873 -4.9408 -4.9408 -4.9330 -4.9330 -4.9088 -4.9088 -4.9037 -4.9037 -4.8933 -4.8933 -4.8275 -4.8275 -4.8246 -4.8246 2.1806 2.1806 2.4542 2.4542 2.4712 2.4712 7.1457 7.1457 7.9896 7.9896 8.5859 8.5859 9.0238 9.0238 12.3906 12.3906 12.9356 12.9356 13.1999 13.1999 13.6483 13.6483 14.0928 14.0928 k = 0.2188 0.5000 0.4941 ( 4544 PWs) bands (ev): -25.1083 -25.1083 -7.9809 -7.9809 -7.5109 -7.5109 -7.5017 -7.5017 -7.4789 -7.4789 -7.4757 -7.4757 -7.4663 -7.4663 -7.4599 -7.4599 -6.8406 -6.8406 -6.8030 -6.8030 -5.0023 -5.0023 -4.9899 -4.9899 -4.9413 -4.9413 -4.9338 -4.9338 -4.9084 -4.9084 -4.9037 -4.9037 -4.8940 -4.8940 -4.8251 -4.8251 -4.8224 -4.8224 2.2060 2.2060 2.4626 2.4626 2.4791 2.4791 7.1819 7.1819 7.8600 7.8600 8.4896 8.4896 8.9338 8.9338 12.5542 12.5542 13.0851 13.0851 13.3683 13.3683 13.6082 13.6082 14.1456 14.1456 k = 0.2344 0.5000 0.4941 ( 4548 PWs) bands (ev): -25.1083 -25.1083 -7.9800 -7.9800 -7.5105 -7.5105 -7.5025 -7.5025 -7.4788 -7.4788 -7.4758 -7.4758 -7.4650 -7.4650 -7.4583 -7.4583 -6.8407 -6.8407 -6.8061 -6.8061 -5.0047 -5.0047 -4.9925 -4.9925 -4.9418 -4.9418 -4.9346 -4.9346 -4.9081 -4.9081 -4.9038 -4.9038 -4.8947 -4.8947 -4.8228 -4.8228 -4.8202 -4.8202 2.2324 2.2324 2.4712 2.4712 2.4872 2.4872 7.2192 7.2192 7.7339 7.7339 8.3973 8.3973 8.8478 8.8478 12.7167 12.7167 13.2319 13.2319 13.5229 13.5229 13.5709 13.5709 14.2056 14.2056 k = 0.2500 0.5000 0.4941 ( 4552 PWs) bands (ev): -25.1082 -25.1082 -7.9791 -7.9791 -7.5102 -7.5102 -7.5032 -7.5032 -7.4786 -7.4786 -7.4760 -7.4760 -7.4638 -7.4638 -7.4567 -7.4567 -6.8409 -6.8409 -6.8092 -6.8092 -5.0071 -5.0071 -4.9950 -4.9950 -4.9422 -4.9422 -4.9354 -4.9354 -4.9079 -4.9079 -4.9038 -4.9038 -4.8954 -4.8954 -4.8205 -4.8205 -4.8180 -4.8180 2.2596 2.2596 2.4800 2.4800 2.4954 2.4954 7.2572 7.2572 7.6116 7.6116 8.3091 8.3091 8.7660 8.7660 12.8779 12.8779 13.3647 13.3647 13.5162 13.5162 13.6917 13.6917 14.2740 14.2740 k = 0.2656 0.5000 0.4941 ( 4564 PWs) bands (ev): -25.1082 -25.1082 -7.9782 -7.9782 -7.5099 -7.5099 -7.5040 -7.5040 -7.4785 -7.4785 -7.4761 -7.4761 -7.4626 -7.4626 -7.4550 -7.4550 -6.8411 -6.8411 -6.8124 -6.8124 -5.0094 -5.0094 -4.9974 -4.9974 -4.9427 -4.9427 -4.9362 -4.9362 -4.9078 -4.9078 -4.9039 -4.9039 -4.8961 -4.8961 -4.8182 -4.8182 -4.8158 -4.8158 2.2875 2.2875 2.4888 2.4888 2.5038 2.5038 7.2954 7.2954 7.4937 7.4937 8.2252 8.2252 8.6889 8.6889 13.0374 13.0374 13.3986 13.3986 13.5667 13.5667 13.8344 13.8344 14.3520 14.3520 k = 0.2812 0.5000 0.4941 ( 4560 PWs) bands (ev): -25.1082 -25.1082 -7.9773 -7.9773 -7.5097 -7.5097 -7.5046 -7.5046 -7.4783 -7.4783 -7.4762 -7.4762 -7.4615 -7.4615 -7.4532 -7.4532 -6.8413 -6.8413 -6.8156 -6.8156 -5.0116 -5.0116 -4.9997 -4.9997 -4.9431 -4.9431 -4.9370 -4.9370 -4.9077 -4.9077 -4.9040 -4.9040 -4.8968 -4.8968 -4.8160 -4.8160 -4.8137 -4.8137 2.3157 2.3157 2.4976 2.4976 2.5122 2.5122 7.3333 7.3333 7.3807 7.3807 8.1457 8.1457 8.6168 8.6168 13.1947 13.1947 13.3429 13.3429 13.6990 13.6990 13.9636 13.9636 14.4391 14.4391 k = 0.2969 0.5000 0.4941 ( 4560 PWs) bands (ev): -25.1082 -25.1082 -7.9764 -7.9764 -7.5095 -7.5095 -7.5053 -7.5053 -7.4782 -7.4782 -7.4763 -7.4763 -7.4603 -7.4603 -7.4514 -7.4514 -6.8415 -6.8415 -6.8187 -6.8187 -5.0137 -5.0137 -5.0019 -5.0019 -4.9435 -4.9435 -4.9377 -4.9377 -4.9076 -4.9076 -4.9041 -4.9041 -4.8975 -4.8975 -4.8138 -4.8138 -4.8116 -4.8116 2.3441 2.3441 2.5063 2.5063 2.5205 2.5205 7.2728 7.2728 7.3705 7.3705 8.0709 8.0709 8.5501 8.5501 13.2710 13.2710 13.3513 13.3513 13.8389 13.8389 14.0781 14.0781 14.5329 14.5329 k = 0.3125 0.5000 0.4941 ( 4556 PWs) bands (ev): -25.1081 -25.1081 -7.9756 -7.9756 -7.5094 -7.5094 -7.5059 -7.5059 -7.4782 -7.4782 -7.4763 -7.4763 -7.4592 -7.4592 -7.4496 -7.4496 -6.8417 -6.8417 -6.8218 -6.8218 -5.0157 -5.0157 -5.0040 -5.0040 -4.9440 -4.9440 -4.9384 -4.9384 -4.9076 -4.9076 -4.9042 -4.9042 -4.8981 -4.8981 -4.8118 -4.8118 -4.8097 -4.8097 2.3722 2.3722 2.5149 2.5149 2.5287 2.5287 7.1707 7.1707 7.4063 7.4063 8.0009 8.0009 8.4890 8.4890 13.1970 13.1970 13.5031 13.5031 13.9776 13.9776 14.1794 14.1794 14.6276 14.6276 k = 0.3281 0.5000 0.4941 ( 4560 PWs) bands (ev): -25.1081 -25.1081 -7.9747 -7.9747 -7.5093 -7.5093 -7.5064 -7.5064 -7.4781 -7.4781 -7.4764 -7.4764 -7.4582 -7.4582 -7.4479 -7.4479 -6.8418 -6.8418 -6.8248 -6.8248 -5.0176 -5.0176 -5.0060 -5.0060 -4.9445 -4.9445 -4.9391 -4.9391 -4.9076 -4.9076 -4.9044 -4.9044 -4.8988 -4.8988 -4.8099 -4.8099 -4.8078 -4.8078 2.3999 2.3999 2.5231 2.5231 2.5367 2.5367 7.0747 7.0747 7.4401 7.4401 7.9358 7.9358 8.4340 8.4340 13.1212 13.1212 13.6524 13.6524 14.1130 14.1130 14.2709 14.2709 14.7162 14.7162 k = 0.3438 0.5000 0.4941 ( 4564 PWs) bands (ev): -25.1081 -25.1081 -7.9739 -7.9739 -7.5092 -7.5092 -7.5069 -7.5069 -7.4781 -7.4781 -7.4764 -7.4764 -7.4572 -7.4572 -7.4462 -7.4462 -6.8420 -6.8420 -6.8276 -6.8276 -5.0194 -5.0194 -5.0078 -5.0078 -4.9450 -4.9450 -4.9396 -4.9396 -4.9077 -4.9077 -4.9045 -4.9045 -4.8993 -4.8993 -4.8081 -4.8081 -4.8060 -4.8060 2.4267 2.4267 2.5310 2.5310 2.5444 2.5444 6.9851 6.9851 7.4714 7.4714 7.8758 7.8758 8.3851 8.3851 13.0463 13.0463 13.7980 13.7980 14.2440 14.2440 14.3556 14.3556 14.7927 14.7927 k = 0.3594 0.5000 0.4941 ( 4568 PWs) bands (ev): -25.1081 -25.1081 -7.9732 -7.9732 -7.5092 -7.5092 -7.5074 -7.5074 -7.4781 -7.4781 -7.4764 -7.4764 -7.4563 -7.4563 -7.4445 -7.4445 -6.8421 -6.8421 -6.8303 -6.8303 -5.0210 -5.0210 -5.0095 -5.0095 -4.9455 -4.9455 -4.9401 -4.9401 -4.9077 -4.9077 -4.9046 -4.9046 -4.8999 -4.8999 -4.8064 -4.8064 -4.8044 -4.8044 2.4524 2.4524 2.5385 2.5385 2.5517 2.5517 6.9025 6.9025 7.4995 7.4995 7.8211 7.8211 8.3428 8.3428 12.9739 12.9739 13.9395 13.9395 14.3695 14.3695 14.4360 14.4360 14.8485 14.8485 k = 0.3750 0.5000 0.4941 ( 4560 PWs) bands (ev): -25.1081 -25.1081 -7.9725 -7.9725 -7.5092 -7.5092 -7.5078 -7.5078 -7.4781 -7.4781 -7.4764 -7.4764 -7.4555 -7.4555 -7.4429 -7.4429 -6.8423 -6.8423 -6.8328 -6.8328 -5.0224 -5.0224 -5.0111 -5.0111 -4.9460 -4.9460 -4.9405 -4.9405 -4.9078 -4.9078 -4.9047 -4.9047 -4.9004 -4.9004 -4.8049 -4.8049 -4.8029 -4.8029 2.4765 2.4765 2.5456 2.5456 2.5585 2.5585 6.8271 6.8271 7.5241 7.5241 7.7719 7.7719 8.3069 8.3069 12.9055 12.9055 14.0764 14.0764 14.4884 14.4884 14.5137 14.5137 14.8629 14.8629 k = 0.3906 0.5000 0.4941 ( 4576 PWs) bands (ev): -25.1080 -25.1080 -7.9719 -7.9719 -7.5092 -7.5092 -7.5081 -7.5081 -7.4781 -7.4781 -7.4764 -7.4764 -7.4548 -7.4548 -7.4415 -7.4415 -6.8424 -6.8424 -6.8350 -6.8350 -5.0237 -5.0237 -5.0124 -5.0124 -4.9465 -4.9465 -4.9409 -4.9409 -4.9079 -4.9079 -4.9049 -4.9049 -4.9008 -4.9008 -4.8035 -4.8035 -4.8015 -4.8015 2.4986 2.4986 2.5521 2.5521 2.5647 2.5647 6.7595 6.7595 7.5448 7.5448 7.7282 7.7282 8.2775 8.2775 12.8421 12.8421 14.2083 14.2083 14.5877 14.5877 14.6010 14.6010 14.8720 14.8720 k = 0.4062 0.5000 0.4941 ( 4584 PWs) bands (ev): -25.1080 -25.1080 -7.9714 -7.9714 -7.5093 -7.5093 -7.5083 -7.5083 -7.4782 -7.4782 -7.4764 -7.4764 -7.4541 -7.4541 -7.4402 -7.4402 -6.8425 -6.8425 -6.8371 -6.8371 -5.0249 -5.0249 -5.0136 -5.0136 -4.9469 -4.9469 -4.9412 -4.9412 -4.9080 -4.9080 -4.9050 -4.9050 -4.9012 -4.9012 -4.8023 -4.8023 -4.8004 -4.8004 2.5183 2.5183 2.5583 2.5583 2.5703 2.5703 6.6999 6.6999 7.5613 7.5613 7.6903 7.6903 8.2542 8.2542 12.7850 12.7850 14.3344 14.3344 14.6610 14.6610 14.7020 14.7020 14.8837 14.8837 k = 0.4219 0.5000 0.4941 ( 4584 PWs) bands (ev): -25.1080 -25.1080 -7.9709 -7.9709 -7.5094 -7.5094 -7.5085 -7.5085 -7.4782 -7.4782 -7.4763 -7.4763 -7.4536 -7.4536 -7.4391 -7.4391 -6.8426 -6.8426 -6.8388 -6.8388 -5.0258 -5.0258 -5.0146 -5.0146 -4.9473 -4.9473 -4.9414 -4.9414 -4.9080 -4.9080 -4.9051 -4.9051 -4.9015 -4.9015 -4.8013 -4.8013 -4.7993 -4.7993 2.5351 2.5351 2.5642 2.5642 2.5752 2.5752 6.6488 6.6488 7.5737 7.5737 7.6585 7.6585 8.2365 8.2365 12.7351 12.7351 14.4543 14.4543 14.7305 14.7305 14.7883 14.7883 14.9023 14.9023 k = 0.4375 0.5000 0.4941 ( 4588 PWs) bands (ev): -25.1080 -25.1080 -7.9705 -7.9705 -7.5095 -7.5095 -7.5086 -7.5086 -7.4783 -7.4783 -7.4763 -7.4763 -7.4531 -7.4531 -7.4381 -7.4381 -6.8427 -6.8427 -6.8403 -6.8403 -5.0267 -5.0267 -5.0155 -5.0155 -4.9477 -4.9477 -4.9416 -4.9416 -4.9081 -4.9081 -4.9052 -4.9052 -4.9017 -4.9017 -4.8004 -4.8004 -4.7985 -4.7985 2.5482 2.5482 2.5701 2.5701 2.5793 2.5793 6.6065 6.6065 7.5817 7.5817 7.6334 7.6334 8.2237 8.2237 12.6931 12.6931 14.5669 14.5669 14.7945 14.7945 14.8467 14.8467 14.9393 14.9393 k = 0.4531 0.5000 0.4941 ( 4584 PWs) bands (ev): -25.1080 -25.1080 -7.9702 -7.9702 -7.5097 -7.5097 -7.5087 -7.5087 -7.4783 -7.4783 -7.4763 -7.4763 -7.4527 -7.4527 -7.4374 -7.4374 -6.8428 -6.8428 -6.8414 -6.8414 -5.0273 -5.0273 -5.0161 -5.0161 -4.9480 -4.9480 -4.9417 -4.9417 -4.9081 -4.9081 -4.9053 -4.9053 -4.9019 -4.9019 -4.7998 -4.7998 -4.7978 -4.7978 2.5572 2.5572 2.5763 2.5763 2.5826 2.5826 6.5733 6.5733 7.5845 7.5845 7.6164 7.6164 8.2149 8.2149 12.6597 12.6597 14.6702 14.6702 14.8472 14.8472 14.8791 14.8791 14.9944 14.9944 k = 0.4688 0.5000 0.4941 ( 4596 PWs) bands (ev): -25.1080 -25.1080 -7.9699 -7.9699 -7.5098 -7.5098 -7.5087 -7.5087 -7.4783 -7.4783 -7.4762 -7.4762 -7.4525 -7.4525 -7.4368 -7.4368 -6.8428 -6.8428 -6.8423 -6.8423 -5.0277 -5.0277 -5.0166 -5.0166 -4.9482 -4.9482 -4.9418 -4.9418 -4.9082 -4.9082 -4.9053 -4.9053 -4.9021 -4.9021 -4.7993 -4.7993 -4.7974 -4.7974 2.5624 2.5624 2.5817 2.5817 2.5853 2.5853 6.5494 6.5494 7.5813 7.5813 7.6090 7.6090 8.2094 8.2094 12.6355 12.6355 14.7582 14.7582 14.8749 14.8749 14.9185 14.9185 15.0435 15.0435 k = 0.4844 0.5000 0.4941 ( 4608 PWs) bands (ev): -25.1080 -25.1080 -7.9698 -7.9698 -7.5098 -7.5098 -7.5087 -7.5087 -7.4783 -7.4783 -7.4762 -7.4762 -7.4523 -7.4523 -7.4365 -7.4365 -6.8429 -6.8429 -6.8427 -6.8427 -5.0280 -5.0280 -5.0169 -5.0169 -4.9483 -4.9483 -4.9419 -4.9419 -4.9082 -4.9082 -4.9053 -4.9053 -4.9022 -4.9022 -4.7990 -4.7990 -4.7971 -4.7971 2.5651 2.5651 2.5848 2.5848 2.5876 2.5876 6.5350 6.5350 7.5762 7.5762 7.6074 7.6074 8.2063 8.2063 12.6208 12.6208 14.8169 14.8169 14.8890 14.8890 14.9688 14.9688 15.0626 15.0626 k = 0.5000 0.5000 0.4941 ( 4632 PWs) bands (ev): -25.1080 -25.1080 -7.9698 -7.9698 -7.5098 -7.5098 -7.5088 -7.5088 -7.4783 -7.4783 -7.4762 -7.4762 -7.4522 -7.4522 -7.4364 -7.4364 -6.8430 -6.8430 -6.8428 -6.8428 -5.0281 -5.0281 -5.0170 -5.0170 -4.9484 -4.9484 -4.9419 -4.9419 -4.9082 -4.9082 -4.9054 -4.9054 -4.9022 -4.9022 -4.7989 -4.7989 -4.7970 -4.7970 2.5660 2.5660 2.5856 2.5856 2.5887 2.5887 6.5301 6.5301 7.5741 7.5741 7.6073 7.6073 8.2054 8.2054 12.6158 12.6158 14.8351 14.8351 14.8957 14.8957 15.0082 15.0082 15.0652 15.0652 k = 0.5000 0.5000 0.4941 ( 4632 PWs) bands (ev): -25.1080 -25.1080 -7.9698 -7.9698 -7.5098 -7.5098 -7.5088 -7.5088 -7.4783 -7.4783 -7.4762 -7.4762 -7.4522 -7.4522 -7.4364 -7.4364 -6.8430 -6.8430 -6.8428 -6.8428 -5.0281 -5.0281 -5.0170 -5.0170 -4.9484 -4.9484 -4.9419 -4.9419 -4.9082 -4.9082 -4.9054 -4.9054 -4.9022 -4.9022 -4.7989 -4.7989 -4.7970 -4.7970 2.5660 2.5660 2.5856 2.5856 2.5887 2.5887 6.5301 6.5301 7.5741 7.5741 7.6073 7.6073 8.2054 8.2054 12.6158 12.6158 14.8351 14.8351 14.8957 14.8957 15.0082 15.0082 15.0652 15.0652 k = 0.4889 0.4889 0.4941 ( 4616 PWs) bands (ev): -25.1080 -25.1080 -7.9698 -7.9698 -7.5098 -7.5098 -7.5087 -7.5087 -7.4783 -7.4783 -7.4762 -7.4762 -7.4523 -7.4523 -7.4365 -7.4365 -6.8429 -6.8429 -6.8427 -6.8427 -5.0280 -5.0280 -5.0169 -5.0169 -4.9483 -4.9483 -4.9419 -4.9419 -4.9082 -4.9082 -4.9053 -4.9053 -4.9022 -4.9022 -4.7990 -4.7990 -4.7971 -4.7971 2.5650 2.5650 2.5842 2.5842 2.5884 2.5884 6.5350 6.5350 7.5763 7.5763 7.6074 7.6074 8.2064 8.2064 12.6208 12.6208 14.8161 14.8161 14.8887 14.8887 14.9704 14.9704 15.0622 15.0622 k = 0.4778 0.4778 0.4941 ( 4594 PWs) bands (ev): -25.1080 -25.1080 -7.9699 -7.9699 -7.5098 -7.5098 -7.5087 -7.5087 -7.4783 -7.4783 -7.4762 -7.4762 -7.4525 -7.4525 -7.4368 -7.4368 -6.8427 -6.8427 -6.8424 -6.8424 -5.0277 -5.0277 -5.0166 -5.0166 -4.9482 -4.9482 -4.9418 -4.9418 -4.9082 -4.9082 -4.9053 -4.9053 -4.9021 -4.9021 -4.7993 -4.7993 -4.7974 -4.7974 2.5601 2.5601 2.5786 2.5786 2.5906 2.5906 6.5495 6.5495 7.5828 7.5828 7.6078 7.6078 8.2093 8.2093 12.6357 12.6357 14.7520 14.7520 14.8749 14.8749 14.9286 14.9286 15.0323 15.0323 k = 0.4667 0.4667 0.4941 ( 4598 PWs) bands (ev): -25.1080 -25.1080 -7.9702 -7.9702 -7.5097 -7.5097 -7.5087 -7.5087 -7.4783 -7.4783 -7.4763 -7.4763 -7.4527 -7.4527 -7.4374 -7.4374 -6.8425 -6.8425 -6.8417 -6.8417 -5.0273 -5.0273 -5.0161 -5.0161 -4.9480 -4.9480 -4.9417 -4.9417 -4.9082 -4.9082 -4.9052 -4.9052 -4.9019 -4.9019 -4.7998 -4.7998 -4.7978 -4.7978 2.5467 2.5467 2.5735 2.5735 2.5957 2.5957 6.5732 6.5732 7.5928 7.5928 7.6093 7.6093 8.2145 8.2145 12.6602 12.6602 14.6566 14.6566 14.8587 14.8587 14.8822 14.8822 14.9874 14.9874 k = 0.4556 0.4556 0.4941 ( 4590 PWs) bands (ev): -25.1080 -25.1080 -7.9705 -7.9705 -7.5096 -7.5096 -7.5086 -7.5086 -7.4783 -7.4783 -7.4763 -7.4763 -7.4531 -7.4531 -7.4381 -7.4381 -6.8423 -6.8423 -6.8406 -6.8406 -5.0267 -5.0267 -5.0155 -5.0155 -4.9477 -4.9477 -4.9416 -4.9416 -4.9082 -4.9082 -4.9051 -4.9051 -4.9016 -4.9016 -4.8005 -4.8005 -4.7985 -4.7985 2.5245 2.5245 2.5695 2.5695 2.6036 2.6036 6.6055 6.6055 7.6017 7.6017 7.6167 7.6167 8.2223 8.2223 12.6939 12.6939 14.5482 14.5482 14.8006 14.8006 14.8458 14.8458 14.9541 14.9541 k = 0.4444 0.4444 0.4941 ( 4578 PWs) bands (ev): -25.1080 -25.1080 -7.9709 -7.9709 -7.5095 -7.5095 -7.5084 -7.5084 -7.4782 -7.4782 -7.4763 -7.4763 -7.4536 -7.4536 -7.4390 -7.4390 -6.8420 -6.8420 -6.8394 -6.8394 -5.0259 -5.0259 -5.0146 -5.0146 -4.9474 -4.9474 -4.9414 -4.9414 -4.9083 -4.9083 -4.9049 -4.9049 -4.9012 -4.9012 -4.8014 -4.8014 -4.7993 -4.7993 2.4953 2.4953 2.5651 2.5651 2.6143 2.6143 6.6455 6.6455 7.6046 7.6046 7.6352 7.6352 8.2333 8.2333 12.7364 12.7364 14.4336 14.4336 14.7000 14.7000 14.8219 14.8219 14.9305 14.9305 k = 0.4333 0.4333 0.4941 ( 4582 PWs) bands (ev): -25.1080 -25.1080 -7.9713 -7.9713 -7.5094 -7.5094 -7.5082 -7.5082 -7.4782 -7.4782 -7.4763 -7.4763 -7.4543 -7.4543 -7.4401 -7.4401 -6.8417 -6.8417 -6.8379 -6.8379 -5.0249 -5.0249 -5.0136 -5.0136 -4.9470 -4.9470 -4.9413 -4.9413 -4.9086 -4.9086 -4.9046 -4.9046 -4.9007 -4.9007 -4.8025 -4.8025 -4.8002 -4.8002 2.4604 2.4604 2.5599 2.5599 2.6277 2.6277 6.6923 6.6923 7.6058 7.6058 7.6604 7.6604 8.2481 8.2481 12.7867 12.7867 14.3153 14.3153 14.5841 14.5841 14.7918 14.7918 14.9099 14.9099 k = 0.4222 0.4222 0.4941 ( 4574 PWs) bands (ev): -25.1080 -25.1080 -7.9719 -7.9719 -7.5094 -7.5094 -7.5078 -7.5078 -7.4782 -7.4782 -7.4764 -7.4764 -7.4551 -7.4551 -7.4412 -7.4412 -6.8412 -6.8412 -6.8361 -6.8361 -5.0239 -5.0239 -5.0124 -5.0124 -4.9466 -4.9466 -4.9410 -4.9410 -4.9089 -4.9089 -4.9043 -4.9043 -4.9000 -4.9000 -4.8039 -4.8039 -4.8012 -4.8012 2.4204 2.4204 2.5536 2.5536 2.6437 2.6437 6.7447 6.7447 7.6071 7.6071 7.6908 7.6908 8.2675 8.2675 12.8440 12.8440 14.1936 14.1936 14.4590 14.4590 14.7537 14.7537 14.8901 14.8901 k = 0.4111 0.4111 0.4941 ( 4570 PWs) bands (ev): -25.1081 -25.1081 -7.9725 -7.9725 -7.5094 -7.5094 -7.5074 -7.5074 -7.4783 -7.4783 -7.4763 -7.4763 -7.4560 -7.4560 -7.4424 -7.4424 -6.8408 -6.8408 -6.8342 -6.8342 -5.0227 -5.0227 -5.0110 -5.0110 -4.9461 -4.9461 -4.9407 -4.9407 -4.9093 -4.9093 -4.9038 -4.9038 -4.8992 -4.8992 -4.8054 -4.8054 -4.8024 -4.8024 2.3762 2.3762 2.5462 2.5462 2.6622 2.6622 6.8014 6.8014 7.6091 7.6091 7.7261 7.7261 8.2925 8.2925 12.9069 12.9069 14.0680 14.0680 14.3294 14.3294 14.7072 14.7072 14.8702 14.8702 k = 0.4000 0.4000 0.4941 ( 4562 PWs) bands (ev): -25.1081 -25.1081 -7.9731 -7.9731 -7.5095 -7.5095 -7.5070 -7.5070 -7.4783 -7.4783 -7.4763 -7.4763 -7.4571 -7.4571 -7.4436 -7.4436 -6.8402 -6.8402 -6.8321 -6.8321 -5.0214 -5.0214 -5.0095 -5.0095 -4.9458 -4.9458 -4.9404 -4.9404 -4.9098 -4.9098 -4.9033 -4.9033 -4.8982 -4.8982 -4.8071 -4.8071 -4.8037 -4.8037 2.3284 2.3284 2.5375 2.5375 2.6832 2.6832 6.8612 6.8612 7.6121 7.6121 7.7658 7.7658 8.3240 8.3240 12.9734 12.9734 13.9366 13.9366 14.2005 14.2005 14.6520 14.6520 14.8500 14.8500 k = 0.3889 0.3889 0.4941 ( 4554 PWs) bands (ev): -25.1081 -25.1081 -7.9738 -7.9738 -7.5095 -7.5095 -7.5065 -7.5065 -7.4784 -7.4784 -7.4763 -7.4763 -7.4584 -7.4584 -7.4448 -7.4448 -6.8396 -6.8396 -6.8299 -6.8299 -5.0200 -5.0200 -5.0078 -5.0078 -4.9454 -4.9454 -4.9401 -4.9401 -4.9104 -4.9104 -4.9026 -4.9026 -4.8971 -4.8971 -4.8090 -4.8090 -4.8051 -4.8051 2.2777 2.2777 2.5275 2.5275 2.7067 2.7067 6.9230 6.9230 7.6165 7.6165 7.8096 7.8096 8.3632 8.3632 13.0408 13.0408 13.7970 13.7970 14.0783 14.0783 14.5884 14.5884 14.8291 14.8291 k = 0.3778 0.3778 0.4941 ( 4542 PWs) bands (ev): -25.1081 -25.1081 -7.9745 -7.9745 -7.5096 -7.5096 -7.5059 -7.5059 -7.4786 -7.4786 -7.4762 -7.4762 -7.4597 -7.4597 -7.4460 -7.4460 -6.8390 -6.8390 -6.8275 -6.8275 -5.0186 -5.0186 -5.0060 -5.0060 -4.9452 -4.9452 -4.9396 -4.9396 -4.9109 -4.9109 -4.9019 -4.9019 -4.8958 -4.8958 -4.8110 -4.8110 -4.8066 -4.8066 2.2245 2.2245 2.5162 2.5162 2.7327 2.7327 6.9855 6.9855 7.6227 7.6227 7.8567 7.8567 8.4113 8.4113 13.1046 13.1046 13.6477 13.6477 13.9699 13.9699 14.5168 14.5168 14.8076 14.8076 k = 0.3667 0.3667 0.4941 ( 4538 PWs) bands (ev): -25.1081 -25.1081 -7.9753 -7.9753 -7.5097 -7.5097 -7.5053 -7.5053 -7.4789 -7.4789 -7.4761 -7.4761 -7.4613 -7.4613 -7.4471 -7.4471 -6.8383 -6.8383 -6.8251 -6.8251 -5.0171 -5.0171 -5.0041 -5.0041 -4.9451 -4.9451 -4.9392 -4.9392 -4.9115 -4.9115 -4.9010 -4.9010 -4.8945 -4.8945 -4.8131 -4.8131 -4.8082 -4.8082 2.1696 2.1696 2.5034 2.5034 2.7610 2.7610 7.0479 7.0479 7.6313 7.6313 7.9062 7.9062 8.4694 8.4694 13.1565 13.1565 13.4894 13.4894 13.8830 13.8830 14.4376 14.4376 14.7853 14.7853 k = 0.3556 0.3556 0.4941 ( 4544 PWs) bands (ev): -25.1082 -25.1082 -7.9760 -7.9760 -7.5099 -7.5099 -7.5047 -7.5047 -7.4792 -7.4792 -7.4760 -7.4760 -7.4629 -7.4629 -7.4482 -7.4482 -6.8375 -6.8375 -6.8226 -6.8226 -5.0156 -5.0156 -5.0020 -5.0020 -4.9452 -4.9452 -4.9387 -4.9387 -4.9121 -4.9121 -4.9001 -4.9001 -4.8930 -4.8930 -4.8154 -4.8154 -4.8099 -4.8099 2.1134 2.1134 2.4892 2.4892 2.7918 2.7918 7.1096 7.1096 7.6425 7.6425 7.9572 7.9572 8.5385 8.5385 13.1799 13.1799 13.3292 13.3292 13.8274 13.8274 14.3514 14.3514 14.7624 14.7624 k = 0.3444 0.3444 0.4941 ( 4544 PWs) bands (ev): -25.1082 -25.1082 -7.9768 -7.9768 -7.5100 -7.5100 -7.5041 -7.5041 -7.4795 -7.4795 -7.4759 -7.4759 -7.4645 -7.4645 -7.4492 -7.4492 -6.8367 -6.8367 -6.8200 -6.8200 -5.0141 -5.0141 -4.9999 -4.9999 -4.9454 -4.9454 -4.9381 -4.9381 -4.9126 -4.9126 -4.8990 -4.8990 -4.8914 -4.8914 -4.8177 -4.8177 -4.8117 -4.8117 2.0563 2.0563 2.4735 2.4735 2.8250 2.8250 7.1700 7.1700 7.6570 7.6570 8.0090 8.0090 8.6192 8.6192 13.1093 13.1093 13.2236 13.2236 13.8122 13.8122 14.2588 14.2588 14.7390 14.7390 k = 0.3333 0.3333 0.4941 ( 4544 PWs) bands (ev): -25.1082 -25.1082 -7.9775 -7.9775 -7.5101 -7.5101 -7.5034 -7.5034 -7.4800 -7.4800 -7.4758 -7.4758 -7.4662 -7.4662 -7.4501 -7.4501 -6.8359 -6.8359 -6.8175 -6.8175 -5.0126 -5.0126 -4.9978 -4.9978 -4.9457 -4.9457 -4.9376 -4.9376 -4.9131 -4.9131 -4.8979 -4.8979 -4.8898 -4.8898 -4.8201 -4.8201 -4.8136 -4.8136 1.9988 1.9988 2.4563 2.4563 2.8605 2.8605 7.2291 7.2291 7.6750 7.6750 8.0611 8.0611 8.7115 8.7115 12.9416 12.9416 13.1755 13.1755 13.8374 13.8374 14.1603 14.1603 14.7154 14.7154 k = 0.3222 0.3222 0.4941 ( 4536 PWs) bands (ev): -25.1083 -25.1083 -7.9782 -7.9782 -7.5103 -7.5103 -7.5028 -7.5028 -7.4805 -7.4805 -7.4757 -7.4757 -7.4678 -7.4678 -7.4510 -7.4510 -6.8350 -6.8350 -6.8150 -6.8150 -5.0111 -5.0111 -4.9956 -4.9956 -4.9462 -4.9462 -4.9370 -4.9370 -4.9135 -4.9135 -4.8967 -4.8967 -4.8879 -4.8879 -4.8225 -4.8225 -4.8155 -4.8155 1.9413 1.9413 2.4376 2.4376 2.8983 2.8983 7.2868 7.2868 7.6970 7.6970 8.1132 8.1132 8.8151 8.8151 12.7585 12.7585 13.1135 13.1135 13.8916 13.8916 14.0569 14.0569 14.6918 14.6918 k = 0.3111 0.3111 0.4941 ( 4536 PWs) bands (ev): -25.1083 -25.1083 -7.9789 -7.9789 -7.5105 -7.5105 -7.5021 -7.5021 -7.4811 -7.4811 -7.4756 -7.4756 -7.4693 -7.4693 -7.4518 -7.4518 -6.8341 -6.8341 -6.8125 -6.8125 -5.0097 -5.0097 -4.9934 -4.9934 -4.9468 -4.9468 -4.9363 -4.9363 -4.9139 -4.9139 -4.8954 -4.8954 -4.8860 -4.8860 -4.8250 -4.8250 -4.8174 -4.8174 1.8840 1.8840 2.4175 2.4175 2.9383 2.9383 7.3432 7.3432 7.7231 7.7231 8.1654 8.1654 8.9290 8.9290 12.5710 12.5710 13.0387 13.0387 13.9418 13.9418 13.9687 13.9687 14.6687 14.6687 k = 0.3000 0.3000 0.4941 ( 4536 PWs) bands (ev): -25.1083 -25.1083 -7.9796 -7.9796 -7.5107 -7.5107 -7.5014 -7.5014 -7.4818 -7.4818 -7.4756 -7.4756 -7.4707 -7.4707 -7.4525 -7.4525 -6.8332 -6.8332 -6.8101 -6.8101 -5.0083 -5.0083 -4.9913 -4.9913 -4.9476 -4.9476 -4.9357 -4.9357 -4.9141 -4.9141 -4.8943 -4.8943 -4.8839 -4.8839 -4.8274 -4.8274 -4.8194 -4.8194 1.8274 1.8274 2.3960 2.3960 2.9806 2.9806 7.3986 7.3986 7.7536 7.7536 8.2180 8.2180 9.0521 9.0521 12.3815 12.3815 12.9571 12.9571 13.8348 13.8348 14.0386 14.0386 14.6465 14.6465 k = 0.2889 0.2889 0.4941 ( 4532 PWs) bands (ev): -25.1084 -25.1084 -7.9802 -7.9802 -7.5109 -7.5109 -7.5007 -7.5007 -7.4826 -7.4826 -7.4756 -7.4756 -7.4719 -7.4719 -7.4532 -7.4532 -6.8322 -6.8322 -6.8078 -6.8078 -5.0071 -5.0071 -4.9893 -4.9893 -4.9485 -4.9485 -4.9350 -4.9350 -4.9143 -4.9143 -4.8932 -4.8932 -4.8816 -4.8816 -4.8299 -4.8299 -4.8213 -4.8213 1.7715 1.7715 2.3732 2.3732 3.0249 3.0249 7.4533 7.4533 7.7887 7.7887 8.2714 8.2714 9.1833 9.1833 12.1914 12.1914 12.8726 12.8726 13.7195 13.7195 14.1094 14.1094 14.6253 14.6253 k = 0.2778 0.2778 0.4941 ( 4532 PWs) bands (ev): -25.1084 -25.1084 -7.9807 -7.9807 -7.5112 -7.5112 -7.5001 -7.5001 -7.4835 -7.4835 -7.4758 -7.4758 -7.4728 -7.4728 -7.4539 -7.4539 -6.8312 -6.8312 -6.8055 -6.8055 -5.0059 -5.0059 -4.9873 -4.9873 -4.9493 -4.9493 -4.9342 -4.9342 -4.9145 -4.9145 -4.8922 -4.8922 -4.8792 -4.8792 -4.8324 -4.8324 -4.8231 -4.8231 1.7168 1.7168 2.3492 2.3492 3.0714 3.0714 7.5074 7.5074 7.8284 7.8284 8.3258 8.3258 9.3212 9.3212 12.0017 12.0017 12.7871 12.7871 13.6014 13.6014 14.1663 14.1663 14.6013 14.6013 k = 0.2667 0.2667 0.4941 ( 4536 PWs) bands (ev): -25.1085 -25.1085 -7.9812 -7.9812 -7.5114 -7.5114 -7.4995 -7.4995 -7.4844 -7.4844 -7.4762 -7.4762 -7.4734 -7.4734 -7.4545 -7.4545 -6.8302 -6.8302 -6.8034 -6.8034 -5.0048 -5.0048 -4.9856 -4.9856 -4.9502 -4.9502 -4.9335 -4.9335 -4.9146 -4.9146 -4.8914 -4.8914 -4.8766 -4.8766 -4.8349 -4.8349 -4.8248 -4.8248 1.6633 1.6633 2.3241 2.3241 3.1198 3.1198 7.5612 7.5612 7.8727 7.8727 8.3815 8.3815 9.4646 9.4646 11.8131 11.8131 12.7020 12.7020 13.4813 13.4813 14.1980 14.1980 14.5544 14.5544 k = 0.2556 0.2556 0.4941 ( 4532 PWs) bands (ev): -25.1085 -25.1085 -7.9816 -7.9816 -7.5117 -7.5117 -7.4989 -7.4989 -7.4854 -7.4854 -7.4767 -7.4767 -7.4737 -7.4737 -7.4550 -7.4550 -6.8292 -6.8292 -6.8013 -6.8013 -5.0038 -5.0038 -4.9840 -4.9840 -4.9511 -4.9511 -4.9327 -4.9327 -4.9146 -4.9146 -4.8908 -4.8908 -4.8739 -4.8739 -4.8374 -4.8374 -4.8264 -4.8264 1.6113 1.6113 2.2981 2.2981 3.1701 3.1701 7.6148 7.6148 7.9217 7.9217 8.4388 8.4388 9.6122 9.6122 11.6264 11.6264 12.6180 12.6180 13.3599 13.3599 14.1935 14.1935 14.4846 14.4846 k = 0.2444 0.2444 0.4941 ( 4528 PWs) bands (ev): -25.1085 -25.1085 -7.9820 -7.9820 -7.5120 -7.5120 -7.4983 -7.4983 -7.4864 -7.4864 -7.4772 -7.4772 -7.4739 -7.4739 -7.4555 -7.4555 -6.8282 -6.8282 -6.7994 -6.7994 -5.0029 -5.0029 -4.9828 -4.9828 -4.9517 -4.9517 -4.9318 -4.9318 -4.9145 -4.9145 -4.8904 -4.8904 -4.8711 -4.8711 -4.8400 -4.8400 -4.8277 -4.8277 1.5608 1.5608 2.2713 2.2713 3.2222 3.2222 7.6682 7.6682 7.9753 7.9753 8.4980 8.4980 9.7626 9.7626 11.4422 11.4422 12.5356 12.5356 13.2378 13.2378 14.1486 14.1486 14.4240 14.4240 k = 0.2333 0.2333 0.4941 ( 4528 PWs) bands (ev): -25.1086 -25.1086 -7.9823 -7.9823 -7.5122 -7.5122 -7.4978 -7.4978 -7.4873 -7.4873 -7.4778 -7.4778 -7.4739 -7.4739 -7.4560 -7.4560 -6.8272 -6.8272 -6.7977 -6.7977 -5.0022 -5.0022 -4.9818 -4.9818 -4.9522 -4.9522 -4.9309 -4.9309 -4.9145 -4.9145 -4.8903 -4.8903 -4.8683 -4.8683 -4.8425 -4.8425 -4.8287 -4.8287 1.5121 1.5121 2.2438 2.2438 3.2758 3.2758 7.7213 7.7213 8.0336 8.0336 8.5592 8.5592 9.9144 9.9144 11.2612 11.2612 12.4553 12.4553 13.1157 13.1157 14.0719 14.0719 14.3777 14.3777 k = 0.2222 0.2222 0.4941 ( 4530 PWs) bands (ev): -25.1086 -25.1086 -7.9825 -7.9825 -7.5125 -7.5125 -7.4974 -7.4974 -7.4882 -7.4882 -7.4782 -7.4782 -7.4740 -7.4740 -7.4564 -7.4564 -6.8262 -6.8262 -6.7960 -6.7960 -5.0017 -5.0017 -4.9812 -4.9812 -4.9524 -4.9524 -4.9300 -4.9300 -4.9143 -4.9143 -4.8904 -4.8904 -4.8655 -4.8655 -4.8451 -4.8451 -4.8295 -4.8295 1.4652 1.4652 2.2160 2.2160 3.3310 3.3310 7.7740 7.7740 8.0965 8.0965 8.6226 8.6226 10.0660 10.0660 11.0841 11.0841 12.3773 12.3773 12.9942 12.9942 13.9780 13.9780 14.3392 14.3392 k = 0.2111 0.2111 0.4941 ( 4542 PWs) bands (ev): -25.1087 -25.1087 -7.9827 -7.9827 -7.5129 -7.5129 -7.4972 -7.4972 -7.4889 -7.4889 -7.4786 -7.4786 -7.4740 -7.4740 -7.4568 -7.4568 -6.8253 -6.8253 -6.7945 -6.7945 -5.0012 -5.0012 -4.9810 -4.9810 -4.9524 -4.9524 -4.9290 -4.9290 -4.9142 -4.9142 -4.8907 -4.8907 -4.8628 -4.8628 -4.8476 -4.8476 -4.8298 -4.8298 1.4203 1.4203 2.1878 2.1878 3.3874 3.3874 7.8260 7.8260 8.1638 8.1638 8.6882 8.6882 10.2155 10.2155 10.9115 10.9115 12.3021 12.3021 12.8740 12.8740 13.8772 13.8772 14.3037 14.3037 k = 0.2000 0.2000 0.4941 ( 4534 PWs) bands (ev): -25.1087 -25.1087 -7.9828 -7.9828 -7.5132 -7.5132 -7.4970 -7.4970 -7.4895 -7.4895 -7.4789 -7.4789 -7.4740 -7.4740 -7.4572 -7.4572 -6.8244 -6.8244 -6.7931 -6.7931 -5.0010 -5.0010 -4.9810 -4.9810 -4.9520 -4.9520 -4.9280 -4.9280 -4.9140 -4.9140 -4.8913 -4.8913 -4.8602 -4.8602 -4.8501 -4.8501 -4.8297 -4.8297 1.3773 1.3773 2.1597 2.1597 3.4450 3.4450 7.8770 7.8770 8.2356 8.2356 8.7562 8.7562 10.3606 10.3606 10.7442 10.7442 12.2304 12.2304 12.7559 12.7559 13.7750 13.7750 14.2697 14.2697 k = 0.1889 0.1889 0.4941 ( 4534 PWs) bands (ev): -25.1088 -25.1088 -7.9828 -7.9828 -7.5135 -7.5135 -7.4970 -7.4970 -7.4900 -7.4900 -7.4791 -7.4791 -7.4739 -7.4739 -7.4576 -7.4576 -6.8235 -6.8235 -6.7918 -6.7918 -5.0009 -5.0009 -4.9813 -4.9813 -4.9514 -4.9514 -4.9271 -4.9271 -4.9138 -4.9138 -4.8922 -4.8922 -4.8579 -4.8579 -4.8526 -4.8526 -4.8292 -4.8292 1.3365 1.3365 2.1317 2.1317 3.5034 3.5034 7.9266 7.9266 8.3115 8.3115 8.8264 8.8264 10.4967 10.4967 10.5850 10.5850 12.1631 12.1631 12.6404 12.6404 13.6747 13.6747 14.2368 14.2368 k = 0.1778 0.1778 0.4941 ( 4536 PWs) bands (ev): -25.1088 -25.1088 -7.9828 -7.9828 -7.5139 -7.5139 -7.4972 -7.4972 -7.4903 -7.4903 -7.4791 -7.4791 -7.4739 -7.4739 -7.4579 -7.4579 -6.8226 -6.8226 -6.7907 -6.7907 -5.0010 -5.0010 -4.9818 -4.9818 -4.9506 -4.9506 -4.9261 -4.9261 -4.9136 -4.9136 -4.8933 -4.8933 -4.8566 -4.8566 -4.8542 -4.8542 -4.8283 -4.8283 1.2977 1.2977 2.1041 2.1041 3.5624 3.5624 7.9743 7.9743 8.3914 8.3914 8.8990 8.8990 10.4255 10.4255 10.6291 10.6291 12.1015 12.1015 12.5283 12.5283 13.5786 13.5786 14.2056 14.2056 k = 0.1667 0.1667 0.4941 ( 4528 PWs) bands (ev): -25.1088 -25.1088 -7.9828 -7.9828 -7.5142 -7.5142 -7.4974 -7.4974 -7.4906 -7.4906 -7.4790 -7.4790 -7.4739 -7.4739 -7.4582 -7.4582 -6.8218 -6.8218 -6.7896 -6.7896 -5.0012 -5.0012 -4.9823 -4.9823 -4.9497 -4.9497 -4.9252 -4.9252 -4.9133 -4.9133 -4.8946 -4.8946 -4.8581 -4.8581 -4.8532 -4.8532 -4.8270 -4.8270 1.2612 1.2612 2.0770 2.0770 3.6217 3.6217 8.0196 8.0196 8.4749 8.4749 8.9739 8.9739 10.2788 10.2788 10.7413 10.7413 12.0478 12.0478 12.4204 12.4204 13.4886 13.4886 14.1766 14.1766 k = 0.1556 0.1556 0.4941 ( 4538 PWs) bands (ev): -25.1089 -25.1089 -7.9827 -7.9827 -7.5146 -7.5146 -7.4978 -7.4978 -7.4907 -7.4907 -7.4788 -7.4788 -7.4738 -7.4738 -7.4585 -7.4585 -6.8211 -6.8211 -6.7887 -6.7887 -5.0016 -5.0016 -4.9829 -4.9829 -4.9486 -4.9486 -4.9243 -4.9243 -4.9131 -4.9131 -4.8960 -4.8960 -4.8603 -4.8603 -4.8517 -4.8517 -4.8253 -4.8253 1.2269 1.2269 2.0507 2.0507 3.6809 3.6809 8.0619 8.0619 8.5615 8.5615 9.0508 9.0508 10.1402 10.1402 10.8337 10.8337 12.0042 12.0042 12.3175 12.3175 13.4067 13.4067 14.1503 14.1503 k = 0.1444 0.1444 0.4941 ( 4538 PWs) bands (ev): -25.1089 -25.1089 -7.9825 -7.9825 -7.5150 -7.5150 -7.4982 -7.4982 -7.4909 -7.4909 -7.4784 -7.4784 -7.4738 -7.4738 -7.4589 -7.4589 -6.8204 -6.8204 -6.7879 -6.7879 -5.0022 -5.0022 -4.9833 -4.9833 -4.9475 -4.9475 -4.9234 -4.9234 -4.9129 -4.9129 -4.8976 -4.8976 -4.8625 -4.8625 -4.8503 -4.8503 -4.8234 -4.8234 1.1949 1.1949 2.0254 2.0254 3.7397 3.7397 8.1006 8.1006 8.6509 8.6509 9.1295 9.1295 10.0113 10.0113 10.9000 10.9000 11.9729 11.9729 12.2208 12.2208 13.3349 13.3349 14.1272 14.1272 k = 0.1333 0.1333 0.4941 ( 4542 PWs) bands (ev): -25.1090 -25.1090 -7.9824 -7.9824 -7.5154 -7.5154 -7.4986 -7.4986 -7.4910 -7.4910 -7.4779 -7.4779 -7.4738 -7.4738 -7.4592 -7.4592 -6.8198 -6.8198 -6.7871 -6.7871 -5.0029 -5.0029 -4.9837 -4.9837 -4.9464 -4.9464 -4.9226 -4.9226 -4.9127 -4.9127 -4.8993 -4.8993 -4.8646 -4.8646 -4.8491 -4.8491 -4.8212 -4.8212 1.1651 1.1651 2.0011 2.0011 3.7977 3.7977 8.1348 8.1348 8.7424 8.7424 9.2094 9.2094 9.8937 9.8937 10.9359 10.9359 11.9530 11.9530 12.1325 12.1325 13.2752 13.2752 14.1080 14.1080 k = 0.1222 0.1222 0.4941 ( 4538 PWs) bands (ev): -25.1090 -25.1090 -7.9822 -7.9822 -7.5158 -7.5158 -7.4990 -7.4990 -7.4912 -7.4912 -7.4772 -7.4772 -7.4737 -7.4737 -7.4596 -7.4596 -6.8193 -6.8193 -6.7865 -6.7865 -5.0037 -5.0037 -4.9840 -4.9840 -4.9452 -4.9452 -4.9219 -4.9219 -4.9126 -4.9126 -4.9010 -4.9010 -4.8666 -4.8666 -4.8480 -4.8480 -4.8190 -4.8190 1.1377 1.1377 1.9781 1.9781 3.8543 3.8543 8.1640 8.1640 8.8353 8.8353 9.2896 9.2896 9.7896 9.7896 10.9402 10.9402 11.9352 11.9352 12.0603 12.0603 13.2296 13.2296 14.0929 14.0929 k = 0.1111 0.1111 0.4941 ( 4544 PWs) bands (ev): -25.1090 -25.1090 -7.9820 -7.9820 -7.5161 -7.5161 -7.4994 -7.4994 -7.4913 -7.4913 -7.4765 -7.4765 -7.4736 -7.4736 -7.4600 -7.4600 -6.8188 -6.8188 -6.7859 -6.7859 -5.0046 -5.0046 -4.9842 -4.9842 -4.9441 -4.9441 -4.9213 -4.9213 -4.9125 -4.9125 -4.9026 -4.9026 -4.8685 -4.8685 -4.8470 -4.8470 -4.8168 -4.8168 1.1127 1.1127 1.9566 1.9566 3.9091 3.9091 8.1873 8.1873 8.9284 8.9284 9.3676 9.3676 9.7024 9.7024 10.9159 10.9159 11.8967 11.8967 12.0215 12.0215 13.1994 13.1994 14.0817 14.0817 k = 0.1000 0.1000 0.4941 ( 4536 PWs) bands (ev): -25.1090 -25.1090 -7.9818 -7.9818 -7.5165 -7.5165 -7.4997 -7.4997 -7.4915 -7.4915 -7.4756 -7.4756 -7.4736 -7.4736 -7.4604 -7.4604 -6.8183 -6.8183 -6.7854 -6.7854 -5.0056 -5.0056 -4.9843 -4.9843 -4.9430 -4.9430 -4.9207 -4.9207 -4.9126 -4.9126 -4.9042 -4.9042 -4.8702 -4.8702 -4.8461 -4.8461 -4.8146 -4.8146 1.0899 1.0899 1.9367 1.9367 3.9615 3.9615 8.2043 8.2043 9.0199 9.0199 9.4364 9.4364 9.6408 9.6408 10.8681 10.8681 11.8340 11.8340 12.0128 12.0128 13.1848 13.1848 14.0736 14.0736 k = 0.0889 0.0889 0.4941 ( 4540 PWs) bands (ev): -25.1091 -25.1091 -7.9816 -7.9816 -7.5169 -7.5169 -7.5000 -7.5000 -7.4917 -7.4917 -7.4747 -7.4747 -7.4735 -7.4735 -7.4608 -7.4608 -6.8180 -6.8180 -6.7849 -6.7849 -5.0065 -5.0065 -4.9843 -4.9843 -4.9420 -4.9420 -4.9202 -4.9202 -4.9129 -4.9129 -4.9055 -4.9055 -4.8718 -4.8718 -4.8454 -4.8454 -4.8125 -4.8125 1.0696 1.0696 1.9185 1.9185 4.0108 4.0108 8.2146 8.2146 9.1063 9.1063 9.4750 9.4750 9.6284 9.6284 10.8028 10.8028 11.7646 11.7646 12.0113 12.0113 13.1842 13.1842 14.0648 14.0648 k = 0.0778 0.0778 0.4941 ( 4540 PWs) bands (ev): -25.1091 -25.1091 -7.9814 -7.9814 -7.5172 -7.5172 -7.5003 -7.5003 -7.4919 -7.4919 -7.4738 -7.4738 -7.4734 -7.4734 -7.4613 -7.4613 -6.8176 -6.8176 -6.7846 -6.7846 -5.0074 -5.0074 -4.9842 -4.9842 -4.9411 -4.9411 -4.9197 -4.9197 -4.9134 -4.9134 -4.9066 -4.9066 -4.8732 -4.8732 -4.8447 -4.8447 -4.8106 -4.8106 1.0516 1.0516 1.9022 1.9022 4.0564 4.0564 8.2186 8.2186 9.1802 9.1802 9.4803 9.4803 9.6745 9.6745 10.7250 10.7250 11.6962 11.6962 12.0073 12.0073 13.1942 13.1942 14.0484 14.0484 k = 0.0667 0.0667 0.4941 ( 4540 PWs) bands (ev): -25.1091 -25.1091 -7.9812 -7.9812 -7.5175 -7.5175 -7.5005 -7.5005 -7.4921 -7.4921 -7.4735 -7.4735 -7.4727 -7.4727 -7.4619 -7.4619 -6.8174 -6.8174 -6.7842 -6.7842 -5.0082 -5.0082 -4.9841 -4.9841 -4.9402 -4.9402 -4.9193 -4.9193 -4.9141 -4.9141 -4.9074 -4.9074 -4.8744 -4.8744 -4.8441 -4.8441 -4.8089 -4.8089 1.0360 1.0360 1.8878 1.8878 4.0978 4.0978 8.2170 8.2170 9.2291 9.2291 9.4993 9.4993 9.7421 9.7421 10.6383 10.6383 11.6311 11.6311 11.9988 11.9988 13.2107 13.2107 14.0201 14.0201 k = 0.0556 0.0556 0.4941 ( 4540 PWs) bands (ev): -25.1091 -25.1091 -7.9810 -7.9810 -7.5178 -7.5178 -7.5007 -7.5007 -7.4922 -7.4922 -7.4734 -7.4734 -7.4717 -7.4717 -7.4625 -7.4625 -6.8172 -6.8172 -6.7840 -6.7840 -5.0089 -5.0089 -4.9840 -4.9840 -4.9395 -4.9395 -4.9191 -4.9191 -4.9149 -4.9149 -4.9078 -4.9078 -4.8754 -4.8754 -4.8436 -4.8436 -4.8074 -4.8074 1.0228 1.0228 1.8755 1.8755 4.1342 4.1342 8.2112 8.2112 9.2478 9.2478 9.5531 9.5531 9.8118 9.8118 10.5455 10.5455 11.5709 11.5709 11.9867 11.9867 13.2295 13.2295 13.9841 13.9841 k = 0.0444 0.0444 0.4941 ( 4536 PWs) bands (ev): -25.1092 -25.1092 -7.9809 -7.9809 -7.5181 -7.5181 -7.5009 -7.5009 -7.4924 -7.4924 -7.4733 -7.4733 -7.4707 -7.4707 -7.4631 -7.4631 -6.8170 -6.8170 -6.7838 -6.7838 -5.0095 -5.0095 -4.9839 -4.9839 -4.9389 -4.9389 -4.9189 -4.9189 -4.9157 -4.9157 -4.9081 -4.9081 -4.8763 -4.8763 -4.8432 -4.8432 -4.8061 -4.8061 1.0120 1.0120 1.8653 1.8653 4.1650 4.1650 8.2029 8.2029 9.2491 9.2491 9.6316 9.6316 9.8766 9.8766 10.4488 10.4488 11.5171 11.5171 11.9732 11.9732 13.2473 13.2473 13.9475 13.9475 k = 0.0333 0.0333 0.4941 ( 4536 PWs) bands (ev): -25.1092 -25.1092 -7.9807 -7.9807 -7.5183 -7.5183 -7.5010 -7.5010 -7.4925 -7.4925 -7.4733 -7.4733 -7.4698 -7.4698 -7.4637 -7.4637 -6.8169 -6.8169 -6.7836 -6.7836 -5.0100 -5.0100 -4.9837 -4.9837 -4.9384 -4.9384 -4.9188 -4.9188 -4.9163 -4.9163 -4.9083 -4.9083 -4.8769 -4.8769 -4.8428 -4.8428 -4.8051 -4.8051 1.0036 1.0036 1.8573 1.8573 4.1896 4.1896 8.1940 8.1940 9.2450 9.2450 9.7215 9.7215 9.9330 9.9330 10.3498 10.3498 11.4716 11.4716 11.9602 11.9602 13.2621 13.2621 13.9151 13.9151 k = 0.0222 0.0222 0.4941 ( 4538 PWs) bands (ev): -25.1092 -25.1092 -7.9807 -7.9807 -7.5184 -7.5184 -7.5011 -7.5011 -7.4925 -7.4925 -7.4733 -7.4733 -7.4689 -7.4689 -7.4644 -7.4644 -6.8168 -6.8168 -6.7835 -6.7835 -5.0104 -5.0104 -4.9836 -4.9836 -4.9380 -4.9380 -4.9188 -4.9188 -4.9168 -4.9168 -4.9084 -4.9084 -4.8774 -4.8774 -4.8426 -4.8426 -4.8044 -4.8044 0.9976 0.9976 1.8516 1.8516 4.2075 4.2075 8.1862 8.1862 9.2409 9.2409 9.8145 9.8145 9.9783 9.9783 10.2503 10.2503 11.4366 11.4366 11.9497 11.9497 13.2729 13.2729 13.8902 13.8902 k = 0.0111 0.0111 0.4941 ( 4542 PWs) bands (ev): -25.1092 -25.1092 -7.9806 -7.9806 -7.5185 -7.5185 -7.5011 -7.5011 -7.4926 -7.4926 -7.4733 -7.4733 -7.4682 -7.4682 -7.4650 -7.4650 -6.8168 -6.8168 -6.7834 -6.7834 -5.0106 -5.0106 -4.9835 -4.9835 -4.9378 -4.9378 -4.9189 -4.9189 -4.9170 -4.9170 -4.9085 -4.9085 -4.8777 -4.8777 -4.8424 -4.8424 -4.8039 -4.8039 0.9940 0.9940 1.8481 1.8481 4.2185 4.2185 8.1809 8.1809 9.2382 9.2382 9.9003 9.9003 10.0150 10.0150 10.1530 10.1530 11.4145 11.4145 11.9428 11.9428 13.2794 13.2794 13.8746 13.8746 k = 0.0000 0.0000 0.4941 ( 4548 PWs) bands (ev): -25.1092 -25.1092 -7.9806 -7.9806 -7.5185 -7.5185 -7.5011 -7.5011 -7.4926 -7.4926 -7.4733 -7.4733 -7.4679 -7.4679 -7.4652 -7.4652 -6.8167 -6.8167 -6.7834 -6.7834 -5.0107 -5.0107 -4.9835 -4.9835 -4.9377 -4.9377 -4.9189 -4.9189 -4.9171 -4.9171 -4.9085 -4.9085 -4.8778 -4.8778 -4.8424 -4.8424 -4.8038 -4.8038 0.9928 0.9928 1.8469 1.8469 4.2221 4.2221 8.1791 8.1791 9.2373 9.2373 9.9424 9.9424 10.0660 10.0660 10.0687 10.0687 11.4069 11.4069 11.9405 11.9405 13.2815 13.2815 13.8692 13.8692 k = 0.0000 0.5000-0.0000 ( 4544 PWs) bands (ev): -25.1091 -25.1091 -7.9824 -7.9824 -7.5133 -7.5133 -7.4993 -7.4993 -7.4907 -7.4907 -7.4813 -7.4813 -7.4743 -7.4743 -7.4636 -7.4636 -6.8145 -6.8145 -6.7829 -6.7829 -5.0015 -5.0015 -4.9764 -4.9764 -4.9315 -4.9315 -4.9275 -4.9275 -4.9243 -4.9243 -4.9176 -4.9176 -4.8758 -4.8758 -4.8397 -4.8397 -4.8032 -4.8032 1.0386 1.0386 1.8573 1.8573 4.1705 4.1705 8.1662 8.1662 9.2192 9.2192 9.8812 9.8812 10.0463 10.0463 10.0800 10.0800 11.3749 11.3749 11.9173 11.9173 13.1983 13.1983 13.8368 13.8368 k = 0.0000 0.5000 0.0154 ( 4542 PWs) bands (ev): -25.1091 -25.1091 -7.9824 -7.9824 -7.5133 -7.5133 -7.4993 -7.4993 -7.4907 -7.4907 -7.4813 -7.4813 -7.4743 -7.4743 -7.4635 -7.4635 -6.8145 -6.8145 -6.7829 -6.7829 -5.0015 -5.0015 -4.9765 -4.9765 -4.9316 -4.9316 -4.9275 -4.9275 -4.9242 -4.9242 -4.9175 -4.9175 -4.8757 -4.8757 -4.8398 -4.8398 -4.8033 -4.8033 1.0397 1.0397 1.8584 1.8584 4.1669 4.1669 8.1681 8.1681 9.2201 9.2201 9.8353 9.8353 10.0359 10.0359 10.1285 10.1285 11.3822 11.3822 11.9190 11.9190 13.1964 13.1964 13.8420 13.8420 k = 