Program PWSCF v.5.3.0 (svn rev. 11974) starts on 3Jan2017 at 14:12:44 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: ./BaTl2.save/ file Ba.rel-pbe-spn-rrkjus_psl.1.0.0.UPF: wavefunction(s) 5S 6S renormalized file Tl.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 39 33 9 1929 1509 230 Max 40 34 11 1934 1529 236 Sum 1417 1201 349 69529 54705 8365 bravais-lattice index = 14 lattice parameter (alat) = 9.8644 a.u. unit-cell volume = 1343.5573 (a.u.)^3 number of atoms/cell = 6 number of atomic types = 2 number of electrons = 72.00 number of Kohn-Sham states= 86 kinetic-energy cutoff = 45.0000 Ry charge density cutoff = 211.0000 Ry Exchange-correlation = PBE ( 1 4 3 4 0 0) Non magnetic calculation with spin-orbit celldm(1)= 9.864370 celldm(2)= 1.000000 celldm(3)= 1.616284 celldm(4)= 0.000000 celldm(5)= 0.000000 celldm(6)= -0.500000 crystal axes: (cart. coord. in units of alat) a(1) = ( 1.000000 0.000000 0.000000 ) a(2) = ( -0.500000 0.866025 0.000000 ) a(3) = ( 0.000000 0.000000 1.616284 ) reciprocal axes: (cart. coord. in units 2 pi/alat) b(1) = ( 1.000000 0.577350 -0.000000 ) b(2) = ( 0.000000 1.154701 -0.000000 ) b(3) = ( 0.000000 0.000000 0.618703 ) PseudoPot. # 1 for Ba read from file: /users/gautes/Pseudo/Ba.rel-pbe-spn-rrkjus_psl.1.0.0.UPF MD5 check sum: 3006f3397849ee49953ff32be8e81b23 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 1251 points, 11 beta functions with: l(1) = 0 l(2) = 0 l(3) = 0 l(4) = 1 l(5) = 1 l(6) = 1 l(7) = 1 l(8) = 2 l(9) = 2 l(10) = 2 l(11) = 2 Q(r) pseudized with 0 coefficients PseudoPot. # 2 for Tl read from file: /users/gautes/Pseudo/Tl.rel-pbe-dn-rrkjus_psl.1.0.0.UPF MD5 check sum: cd969aa200d2b9b89aab382fbbb9d684 Pseudo is Ultrasoft + core correction, Zval = 13.0 Generated using "atomic" code by A. Dal Corso v.5.0.2 svn rev. 9656 Using radial grid of 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 atomic species valence mass pseudopotential Ba 10.00 137.32700 Ba( 1.00) Tl 13.00 204.38330 Tl( 1.00) 12 Sym. Ops., with inversion, found (note: 12 additional sym.ops. were found but ignored their fractional translations are incommensurate with FFT grid) s frac. trans. isym = 1 identity cryst. s( 1) = ( 1 0 0 ) ( 0 1 0 ) ( 0 0 1 ) cart. s( 1) = ( 1.0000000 0.0000000 0.0000000 ) ( 0.0000000 1.0000000 0.0000000 ) ( 0.0000000 0.0000000 1.0000000 ) isym = 2 180 deg rotation - cart. axis [1,0,0] cryst. s( 2) = ( 1 0 0 ) ( -1 -1 0 ) ( 0 0 -1 ) cart. s( 2) = ( 1.0000000 -0.0000000 -0.0000000 ) ( 0.0000000 -1.0000000 -0.0000000 ) ( 0.0000000 0.0000000 -1.0000000 ) isym = 3 120 deg rotation - cryst. axis [0,0,1] cryst. s( 3) = ( 0 1 0 ) ( -1 -1 0 ) ( 0 0 1 ) cart. s( 3) = ( -0.5000000 -0.8660254 0.0000000 ) ( 0.8660254 -0.5000000 0.0000000 ) ( 0.0000000 0.0000000 1.0000000 ) isym = 4 120 deg rotation - cryst. axis [0,0,-1] cryst. s( 4) = ( -1 -1 0 ) ( 1 0 0 ) ( 0 0 1 ) cart. s( 4) = ( -0.5000000 0.8660254 0.0000000 ) ( -0.8660254 -0.5000000 0.0000000 ) ( 0.0000000 0.0000000 1.0000000 ) isym = 5 180 deg rotation - cryst. axis [0,1,0] cryst. s( 5) = ( -1 -1 0 ) ( 0 1 0 ) ( 0 0 -1 ) cart. s( 5) = ( -0.5000000 -0.8660254 0.0000000 ) ( -0.8660254 0.5000000 -0.0000000 ) ( 0.0000000 0.0000000 -1.0000000 ) isym = 6 180 deg rotation - cryst. axis [1,1,0] cryst. s( 6) = ( 0 1 0 ) ( 1 0 0 ) ( 0 0 -1 ) cart. s( 6) = ( -0.5000000 0.8660254 -0.0000000 ) ( 0.8660254 0.5000000 -0.0000000 ) ( 0.0000000 0.0000000 -1.0000000 ) isym = 7 inversion cryst. s( 7) = ( -1 0 0 ) ( 0 -1 0 ) ( 0 0 -1 ) cart. s( 7) = ( -1.0000000 -0.0000000 0.0000000 ) ( 0.0000000 -1.0000000 -0.0000000 ) ( 0.0000000 0.0000000 -1.0000000 ) isym = 8 inv. 180 deg rotation - cart. axis [1,0,0] cryst. s( 8) = ( -1 0 0 ) ( 1 1 0 ) ( 0 0 1 ) cart. s( 8) = ( -1.0000000 0.0000000 0.0000000 ) ( 0.0000000 1.0000000 0.0000000 ) ( 0.0000000 0.0000000 1.0000000 ) isym = 9 inv. 120 deg rotation - cryst. axis [0,0,1] cryst. s( 9) = ( 0 -1 0 ) ( 1 1 0 ) ( 0 0 -1 ) cart. s( 9) = ( 0.5000000 0.8660254 -0.0000000 ) ( -0.8660254 0.5000000 -0.0000000 ) ( 0.0000000 0.0000000 -1.0000000 ) isym = 10 inv. 120 deg rotation - cryst. axis [0,0,-1] cryst. s(10) = ( 1 1 0 ) ( -1 0 0 ) ( 0 0 -1 ) cart. s(10) = ( 0.5000000 -0.8660254 -0.0000000 ) ( 0.8660254 0.5000000 -0.0000000 ) ( 0.0000000 0.0000000 -1.0000000 ) isym = 11 inv. 180 deg rotation - cryst. axis [0,1,0] cryst. s(11) = ( 1 1 0 ) ( 0 -1 0 ) ( 0 0 1 ) cart. s(11) = ( 0.5000000 0.8660254 -0.0000000 ) ( 0.8660254 -0.5000000 0.0000000 ) ( 0.0000000 0.0000000 1.0000000 ) isym = 12 inv. 180 deg rotation - cryst. axis [1,1,0] cryst. s(12) = ( 0 -1 0 ) ( -1 0 0 ) ( 0 0 1 ) cart. s(12) = ( 0.5000000 -0.8660254 0.0000000 ) ( -0.8660254 -0.5000000 0.0000000 ) ( 0.0000000 0.0000000 1.0000000 ) double point group D_3d (-3m) there are 12 classes and 6 irreducible representations the character table: E -E 2C3 -2C3 3C2' -3C2' i -i 2S6 -2S6 3s_v -3s_v G_4+ 2.00 -2.00 1.00 -1.00 0.00 0.00 2.00 -2.00 1.00 -1.00 0.00 0.00 G_5+ 1.00 -1.00 -1.00 1.00 0.00 0.00 1.00 -1.00 -1.00 1.00 0.00 0.00 G_6+ 1.00 -1.00 -1.00 1.00 0.00 0.00 1.00 -1.00 -1.00 1.00 0.00 0.00 G_4- 2.00 -2.00 1.00 -1.00 0.00 0.00 -2.00 2.00 -1.00 1.00 0.00 0.00 G_5- 1.00 -1.00 -1.00 1.00 0.00 0.00 -1.00 1.00 1.00 -1.00 0.00 0.00 G_6- 1.00 -1.00 -1.00 1.00 0.00 0.00 -1.00 1.00 1.00 -1.00 0.00 0.00 imaginary part E -E 2C3 -2C3 3C2' -3C2' i -i 2S6 -2S6 3s_v -3s_v G_4+ 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 G_5+ 0.00 0.00 0.00 0.00 1.00 -1.00 0.00 0.00 0.00 0.00 1.00 -1.00 G_6+ 0.00 0.00 0.00 0.00 -1.00 1.00 0.00 0.00 0.00 0.00 -1.00 1.00 G_4- 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 G_5- 0.00 0.00 0.00 0.00 1.00 -1.00 0.00 0.00 0.00 0.00 -1.00 1.00 G_6- 0.00 0.00 0.00 0.00 -1.00 1.00 0.00 0.00 0.00 0.00 1.00 -1.00 the symmetry operations in each class and the name of the first element: E 1 identity -E -1 identity E 2C3 3 4 120 deg rotation - cryst