0.0000 0.5000 0.0309 ( 4542 PWs) bands (ev): -25.1091 -25.1091 -7.9825 -7.9825 -7.5132 -7.5132 -7.4992 -7.4992 -7.4907 -7.4907 -7.4813 -7.4813 -7.4746 -7.4746 -7.4634 -7.4634 -6.8146 -6.8146 -6.7830 -6.7830 -5.0013 -5.0013 -4.9766 -4.9766 -4.9321 -4.9321 -4.9274 -4.9274 -4.9240 -4.9240 -4.9172 -4.9172 -4.8755 -4.8755 -4.8399 -4.8399 -4.8037 -4.8037 1.0432 1.0432 1.8617 1.8617 4.1564 4.1564 8.1738 8.1738 9.2225 9.2225 9.7393 9.7393 10.0352 10.0352 10.2025 10.2025 11.4035 11.4035 11.9244 11.9244 13.1906 13.1906 13.8573 13.8573 k = 0.0000 0.5000 0.0463 ( 4532 PWs) bands (ev): -25.1090 -25.1090 -7.9825 -7.9825 -7.5131 -7.5131 -7.4991 -7.4991 -7.4907 -7.4907 -7.4812 -7.4812 -7.4749 -7.4749 -7.4632 -7.4632 -6.8147 -6.8147 -6.7831 -6.7831 -5.0009 -5.0009 -4.9768 -4.9768 -4.9328 -4.9328 -4.9272 -4.9272 -4.9236 -4.9236 -4.9166 -4.9166 -4.8751 -4.8751 -4.8401 -4.8401 -4.8044 -4.8044 1.0489 1.0489 1.8671 1.8671 4.1389 4.1389 8.1830 8.1830 9.2254 9.2254 9.6284 9.6284 10.0403 10.0403 10.2718 10.2718 11.4372 11.4372 11.9347 11.9347 13.1809 13.1809 13.8826 13.8826 k = 0.0000 0.5000 0.0618 ( 4534 PWs) bands (ev): -25.1090 -25.1090 -7.9826 -7.9826 -7.5129 -7.5129 -7.4990 -7.4990 -7.4906 -7.4906 -7.4812 -7.4812 -7.4754 -7.4754 -7.4629 -7.4629 -6.8149 -6.8149 -6.7832 -6.7832 -5.0005 -5.0005 -4.9771 -4.9771 -4.9336 -4.9336 -4.9270 -4.9270 -4.9231 -4.9231 -4.9160 -4.9160 -4.8747 -4.8747 -4.8404 -4.8404 -4.8053 -4.8053 1.0569 1.0569 1.8747 1.8747 4.1148 4.1148 8.1955 8.1955 9.2257 9.2257 9.5157 9.5157 10.0488 10.0488 10.3301 10.3301 11.4801 11.4801 11.9520 11.9520 13.1673 13.1673 13.9169 13.9169 k = 0.0000 0.5000 0.0772 ( 4534 PWs) bands (ev): -25.1090 -25.1090 -7.9827 -7.9827 -7.5128 -7.5128 -7.4989 -7.4989 -7.4906 -7.4906 -7.4811 -7.4811 -7.4759 -7.4759 -7.4626 -7.4626 -6.8152 -6.8152 -6.7833 -6.7833 -4.9999 -4.9999 -4.9774 -4.9774 -4.9346 -4.9346 -4.9267 -4.9267 -4.9226 -4.9226 -4.9152 -4.9152 -4.8741 -4.8741 -4.8408 -4.8408 -4.8065 -4.8065 1.0672 1.0672 1.8844 1.8844 4.0842 4.0842 8.2108 8.2108 9.2131 9.2131 9.4152 9.4152 10.0601 10.0601 10.3758 10.3758 11.5269 11.5269 11.9796 11.9796 13.1500 13.1500 13.9585 13.9585 k = 0.0000 0.5000 0.0926 ( 4550 PWs) bands (ev): -25.1090 -25.1090 -7.9829 -7.9829 -7.5126 -7.5126 -7.4987 -7.4987 -7.4905 -7.4905 -7.4810 -7.4810 -7.4765 -7.4765 -7.4623 -7.4623 -6.8155 -6.8155 -6.7835 -6.7835 -4.9993 -4.9993 -4.9778 -4.9778 -4.9356 -4.9356 -4.9264 -4.9264 -4.9220 -4.9220 -4.9144 -4.9144 -4.8733 -4.8733 -4.8413 -4.8413 -4.8080 -4.8080 1.0798 1.0798 1.8961 1.8961 4.0476 4.0476 8.2283 8.2283 9.1618 9.1618 9.3554 9.3554 10.0739 10.0739 10.4095 10.4095 11.5712 11.5712 12.0211 12.0211 13.1288 13.1288 14.0007 14.0007 k = 0.0000 0.5000 0.1081 ( 4558 PWs) bands (ev): -25.1090 -25.1090 -7.9831 -7.9831 -7.5124 -7.5124 -7.4985 -7.4985 -7.4905 -7.4905 -7.4810 -7.4810 -7.4770 -7.4770 -7.4620 -7.4620 -6.8159 -6.8159 -6.7836 -6.7836 -4.9985 -4.9985 -4.9781 -4.9781 -4.9367 -4.9367 -4.9261 -4.9261 -4.9214 -4.9214 -4.9136 -4.9136 -4.8725 -4.8725 -4.8418 -4.8418 -4.8097 -4.8097 1.0947 1.0947 1.9098 1.9098 4.0053 4.0053 8.2467 8.2467 9.0673 9.0673 9.3429 9.3429 10.0898 10.0898 10.4324 10.4324 11.6071 11.6071 12.0792 12.0792 13.1036 13.1036 14.0142 14.0142 k = 0.0000 0.5000 0.1235 ( 4542 PWs) bands (ev): -25.1090 -25.1090 -7.9832 -7.9832 -7.5122 -7.5122 -7.4983 -7.4983 -7.4904 -7.4904 -7.4809 -7.4809 -7.4776 -7.4776 -7.4618 -7.4618 -6.8164 -6.8164 -6.7837 -6.7837 -4.9976 -4.9976 -4.9785 -4.9785 -4.9378 -4.9378 -4.9257 -4.9257 -4.9208 -4.9208 -4.9128 -4.9128 -4.8715 -4.8715 -4.8423 -4.8423 -4.8116 -4.8116 1.1119 1.1119 1.9253 1.9253 3.9578 3.9578 8.2643 8.2643 8.9579 8.9579 9.3519 9.3519 10.1076 10.1076 10.4463 10.4463 11.6316 11.6316 12.1536 12.1536 13.0742 13.0742 13.9970 13.9970 k = 0.0000 0.5000 0.1390 ( 4544 PWs) bands (ev): -25.1090 -25.1090 -7.9834 -7.9834 -7.5120 -7.5120 -7.4980 -7.4980 -7.4903 -7.4903 -7.4808 -7.4808 -7.4782 -7.4782 -7.4616 -7.4616 -6.8171 -6.8171 -6.7838 -6.7838 -4.9966 -4.9966 -4.9788 -4.9788 -4.9388 -4.9388 -4.9253 -4.9253 -4.9202 -4.9202 -4.9120 -4.9120 -4.8704 -4.8704 -4.8429 -4.8429 -4.8137 -4.8137 1.1313 1.1313 1.9426 1.9426 3.9055 3.9055 8.2777 8.2777 8.8503 8.8503 9.3695 9.3695 10.1270 10.1270 10.4531 10.4531 11.6447 11.6447 12.2410 12.2410 13.0403 13.0403 13.9774 13.9774 k = 0.0000 0.5000 0.1544 ( 4544 PWs) bands (ev): -25.1089 -25.1089 -7.9837 -7.9837 -7.5119 -7.5119 -7.4976 -7.4976 -7.4901 -7.4901 -7.4807 -7.4807 -7.4786 -7.4786 -7.4615 -7.4615 -6.8178 -6.8178 -6.7838 -6.7838 -4.9955 -4.9955 -4.9790 -4.9790 -4.9398 -4.9398 -4.9248 -4.9248 -4.9197 -4.9197 -4.9112 -4.9112 -4.8692 -4.8692 -4.8435 -4.8435 -4.8161 -4.8161 1.1529 1.1529 1.9616 1.9616 3.8489 3.8489 8.2806 8.2806 8.7549 8.7549 9.3920 9.3920 10.1475 10.1475 10.4546 10.4546 11.6478 11.6478 12.3364 12.3364 13.0020 13.0020 13.9636 13.9636 k = 0.0000 0.5000 0.1699 ( 4544 PWs) bands (ev): -25.1089 -25.1089 -7.9839 -7.9839 -7.5118 -7.5118 -7.4973 -7.4973 -7.4900 -7.4900 -7.4807 -7.4807 -7.4790 -7.4790 -7.4614 -7.4614 -6.8186 -6.8186 -6.7838 -6.7838 -4.9943 -4.9943 -4.9791 -4.9791 -4.9408 -4.9408 -4.9244 -4.9244 -4.9192 -4.9192 -4.9106 -4.9106 -4.8680 -4.8680 -4.8442 -4.8442 -4.8186 -4.8186 1.1768 1.1768 1.9822 1.9822 3.7883 3.7883 8.2629 8.2629 8.6834 8.6834 9.4176 9.4176 10.1684 10.1684 10.4525 10.4525 11.6426 11.6426 12.4345 12.4345 12.9601 12.9601 13.9593 13.9593 k = 0.0000 0.5000 0.1853 ( 4544 PWs) bands (ev): -25.1089 -25.1089 -7.9842 -7.9842 -7.5117 -7.5117 -7.4968 -7.4968 -7.4898 -7.4898 -7.4806 -7.4806 -7.4793 -7.4793 -7.4614 -7.4614 -6.8195 -6.8195 -6.7837 -6.7837 -4.9931 -4.9931 -4.9791 -4.9791 -4.9417 -4.9417 -4.9238 -4.9238 -4.9189 -4.9189 -4.9100 -4.9100 -4.8666 -4.8666 -4.8448 -4.8448 -4.8213 -4.8213 1.2029 1.2029 2.0041 2.0041 3.7244 3.7244 8.2155 8.2155 8.6459 8.6459 9.4458 9.4458 10.1888 10.1888 10.4486 10.4486 11.6306 11.6306 12.5284 12.5284 12.9180 12.9180 13.9666 13.9666 k = 0.0000 0.5000 0.2007 ( 4532 PWs) bands (ev): -25.1089 -25.1089 -7.9844 -7.9844 -7.5118 -7.5118 -7.4963 -7.4963 -7.4896 -7.4896 -7.4806 -7.4806 -7.4794 -7.4794 -7.4614 -7.4614 -6.8206 -6.8206 -6.7836 -6.7836 -4.9919 -4.9919 -4.9790 -4.9790 -4.9426 -4.9426 -4.9233 -4.9233 -4.9187 -4.9187 -4.9094 -4.9094 -4.8652 -4.8652 -4.8456 -4.8456 -4.8241 -4.8241 1.2313 1.2313 2.0273 2.0273 3.6576 3.6576 8.1404 8.1404 8.6408 8.6408 9.4760 9.4760 10.2075 10.2075 10.4448 10.4448 11.6128 11.6128 12.6051 12.6051 12.8863 12.8863 13.9866 13.9866 k = 0.0000 0.5000 0.2162 ( 4536 PWs) bands (ev): -25.1088 -25.1088 -7.9847 -7.9847 -7.5119 -7.5119 -7.4958 -7.4958 -7.4895 -7.4895 -7.4806 -7.4806 -7.4794 -7.4794 -7.4616 -7.4616 -6.8217 -6.8217 -6.7834 -6.7834 -4.9907 -4.9907 -4.9787 -4.9787 -4.9434 -4.9434 -4.9227 -4.9227 -4.9185 -4.9185 -4.9090 -4.9090 -4.8637 -4.8637 -4.8463 -4.8463 -4.8269 -4.8269 1.2618 1.2618 2.0515 2.0515 3.5882 3.5882 8.0483 8.0483 8.6578 8.6578 9.5079 9.5079 10.2231 10.2231 10.4429 10.4429 11.5903 11.5903 12.6370 12.6370 12.8914 12.8914 14.0197 14.0197 k = 0.0000 0.5000 0.2316 ( 4546 PWs) bands (ev): -25.1088 -25.1088 -7.9850 -7.9850 -7.5120 -7.5120 -7.4952 -7.4952 -7.4895 -7.4895 -7.4806 -7.4806 -7.4793 -7.4793 -7.4618 -7.4618 -6.8229 -6.8229 -6.7832 -6.7832 -4.9895 -4.9895 -4.9781 -4.9781 -4.9440 -4.9440 -4.9221 -4.9221 -4.9185 -4.9185 -4.9087 -4.9087 -4.8623 -4.8623 -4.8472 -4.8472 -4.8298 -4.8298 1.2945 1.2945 2.0767 2.0767 3.5166 3.5166 7.9485 7.9485 8.6877 8.6877 9.5412 9.5412 10.2343 10.2343 10.4445 10.4445 11.5642 11.5642 12.6110 12.6110 12.9458 12.9458 14.0654 14.0654 k = 0.0000 0.5000 0.2471 ( 4536 PWs) bands (ev): -25.1088 -25.1088 -7.9853 -7.9853 -7.5122 -7.5122 -7.4946 -7.4946 -7.4894 -7.4894 -7.4804 -7.4804 -7.4792 -7.4792 -7.4620 -7.4620 -6.8242 -6.8242 -6.7829 -6.7829 -4.9883 -4.9883 -4.9774 -4.9774 -4.9446 -4.9446 -4.9215 -4.9215 -4.9185 -4.9185 -4.9085 -4.9085 -4.8607 -4.8607 -4.8482 -4.8482 -4.8326 -4.8326 1.3293 1.3293 2.1025 2.1025 3.4434 3.4434 7.8465 7.8465 8.7253 8.7253 9.5755 9.5755 10.2404 10.2404 10.4502 10.4502 11.5356 11.5356 12.5528 12.5528 13.0237 13.0237 14.1228 14.1228 k = 0.0000 0.5000 0.2625 ( 4544 PWs) bands (ev): -25.1087 -25.1087 -7.9856 -7.9856 -7.5125 -7.5125 -7.4939 -7.4939 -7.4895 -7.4895 -7.4802 -7.4802 -7.4790 -7.4790 -7.4624 -7.4624 -6.8255 -6.8255 -6.7825 -6.7825 -4.9873 -4.9873 -4.9765 -4.9765 -4.9450 -4.9450 -4.9211 -4.9211 -4.9185 -4.9185 -4.9085 -4.9085 -4.8592 -4.8592 -4.8495 -4.8495 -4.8351 -4.8351 1.3662 1.3662 2.1287 2.1287 3.3688 3.3688 7.7452 7.7452 8.7678 8.7678 9.6105 9.6105 10.2418 10.2418 10.4595 10.4595 11.5060 11.5060 12.4812 12.4812 13.1070 13.1070 14.1905 14.1905 k = 0.0000 0.5000 0.2779 ( 4552 PWs) bands (ev): -25.1087 -25.1087 -7.9858 -7.9858 -7.5128 -7.5128 -7.4932 -7.4932 -7.4895 -7.4895 -7.4799 -7.4799 -7.4788 -7.4788 -7.4628 -7.4628 -6.8268 -6.8268 -6.7822 -6.7822 -4.9863 -4.9863 -4.9753 -4.9753 -4.9453 -4.9453 -4.9209 -4.9209 -4.9183 -4.9183 -4.9085 -4.9085 -4.8577 -4.8577 -4.8511 -4.8511 -4.8373 -4.8373 1.4052 1.4052 2.1552 2.1552 3.2933 3.2933 7.6463 7.6463 8.8135 8.8135 9.6460 9.6460 10.2398 10.2398 10.4704 10.4704 11.4768 11.4768 12.4032 12.4032 13.1891 13.1891 14.2666 14.2666 k = 0.0000 0.5000 0.2934 ( 4536 PWs) bands (ev): -25.1087 -25.1087 -7.9861 -7.9861 -7.5131 -7.5131 -7.4924 -7.4924 -7.4896 -7.4896 -7.4795 -7.4795 -7.4786 -7.4786 -7.4633 -7.4633 -6.8282 -6.8282 -6.7818 -6.7818 -4.9854 -4.9854 -4.9740 -4.9740 -4.9454 -4.9454 -4.9211 -4.9211 -4.9178 -4.9178 -4.9087 -4.9087 -4.8563 -4.8563 -4.8533 -4.8533 -4.8390 -4.8390 1.4462 1.4462 2.1816 2.1816 3.2171 3.2171 7.5511 7.5511 8.8614 8.8614 9.6815 9.6815 10.2363 10.2363 10.4806 10.4806 11.4498 11.4498 12.3220 12.3220 13.2676 13.2676 14.3491 14.3491 k = 0.0000 0.5000 0.3088 ( 4534 PWs) bands (ev): -25.1087 -25.1087 -7.9864 -7.9864 -7.5134 -7.5134 -7.4917 -7.4917 -7.4897 -7.4897 -7.4792 -7.4792 -7.4782 -7.4782 -7.4638 -7.4638 -6.8295 -6.8295 -6.7813 -6.7813 -4.9846 -4.9846 -4.9726 -4.9726 -4.9454 -4.9454 -4.9217 -4.9217 -4.9171 -4.9171 -4.9090 -4.9090 -4.8561 -4.8561 -4.8547 -4.8547 -4.8402 -4.8402 1.4891 1.4891 2.2077 2.2077 3.1406 3.1406 7.4604 7.4604 8.9105 8.9105 9.7166 9.7166 10.2330 10.2330 10.4877 10.4877 11.4265 11.4265 12.2397 12.2397 13.3412 13.3412 14.4299 14.4299 k = 0.0000 0.5000 0.3243 ( 4550 PWs) bands (ev): -25.1086 -25.1086 -7.9867 -7.9867 -7.5138 -7.5138 -7.4912 -7.4912 -7.4896 -7.4896 -7.4789 -7.4789 -7.4777 -7.4777 -7.4644 -7.4644 -6.8308 -6.8308 -6.7809 -6.7809 -4.9839 -4.9839 -4.9712 -4.9712 -4.9450 -4.9450 -4.9223 -4.9223 -4.9162 -4.9162 -4.9095 -4.9095 -4.8591 -4.8591 -4.8535 -4.8535 -4.8410 -4.8410 1.5338 1.5338 2.2332 2.2332 3.0642 3.0642 7.3747 7.3747 8.9603 8.9603 9.7511 9.7511 10.2310 10.2310 10.4895 10.4895 11.4085 11.4085 12.1575 12.1575 13.4096 13.4096 14.3652 14.3652 k = 0.0000 0.5000 0.3397 ( 4550 PWs) bands (ev): -25.1086 -25.1086 -7.9869 -7.9869 -7.5141 -7.5141 -7.4910 -7.4910 -7.4891 -7.4891 -7.4787 -7.4787 -7.4772 -7.4772 -7.4650 -7.4650 -6.8321 -6.8321 -6.7805 -6.7805 -4.9831 -4.9831 -4.9698 -4.9698 -4.9445 -4.9445 -4.9231 -4.9231 -4.9153 -4.9153 -4.9100 -4.9100 -4.8624 -4.8624 -4.8522 -4.8522 -4.8415 -4.8415 1.5803 1.5803 2.2579 2.2579 2.9881 2.9881 7.2946 7.2946 9.0100 9.0100 9.7844 9.7844 10.2316 10.2316 10.4845 10.4845 11.3968 11.3968 12.0767 12.0767 13.4722 13.4722 14.2928 14.2928 k = 0.0000 0.5000 0.3552 ( 4548 PWs) bands (ev): -25.1086 -25.1086 -7.9871 -7.9871 -7.5145 -7.5145 -7.4910 -7.4910 -7.4884 -7.4884 -7.4785 -7.4785 -7.4766 -7.4766 -7.4657 -7.4657 -6.8333 -6.8333 -6.7801 -6.7801 -4.9824 -4.9824 -4.9685 -4.9685 -4.9436 -4.9436 -4.9240 -4.9240 -4.9143 -4.9143 -4.9107 -4.9107 -4.8658 -4.8658 -4.8510 -4.8510 -4.8417 -4.8417 1.6283 1.6283 2.2814 2.2814 2.9127 2.9127 7.2207 7.2207 9.0589 9.0589 9.8165 9.8165 10.2354 10.2354 10.4718 10.4718 11.3920 11.3920 11.9983 11.9983 13.5290 13.5290 14.2189 14.2189 k = 0.0000 0.5000 0.3706 ( 4544 PWs) bands (ev): -25.1086 -25.1086 -7.9874 -7.9874 -7.5148 -7.5148 -7.4911 -7.4911 -7.4877 -7.4877 -7.4784 -7.4784 -7.4760 -7.4760 -7.4664 -7.4664 -6.8344 -6.8344 -6.7797 -6.7797 -4.9817 -4.9817 -4.9673 -4.9673 -4.9424 -4.9424 -4.9249 -4.9249 -4.9135 -4.9135 -4.9112 -4.9112 -4.8693 -4.8693 -4.8500 -4.8500 -4.8418 -4.8418 1.6777 1.6777 2.3034 2.3034 2.8384 2.8384 7.1532 7.1532 9.1062 9.1062 9.8473 9.8473 10.2428 10.2428 10.4511 10.4511 11.3939 11.3939 11.9234 11.9234 13.5796 13.5796 14.1461 14.1461 k = 0.0000 0.5000 0.3860 ( 4540 PWs) bands (ev): -25.1086 -25.1086 -7.9876 -7.9876 -7.5151 -7.5151 -7.4913 -7.4913 -7.4868 -7.4868 -7.4783 -7.4783 -7.4755 -7.4755 -7.4671 -7.4671 -6.8355 -6.8355 -6.7794 -6.7794 -4.9811 -4.9811 -4.9663 -4.9663 -4.9409 -4.9409 -4.9258 -4.9258 -4.9134 -4.9134 -4.9112 -4.9112 -4.8728 -4.8728 -4.8490 -4.8490 -4.8418 -4.8418 1.7281 1.7281 2.3237 2.3237 2.7656 2.7656 7.0927 7.0927 9.1512 9.1512 9.8771 9.8771 10.2534 10.2534 10.4231 10.4231 11.4014 11.4014 11.8530 11.8530 13.6239 13.6239 14.0766 14.0766 k = 0.0000 0.5000 0.4015 ( 4532 PWs) bands (ev): -25.1085 -25.1085 -7.9877 -7.9877 -7.5154 -7.5154 -7.4914 -7.4914 -7.4860 -7.4860 -7.4782 -7.4782 -7.4750 -7.4750 -7.4678 -7.4678 -6.8364 -6.8364 -6.7791 -6.7791 -4.9805 -4.9805 -4.9655 -4.9655 -4.9392 -4.9392 -4.9266 -4.9266 -4.9142 -4.9142 -4.9103 -4.9103 -4.8762 -4.8762 -4.8482 -4.8482 -4.8417 -4.8417 1.7792 1.7792 2.3419 2.3419 2.6949 2.6949 7.0395 7.0395 9.1928 9.1928 9.9065 9.9065 10.2668 10.2668 10.3889 10.3889 11.4129 11.4129 11.7885 11.7885 13.6615 13.6615 14.0127 14.0127 k = 0.0000 0.5000 0.4169 ( 4528 PWs) bands (ev): -25.1085 -25.1085 -7.9879 -7.9879 -7.5156 -7.5156 -7.4915 -7.4915 -7.4852 -7.4852 -7.4781 -7.4781 -7.4746 -7.4746 -7.4684 -7.4684 -6.8372 -6.8372 -6.7788 -6.7788 -4.9799 -4.9799 -4.9648 -4.9648 -4.9372 -4.9372 -4.9274 -4.9274 -4.9154 -4.9154 -4.9092 -4.9092 -4.8794 -4.8794 -4.8475 -4.8475 -4.8416 -4.8416 1.8302 1.8302 2.3578 2.3578 2.6272 2.6272 6.9938 6.9938 9.2302 9.2302 9.9362 9.9362 10.2815 10.2815 10.3501 10.3501 11.4265 11.4265 11.7311 11.7311 13.6916 13.6916 13.9569 13.9569 k = 0.0000 0.5000 0.4324 ( 4532 PWs) bands (ev): -25.1085 -25.1085 -7.9880 -7.9880 -7.5158 -7.5158 -7.4916 -7.4916 -7.4845 -7.4845 -7.4781 -7.4781 -7.4742 -7.4742 -7.4690 -7.4690 -6.8378 -6.8378 -6.7786 -6.7786 -4.9795 -4.9795 -4.9643 -4.9643 -4.9351 -4.9351 -4.9281 -4.9281 -4.9168 -4.9168 -4.9080 -4.9080 -4.8824 -4.8824 -4.8469 -4.8469 -4.8415 -4.8415 1.8799 1.8799 2.3712 2.3712 2.5637 2.5637 6.9561 6.9561 9.2623 9.2623 9.9672 9.9672 10.2920 10.2920 10.3125 10.3125 11.4402 11.4402 11.6821 11.6821 13.7133 13.7133 13.9116 13.9116 k = 0.0000 0.5000 0.4478 ( 4524 PWs) bands (ev): -25.1085 -25.1085 -7.9881 -7.9881 -7.5160 -7.5160 -7.4917 -7.4917 -7.4839 -7.4839 -7.4780 -7.4780 -7.4740 -7.4740 -7.4695 -7.4695 -6.8384 -6.8384 -6.7784 -6.7784 -4.9791 -4.9791 -4.9640 -4.9640 -4.9330 -4.9330 -4.9286 -4.9286 -4.9183 -4.9183 -4.9069 -4.9069 -4.8850 -4.8850 -4.8465 -4.8465 -4.8413 -4.8413 1.9265 1.9265 2.3817 2.3817 2.5064 2.5064 6.9264 6.9264 9.2882 9.2882 10.0001 10.0001 10.2596 10.2596 10.3147 10.3147 11.4521 11.4521 11.6430 11.6430 13.7255 13.7255 13.8793 13.8793 k = 0.0000 0.5000 0.4632 ( 4528 PWs) bands (ev): -25.1085 -25.1085 -7.9882 -7.9882 -7.5161 -7.5161 -7.4918 -7.4918 -7.4834 -7.4834 -7.4780 -7.4780 -7.4738 -7.4738 -7.4699 -7.4699 -6.8388 -6.8388 -6.7782 -6.7782 -4.9788 -4.9788 -4.9637 -4.9637 -4.9311 -4.9311 -4.9289 -4.9289 -4.9199 -4.9199 -4.9058 -4.9058 -4.8871 -4.8871 -4.8462 -4.8462 -4.8412 -4.8412 1.9666 1.9666 2.3892 2.3892 2.4588 2.4588 6.9051 6.9051 9.3073 9.3073 10.0350 10.0350 10.2157 10.2157 10.3255 10.3255 11.4608 11.4608 11.6151 11.6151 13.7289 13.7289 13.8607 13.8607 k = 0.0000 0.5000 0.4787 ( 4536 PWs) bands (ev): -25.1085 -25.1085 -7.9882 -7.9882 -7.5161 -7.5161 -7.4919 -7.4919 -7.4830 -7.4830 -7.4780 -7.4780 -7.4737 -7.4737 -7.4701 -7.4701 -6.8390 -6.8390 -6.7781 -6.7781 -4.9786 -4.9786 -4.9636 -4.9636 -4.9301 -4.9301 -4.9284 -4.9284 -4.9214 -4.9214 -4.9051 -4.9051 -4.8885 -4.8885 -4.8460 -4.8460 -4.8412 -4.8412 1.9951 1.9951 2.3931 2.3931 2.4264 2.4264 6.8923 6.8923 9.3190 9.3190 10.0704 10.0704 10.1742 10.1742 10.3329 10.3329 11.4656 11.4656 11.5986 11.5986 13.7274 13.7274 13.8527 13.8527 k = 0.0000 0.5000 0.4941 ( 4532 PWs) bands (ev): -25.1085 -25.1085 -7.9882 -7.9882 -7.5162 -7.5162 -7.4919 -7.4919 -7.4829 -7.4829 -7.4780 -7.4780 -7.4737 -7.4737 -7.4702 -7.4702 -6.8391 -6.8391 -6.7781 -6.7781 -4.9786 -4.9786 -4.9635 -4.9635 -4.9300 -4.9300 -4.9278 -4.9278 -4.9220 -4.9220 -4.9048 -4.9048 -4.8890 -4.8890 -4.8459 -4.8459 -4.8411 -4.8411 2.0056 2.0056 2.3937 2.3937 2.4153 2.4153 6.8880 6.8880 9.3229 9.3229 10.0924 10.0924 10.1499 10.1499 10.3355 10.3355 11.4671 11.4671 11.5933 11.5933 13.7262 13.7262 13.8506 13.8506 k = 0.5000 0.5000-0.0000 ( 4540 PWs) bands (ev): -25.1084 -25.1084 -7.9880 -7.9880 -7.5192 -7.5192 -7.4968 -7.4968 -7.4802 -7.4802 -7.4798 -7.4798 -7.4748 -7.4748 -7.4608 -7.4608 -6.8395 -6.8395 -6.7805 -6.7805 -4.9855 -4.9855 -4.9715 -4.9715 -4.9250 -4.9250 -4.9217 -4.9217 -4.9201 -4.9201 -4.8950 -4.8950 -4.8945 -4.8945 -4.8468 -4.8468 -4.8431 -4.8431 2.0290 2.0290 2.4168 2.4168 2.4298 2.4298 6.8745 6.8745 9.2255 9.2255 10.0439 10.0439 10.0923 10.0923 10.2616 10.2616 11.3929 11.3929 11.5270 11.5270 13.8550 13.8550 13.9011 13.9011 k = 0.5000 0.5000 0.0154 ( 4556 PWs) bands (ev): -25.1084 -25.1084 -7.9879 -7.9879 -7.5191 -7.5191 -7.4968 -7.4968 -7.4802 -7.4802 -7.4798 -7.4798 -7.4747 -7.4747 -7.4608 -7.4608 -6.8395 -6.8395 -6.7806 -6.7806 -4.9856 -4.9856 -4.9717 -4.9717 -4.9260 -4.9260 -4.9208 -4.9208 -4.9201 -4.9201 -4.8954 -4.8954 -4.8942 -4.8942 -4.8466 -4.8466 -4.8430 -4.8430 2.0300 2.0300 2.4172 2.4172 2.4301 2.4301 6.8761 6.8761 9.2126 9.2126 10.0024 10.0024 10.0302 10.0302 10.3549 10.3549 11.4090 11.4090 11.5415 11.5415 13.8547 13.8547 13.9027 13.9027 k = 0.5000 0.5000 0.0309 ( 4556 PWs) bands (ev): -25.1084 -25.1084 -7.9878 -7.9878 -7.5190 -7.5190 -7.4969 -7.4969 -7.4802 -7.4802 -7.4797 -7.4797 -7.4744 -7.4744 -7.4608 -7.4608 -6.8395 -6.8395 -6.7810 -6.7810 -4.9859 -4.9859 -4.9721 -4.9721 -4.9276 -4.9276 -4.9202 -4.9202 -4.9191 -4.9191 -4.8960 -4.8960 -4.8939 -4.8939 -4.8461 -4.8461 -4.8426 -4.8426 2.0332 2.0332 2.4182 2.4182 2.4312 2.4312 6.8809 6.8809 9.1749 9.1749 9.8641 9.8641 9.9912 9.9912 10.5035 10.5035 11.4556 11.4556 11.5839 11.5839 13.8539 13.8539 13.9076 13.9076 k = 0.5000 0.5000 0.0463 ( 4548 PWs) bands (ev): -25.1084 -25.1084 -7.9876 -7.9876 -7.5187 -7.5187 -7.4971 -7.4971 -7.4803 -7.4803 -7.4797 -7.4797 -7.4741 -7.4741 -7.4606 -7.4606 -6.8396 -6.8396 -6.7817 -6.7817 -4.9865 -4.9865 -4.9728 -4.9728 -4.9294 -4.9294 -4.9204 -4.9204 -4.9174 -4.9174 -4.8967 -4.8967 -4.8936 -4.8936 -4.8453 -4.8453 -4.8421 -4.8421 2.0385 2.0385 2.4199 2.4199 2.4329 2.4329 6.8889 6.8889 9.1144 9.1144 9.7243 9.7243 9.9315 9.9315 10.6608 10.6608 11.5279 11.5279 11.6521 11.6521 13.8522 13.8522 13.9156 13.9156 k = 0.5000 0.5000 0.0618 ( 4548 PWs) bands (ev): -25.1084 -25.1084 -7.9873 -7.9873 -7.5184 -7.5184 -7.4974 -7.4974 -7.4803 -7.4803 -7.4796 -7.4796 -7.4735 -7.4735 -7.4605 -7.4605 -6.8396 -6.8396 -6.7827 -6.7827 -4.9873 -4.9873 -4.9738 -4.9738 -4.9312 -4.9312 -4.9206 -4.9206 -4.9157 -4.9157 -4.8974 -4.8974 -4.8935 -4.8935 -4.8441 -4.8441 -4.8413 -4.8413 2.0459 2.0459 2.4223 2.4223 2.4354 2.4354 6.9000 6.9000 9.0342 9.0342 9.5882 9.5882 9.8564 9.8564 10.8212 10.8212 11.6204 11.6204 11.7430 11.7430 13.8496 13.8496 13.9269 13.9269 k = 0.5000 0.5000 0.0772 ( 4552 PWs) bands (ev): -25.1084 -25.1084 -7.9869 -7.9869 -7.5180 -7.5180 -7.4977 -7.4977 -7.4804 -7.4804 -7.4795 -7.4795 -7.4729 -7.4729 -7.4603 -7.4603 -6.8397 -6.8397 -6.7839 -6.7839 -4.9884 -4.9884 -4.9750 -4.9750 -4.9329 -4.9329 -4.9209 -4.9209 -4.9140 -4.9140 -4.8982 -4.8982 -4.8934 -4.8934 -4.8428 -4.8428 -4.8403 -4.8403 2.0553 2.0553 2.4254 2.4254 2.4384 2.4384 6.9142 6.9142 8.9377 8.9377 9.4572 9.4572 9.7709 9.7709 10.9834 10.9834 11.7284 11.7284 11.8530 11.8530 13.8457 13.8457 13.9414 13.9414 k = 0.5000 0.5000 0.0926 ( 4560 PWs) bands (ev): -25.1084 -25.1084 -7.9865 -7.9865 -7.5175 -7.5175 -7.4981 -7.4981 -7.4804 -7.4804 -7.4794 -7.4794 -7.4722 -7.4722 -7.4600 -7.4600 -6.8398 -6.8398 -6.7854 -6.7854 -4.9896 -4.9896 -4.9764 -4.9764 -4.9345 -4.9345 -4.9213 -4.9213 -4.9125 -4.9125 -4.8989 -4.8989 -4.8935 -4.8935 -4.8411 -4.8411 -4.8391 -4.8391 2.0668 2.0668 2.4291 2.4291 2.4422 2.4422 6.9314 6.9314 8.8286 8.8286 9.3315 9.3315 9.6788 9.6788 11.1467 11.1467 11.8478 11.8478 11.9791 11.9791 13.8400 13.8400 13.9592 13.9592 k = 0.5000 0.5000 0.1081 ( 4552 PWs) bands (ev): -25.1083 -25.1083 -7.9859 -7.9859 -7.5170 -7.5170 -7.4986 -7.4986 -7.4804 -7.4804 -7.4793 -7.4793 -7.4714 -7.4714 -7.4597 -7.4597 -6.8399 -6.8399 -6.7871 -6.7871 -4.9910 -4.9910 -4.9780 -4.9780 -4.9360 -4.9360 -4.9218 -4.9218 -4.9112 -4.9112 -4.8996 -4.8996 -4.8937 -4.8937 -4.8393 -4.8393 -4.8377 -4.8377 2.0801 2.0801 2.4334 2.4334 2.4465 2.4465 6.9514 6.9514 8.7103 8.7103 9.2109 9.2109 9.5830 9.5830 11.3105 11.3105 11.9759 11.9759 12.1183 12.1183 13.8320 13.8320 13.9803 13.9803 k = 0.5000 0.5000 0.1235 ( 4556 PWs) bands (ev): -25.1083 -25.1083 -7.9853 -7.9853 -7.5164 -7.5164 -7.4991 -7.4991 -7.4804 -7.4804 -7.4791 -7.4791 -7.4705 -7.4705 -7.4593 -7.4593 -6.8400 -6.8400 -6.7890 -6.7890 -4.9926 -4.9926 -4.9798 -4.9798 -4.9374 -4.9374 -4.9224 -4.9224 -4.9099 -4.9099 -4.9002 -4.9002 -4.8940 -4.8940 -4.8372 -4.8372 -4.8361 -4.8361 2.0954 2.0954 2.4382 2.4382 2.4514 2.4514 6.9741 6.9741 8.5857 8.5857 9.0949 9.0949 9.4853 9.4853 11.4748 11.4748 12.1105 12.1105 12.2680 12.2680 13.8209 13.8209 14.0046 14.0046 k = 0.5000 0.5000 0.1390 ( 4552 PWs) bands (ev): -25.1083 -25.1083 -7.9847 -7.9847 -7.5158 -7.5158 -7.4996 -7.4996 -7.4803 -7.4803 -7.4789 -7.4789 -7.4696 -7.4696 -7.4588 -7.4588 -6.8401 -6.8401 -6.7912 -6.7912 -4.9944 -4.9944 -4.9818 -4.9818 -4.9387 -4.9387 -4.9231 -4.9231 -4.9088 -4.9088 -4.9008 -4.9008 -4.8943 -4.8943 -4.8351 -4.8351 -4.8344 -4.8344 2.1124 2.1124 2.4436 2.4436 2.4569 2.4569 6.9995 6.9995 8.4574 8.4574 8.9830 8.9830 9.3874 9.3874 11.6392 11.6392 12.2500 12.2500 12.4261 12.4261 13.8058 13.8058 14.0324 14.0324 k = 0.5000 0.5000 0.1544 ( 4560 PWs) bands (ev): -25.1083 -25.1083 -7.9840 -7.9840 -7.5152 -7.5152 -7.5001 -7.5001 -7.4802 -7.4802 -7.4787 -7.4787 -7.4686 -7.4686 -7.4582 -7.4582 -6.8403 -6.8403 -6.7935 -6.7935 -4.9963 -4.9963 -4.9838 -4.9838 -4.9399 -4.9399 -4.9238 -4.9238 -4.9079 -4.9079 -4.9014 -4.9014 -4.8948 -4.8948 -4.8328 -4.8328 -4.8325 -4.8325 2.1311 2.1311 2.4495 2.4495 2.4628 2.4628 7.0272 7.0272 8.3272 8.3272 8.8751 8.8751 9.2903 9.2903 11.8037 11.8037 12.3933 12.3933 12.5907 12.5907 13.7860 13.7860 14.0636 14.0636 k = 0.5000 0.5000 0.1699 ( 4560 PWs) bands (ev): -25.1083 -25.1083 -7.9832 -7.9832 -7.5146 -7.5146 -7.5007 -7.5007 -7.4802 -7.4802 -7.4785 -7.4785 -7.4676 -7.4676 -7.4576 -7.4576 -6.8404 -6.8404 -6.7960 -6.7960 -4.9983 -4.9983 -4.9859 -4.9859 -4.9409 -4.9409 -4.9246 -4.9246 -4.9071 -4.9071 -4.9020 -4.9020 -4.8953 -4.8953 -4.8305 -4.8305 -4.8305 -4.8305 2.1514 2.1514 2.4559 2.4559 2.4692 2.4692 7.0571 7.0571 8.1967 8.1967 8.7709 8.7709 9.1949 9.1949 11.9682 11.9682 12.5393 12.5393 12.7601 12.7601 13.7602 13.7602 14.0983 14.0983 k = 0.5000 0.5000 0.1853 ( 4552 PWs) bands (ev): -25.1083 -25.1083 -7.9824 -7.9824 -7.5140 -7.5140 -7.5013 -7.5013 -7.4801 -7.4801 -7.4783 -7.4783 -7.4666 -7.4666 -7.4569 -7.4569 -6.8406 -6.8406 -6.7987 -6.7987 -5.0003 -5.0003 -4.9881 -4.9881 -4.9418 -4.9418 -4.9256 -4.9256 -4.9064 -4.9064 -4.9025 -4.9025 -4.8958 -4.8958 -4.8284 -4.8284 -4.8280 -4.8280 2.1731 2.1731 2.4626 2.4626 2.4760 2.4760 7.0889 7.0889 8.0671 8.0671 8.6703 8.6703 9.1019 9.1019 12.1325 12.1325 12.6871 12.6871 12.9326 12.9326 13.7277 13.7277 14.1368 14.1368 k = 0.5000 0.5000 0.2007 ( 4544 PWs) bands (ev): -25.1082 -25.1082 -7.9816 -7.9816 -7.5134 -7.5134 -7.5018 -7.5018 -7.4800 -7.4800 -7.4781 -7.4781 -7.4656 -7.4656 -7.4560 -7.4560 -6.8407 -6.8407 -6.8015 -6.8015 -5.0024 -5.0024 -4.9903 -4.9903 -4.9427 -4.9427 -4.9265 -4.9265 -4.9059 -4.9059 -4.9029 -4.9029 -4.8964 -4.8964 -4.8263 -4.8263 -4.8256 -4.8256 2.1962 2.1962 2.4697 2.4697 2.4831 2.4831 7.1224 7.1224 7.9393 7.9393 8.5735 8.5735 9.0117 9.0117 12.2965 12.2965 12.8361 12.8361 13.1068 13.1068 13.6877 13.6877 14.1792 14.1792 k = 0.5000 0.5000 0.2162 ( 4544 PWs) bands (ev): -25.1082 -25.1082 -7.9807 -7.9807 -7.5129 -7.5129 -7.5024 -7.5024 -7.4798 -7.4798 -7.4779 -7.4779 -7.4645 -7.4645 -7.4550 -7.4550 -6.8409 -6.8409 -6.8044 -6.8044 -5.0045 -5.0045 -4.9925 -4.9925 -4.9434 -4.9434 -4.9276 -4.9276 -4.9055 -4.9055 -4.9034 -4.9034 -4.8970 -4.8970 -4.8241 -4.8241 -4.8232 -4.8232 2.2203 2.2203 2.4771 2.4771 2.4905 2.4905 7.1573 7.1573 7.8141 7.8141 8.4804 8.4804 8.9249 8.9249 12.4600 12.4600 12.9852 12.9852 13.2808 13.2808 13.6402 13.6402 14.2259 14.2259 k = 0.5000 0.5000 0.2316 ( 4544 PWs) bands (ev): -25.1082 -25.1082 -7.9798 -7.9798 -7.5124 -7.5124 -7.5030 -7.5030 -7.4797 -7.4797 -7.4776 -7.4776 -7.4635 -7.4635 -7.4540 -7.4540 -6.8411 -6.8411 -6.8074 -6.8074 -5.0066 -5.0066 -4.9947 -4.9947 -4.9441 -4.9441 -4.9286 -4.9286 -4.9051 -4.9051 -4.9038 -4.9038 -4.8975 -4.8975 -4.8219 -4.8219 -4.8208 -4.8208 2.2455 2.2455 2.4847 2.4847 2.4981 2.4981 7.1932 7.1932 7.6921 7.6921 8.3913 8.3913 8.8418 8.8418 12.6228 12.6228 13.1330 13.1330 13.4529 13.4529 13.5861 13.5861 14.2773 14.2773 k = 0.5000 0.5000 0.2471 ( 4552 PWs) bands (ev): -25.1082 -25.1082 -7.9790 -7.9790 -7.5119 -7.5119 -7.5036 -7.5036 -7.4796 -7.4796 -7.4774 -7.4774 -7.4624 -7.4624 -7.4528 -7.4528 -6.8412 -6.8412 -6.8104 -6.8104 -5.0087 -5.0087 -4.9969 -4.9969 -4.9447 -4.9447 -4.9298 -4.9298 -4.9049 -4.9049 -4.9041 -4.9041 -4.8981 -4.8981 -4.8197 -4.8197 -4.8184 -4.8184 2.2715 2.2715 2.4924 2.4924 2.5059 2.5059 7.2298 7.2298 7.5739 7.5739 8.3062 8.3062 8.7628 8.7628 12.7847 12.7847 13.2752 13.2752 13.5299 13.5299 13.6208 13.6208 14.3341 14.3341 k = 0.5000 0.5000 0.2625 ( 4556 PWs) bands (ev): -25.1082 -25.1082 -7.9781 -7.9781 -7.5115 -7.5115 -7.5041 -7.5041 -7.4795 -7.4795 -7.4772 -7.4772 -7.4614 -7.4614 -7.4516 -7.4516 -6.8414 -6.8414 -6.8134 -6.8134 -5.0108 -5.0108 -4.9991 -4.9991 -4.9452 -4.9452 -4.9309 -4.9309 -4.9047 -4.9047 -4.9045 -4.9045 -4.8987 -4.8987 -4.8176 -4.8176 -4.8161 -4.8161 2.2980 2.2980 2.5002 2.5002 2.5137 2.5137 7.2666 7.2666 7.4599 7.4599 8.2253 8.2253 8.6883 8.6883 12.9455 12.9455 13.3772 13.3772 13.5067 13.5067 13.7820 13.7820 14.3973 14.3973 k = 0.5000 0.5000 0.2779 ( 4576 PWs) bands (ev): -25.1082 -25.1082 -7.9772 -7.9772 -7.5112 -7.5112 -7.5047 -7.5047 -7.4793 -7.4793 -7.4771 -7.4771 -7.4604 -7.4604 -7.4503 -7.4503 -6.8416 -6.8416 -6.8165 -6.8165 -5.0128 -5.0128 -5.0012 -5.0012 -4.9457 -4.9457 -4.9320 -4.9320 -4.9049 -4.9049 -4.9046 -4.9046 -4.8992 -4.8992 -4.8154 -4.8154 -4.8139 -4.8139 2.3248 2.3248 2.5080 2.5080 2.5215 2.5215 7.3033 7.3033 7.3506 7.3506 8.1487 8.1487 8.6186 8.6186 13.1048 13.1048 13.3489 13.3489 13.6077 13.6077 13.9335 13.9335 14.4677 14.4677 k = 0.5000 0.5000 0.2934 ( 4568 PWs) bands (ev): -25.1081 -25.1081 -7.9763 -7.9763 -7.5109 -7.5109 -7.5052 -7.5052 -7.4792 -7.4792 -7.4769 -7.4769 -7.4594 -7.4594 -7.4489 -7.4489 -6.8418 -6.8418 -6.8195 -6.8195 -5.0147 -5.0147 -5.0031 -5.0031 -4.9461 -4.9461 -4.9332 -4.9332 -4.9052 -4.9052 -4.9046 -4.9046 -4.8997 -4.8997 -4.8134 -4.8134 -4.8117 -4.8117 2.3517 2.3517 2.5158 2.5158 2.5292 2.5292 7.2464 7.2464 7.3393 7.3393 8.0767 8.0767 8.5539 8.5539 13.2625 13.2625 13.2789 13.2789 13.7455 13.7455 14.0722 14.0722 14.5460 14.5460 k = 0.5000 0.5000 0.3088 ( 4568 PWs) bands (ev): -25.1081 -25.1081 -7.9755 -7.9755 -7.5106 -7.5106 -7.5057 -7.5057 -7.4791 -7.4791 -7.4768 -7.4768 -7.4584 -7.4584 -7.4475 -7.4475 -6.8419 -6.8419 -6.8225 -6.8225 -5.0166 -5.0166 -5.0050 -5.0050 -4.9465 -4.9465 -4.9343 -4.9343 -4.9055 -4.9055 -4.9046 -4.9046 -4.9001 -4.9001 -4.8114 -4.8114 -4.8097 -4.8097 2.3784 2.3784 2.5234 2.5234 2.5367 2.5367 7.1478 7.1478 7.3741 7.3741 8.0093 8.0093 8.4945 8.4945 13.2023 13.2023 13.4181 13.4181 13.8857 13.8857 14.1961 14.1961 14.6313 14.6313 k = 0.5000 0.5000 0.3243 ( 4568 PWs) bands (ev): -25.1081 -25.1081 -7.9746 -7.9746 -7.5104 -7.5104 -7.5061 -7.5061 -7.4790 -7.4790 -7.4767 -7.4767 -7.4575 -7.4575 -7.4461 -7.4461 -6.8421 -6.8421 -6.8253 -6.8253 -5.0183 -5.0183 -5.0068 -5.0068 -4.9468 -4.9468 -4.9354 -4.9354 -4.9059 -4.9059 -4.9046 -4.9046 -4.9005 -4.9005 -4.8096 -4.8096 -4.8078 -4.8078 2.4046 2.4046 2.5308 2.5308 2.5440 2.5440 7.0550 7.0550 7.4072 7.4072 7.9467 7.9467 8.4408 8.4408 13.1246 13.1246 13.5713 13.5713 14.0242 14.0242 14.3050 14.3050 14.7201 14.7201 k = 0.5000 0.5000 0.3397 ( 4556 PWs) bands (ev): -25.1081 -25.1081 -7.9739 -7.9739 -7.5103 -7.5103 -7.5066 -7.5066 -7.4789 -7.4789 -7.4766 -7.4766 -7.4567 -7.4567 -7.4447 -7.4447 -6.8422 -6.8422 -6.8280 -6.8280 -5.0199 -5.0199 -5.0085 -5.0085 -4.9471 -4.9471 -4.9364 -4.9364 -4.9062 -4.9062 -4.9047 -4.9047 -4.9008 -4.9008 -4.8078 -4.8078 -4.8060 -4.8060 2.4301 2.4301 2.5380 2.5380 2.5510 2.5510 6.9686 6.9686 7.4381 7.4381 7.8890 7.8890 8.3929 8.3929 13.0482 13.0482 13.7218 13.7218 14.1592 14.1592 14.4009 14.4009 14.8065 14.8065 k = 0.5000 0.5000 0.3552 ( 4556 PWs) bands (ev): -25.1081 -25.1081 -7.9731 -7.9731 -7.5101 -7.5101 -7.5070 -7.5070 -7.4788 -7.4788 -7.4765 -7.4765 -7.4559 -7.4559 -7.4433 -7.4433 -6.8424 -6.8424 -6.8306 -6.8306 -5.0214 -5.0214 -5.0101 -5.0101 -4.9473 -4.9473 -4.9374 -4.9374 -4.9065 -4.9065 -4.9048 -4.9048 -4.9011 -4.9011 -4.8062 -4.8062 -4.8043 -4.8043 2.4543 2.4543 2.5448 2.5448 2.5575 2.5575 6.8888 6.8888 7.4662 7.4662 7.8364 7.8364 8.3509 8.3509 12.9747 12.9747 13.8691 13.8691 14.2898 14.2898 14.4868 14.4868 14.8122 14.8122 k = 0.5000 0.5000 0.3706 ( 4548 PWs) bands (ev): -25.1080 -25.1080 -7.9725 -7.9725 -7.5100 -7.5100 -7.5073 -7.5073 -7.4787 -7.4787 -7.4764 -7.4764 -7.4551 -7.4551 -7.4420 -7.4420 -6.8425 -6.8425 -6.8330 -6.8330 -5.0228 -5.0228 -5.0115 -5.0115 -4.9476 -4.9476 -4.9382 -4.9382 -4.9068 -4.9068 -4.9049 -4.9049 -4.9014 -4.9014 -4.8047 -4.8047 -4.8028 -4.8028 2.4771 2.4771 2.5511 2.5511 2.5636 2.5636 6.8161 6.8161 7.4913 7.4913 7.7890 7.7890 8.3150 8.3150 12.9055 12.9055 14.0130 14.0130 14.4148 14.4148 14.5653 14.5653 14.8167 14.8167 k = 0.5000 0.5000 0.3860 ( 4548 PWs) bands (ev): -25.1080 -25.1080 -7.9719 -7.9719 -7.5100 -7.5100 -7.5076 -7.5076 -7.4786 -7.4786 -7.4764 -7.4764 -7.4545 -7.4545 -7.4408 -7.4408 -6.8426 -6.8426 -6.8352 -6.8352 -5.0240 -5.0240 -5.0127 -5.0127 -4.9477 -4.9477 -4.9391 -4.9391 -4.9071 -4.9071 -4.9050 -4.9050 -4.9016 -4.9016 -4.8034 -4.8034 -4.8015 -4.8015 2.4981 2.4981 2.5571 2.5571 2.5692 2.5692 6.7509 6.7509 7.5129 7.5129 7.7468 7.7468 8.2850 8.2850 12.8418 12.8418 14.1530 14.1530 14.5330 14.5330 14.6381 14.6381 14.8233 14.8233 k = 0.5000 0.5000 0.4015 ( 4556 PWs) bands (ev): -25.1080 -25.1080 -7.9713 -7.9713 -7.5099 -7.5099 -7.5079 -7.5079 -7.4785 -7.4785 -7.4763 -7.4763 -7.4539 -7.4539 -7.4397 -7.4397 -6.8427 -6.8427 -6.8371 -6.8371 -5.0251 -5.0251 -5.0138 -5.0138 -4.9479 -4.9479 -4.9398 -4.9398 -4.9074 -4.9074 -4.9050 -4.9050 -4.9018 -4.9018 -4.8022 -4.8022 -4.8003 -4.8003 2.5168 2.5168 2.5626 2.5626 2.5742 2.5742 6.6936 6.6936 7.5309 7.5309 7.7101 7.7101 8.2606 8.2606 12.7846 12.7846 14.2888 14.2888 14.6423 14.6423 14.7059 14.7059 14.8323 14.8323 k = 0.5000 0.5000 0.4169 ( 4580 PWs) bands (ev): -25.1080 -25.1080 -7.9709 -7.9709 -7.5099 -7.5099 -7.5082 -7.5082 -7.4785 -7.4785 -7.4763 -7.4763 -7.4534 -7.4534 -7.4387 -7.4387 -6.8428 -6.8428 -6.8388 -6.8388 -5.0260 -5.0260 -5.0148 -5.0148 -4.9481 -4.9481 -4.9404 -4.9404 -4.9076 -4.9076 -4.9051 -4.9051 -4.9019 -4.9019 -4.8012 -4.8012 -4.7993 -4.7993 2.5329 2.5329 2.5678 2.5678 2.5785 2.5785 6.6444 6.6444 7.5454 7.5454 7.6789 7.6789 8.2416 8.2416 12.7346 12.7346 14.4199 14.4199 14.7370 14.7370 14.7685 14.7685 14.8476 14.8476 k = 0.5000 0.5000 0.4324 ( 4588 PWs) bands (ev): -25.1080 -25.1080 -7.9705 -7.9705 -7.5099 -7.5099 -7.5084 -7.5084 -7.4784 -7.4784 -7.4763 -7.4763 -7.4530 -7.4530 -7.4379 -7.4379 -6.8429 -6.8429 -6.8402 -6.8402 -5.0267 -5.0267 -5.0156 -5.0156 -4.9482 -4.9482 -4.9410 -4.9410 -4.9078 -4.9078 -4.9052 -4.9052 -4.9020 -4.9020 -4.8004 -4.8004 -4.7985 -4.7985 2.5459 2.5459 2.5727 2.5727 2.5821 2.5821 6.6036 6.6036 7.5565 7.5565 7.6532 7.6532 8.2273 8.2273 12.6927 12.6927 14.5459 14.5459 14.7988 14.7988 14.8249 14.8249 14.8854 14.8854 k = 0.5000 0.5000 0.4478 ( 4616 PWs) bands (ev): -25.1080 -25.1080 -7.9702 -7.9702 -7.5099 -7.5099 -7.5085 -7.5085 -7.4784 -7.4784 -7.4763 -7.4763 -7.4527 -7.4527 -7.4373 -7.4373 -6.8430 -6.8430 -6.8413 -6.8413 -5.0273 -5.0273 -5.0162 -5.0162 -4.9483 -4.9483 -4.9414 -4.9414 -4.9080 -4.9080 -4.9053 -4.9053 -4.9021 -4.9021 -4.7997 -4.7997 -4.7978 -4.7978 2.5555 2.5555 2.5774 2.5774 2.5850 2.5850 6.5717 6.5717 7.5646 7.5646 7.6331 7.6331 8.2171 8.2171 12.6594 12.6594 14.6659 14.6659 14.8212 14.8212 14.8737 14.8737 14.9490 14.9490 k = 0.5000 0.5000 0.4632 ( 4632 PWs) bands (ev): -25.1080 -25.1080 -7.9699 -7.9699 -7.5098 -7.5098 -7.5087 -7.5087 -7.4784 -7.4784 -7.4762 -7.4762 -7.4524 -7.4524 -7.4368 -7.4368 -6.8430 -6.8430 -6.8421 -6.8421 -5.0278 -5.0278 -5.0166 -5.0166 -4.9483 -4.9483 -4.9417 -4.9417 -4.9081 -4.9081 -4.9053 -4.9053 -4.9022 -4.9022 -4.7993 -4.7993 -4.7974 -4.7974 2.5616 2.5616 2.5816 2.5816 2.5870 2.5870 6.5486 6.5486 7.5700 7.5700 7.6188 7.6188 8.2104 8.2104 12.6353 12.6353 14.7769 14.7769 14.8299 14.8299 14.9147 14.9147 15.0090 15.0090 k = 0.5000 0.5000 0.4787 ( 4632 PWs) bands (ev): -25.1080 -25.1080 -7.9698 -7.9698 -7.5098 -7.5098 -7.5087 -7.5087 -7.4783 -7.4783 -7.4762 -7.4762 -7.4523 -7.4523 -7.4365 -7.4365 -6.8430 -6.8430 -6.8426 -6.8426 -5.0280 -5.0280 -5.0169 -5.0169 -4.9484 -4.9484 -4.9419 -4.9419 -4.9082 -4.9082 -4.9053 -4.9053 -4.9022 -4.9022 -4.7990 -4.7990 -4.7971 -4.7971 2.5650 2.5650 2.5846 2.5846 2.5883 2.5883 6.5348 6.5348 7.5731 7.5731 7.6101 7.6101 8.2066 8.2066 12.6207 12.6207 14.8339 14.8339 14.8649 14.8649 14.9574 14.9574 15.0503 15.0503 k = 0.5000 0.5000 0.4941 ( 4632 PWs) bands (ev): -25.1080 -25.1080 -7.9698 -7.9698 -7.5098 -7.5098 -7.5088 -7.5088 -7.4783 -7.4783 -7.4762 -7.4762 -7.4522 -7.4522 -7.4364 -7.4364 -6.8430 -6.8430 -6.8428 -6.8428 -5.0281 -5.0281 -5.0170 -5.0170 -4.9484 -4.9484 -4.9419 -4.9419 -4.9082 -4.9082 -4.9054 -4.9054 -4.9022 -4.9022 -4.7989 -4.7989 -4.7970 -4.7970 2.5660 2.5660 2.5856 2.5856 2.5887 2.5887 6.5301 6.5301 7.5741 7.5741 7.6073 7.6073 8.2054 8.2054 12.6158 12.6158 14.8351 14.8351 14.8957 14.8957 15.0082 15.0082 15.0652 15.0652 Writing output data file SrPb3.save init_run : 0.23s CPU 0.37s WALL ( 1 calls) electrons : 191.03s CPU 193.84s WALL ( 1 calls) Called by init_run: wfcinit : 0.00s CPU 0.01s WALL ( 1 calls) potinit : 0.02s CPU 0.05s WALL ( 1 calls) Called by electrons: c_bands : 191.02s CPU 193.83s WALL ( 1 calls) v_of_rho : 0.01s CPU 0.00s WALL ( 1 calls) v_h : 0.00s CPU 0.00s WALL ( 1 calls) v_xc : 0.00s CPU 0.00s WALL ( 1 calls) newd : 0.07s CPU 0.09s WALL ( 1 calls) Called by c_bands: init_us_2 : 0.06s CPU 0.06s WALL ( 323 calls) cegterg : 175.65s CPU 177.83s WALL ( 344 calls) Called by sum_band: Called by *egterg: h_psi : 100.72s CPU 102.23s WALL ( 6650 calls) s_psi : 5.60s CPU 5.61s WALL ( 6650 calls) g_psi : 0.27s CPU 0.28s WALL ( 5983 calls) cdiaghg : 61.94s CPU 62.78s WALL ( 6306 calls) cegterg:over : 7.51s CPU 7.67s WALL ( 5983 calls) cegterg:upda : 6.52s CPU 6.46s WALL ( 5983 calls) cegterg:last : 3.32s CPU 3.33s WALL ( 990 calls) cdiaghg:chol : 3.47s CPU 3.56s WALL ( 6306 calls) cdiaghg:inve : 2.52s CPU 2.54s WALL ( 6306 calls) cdiaghg:para : 4.16s CPU 4.26s WALL ( 12612 calls) Called by h_psi: h_psi:vloc : 88.19s CPU 89.64s WALL ( 6650 calls) h_psi:vnl : 12.28s CPU 12.31s WALL ( 6650 calls) add_vuspsi : 6.40s CPU 6.50s WALL ( 6650 calls) General routines calbec : 5.86s CPU 5.80s WALL ( 6650 calls) fft : 0.01s CPU 0.01s WALL ( 19 calls) ffts : 0.00s CPU 0.00s WALL ( 4 calls) fftw : 83.14s CPU 84.76s WALL ( 833048 calls) interpolate : 0.00s CPU 0.00s WALL ( 4 calls) davcio : 0.18s CPU 0.28s WALL ( 646 calls) Parallel routines fft_scatter : 27.19s CPU 27.55s WALL ( 833071 calls) PWSCF : 3m30.18s CPU 3m45.27s WALL This run was terminated on: 21: 8:40 5Jan2017 =------------------------------------------------------------------------------= JOB DONE. =------------------------------------------------------------------------------=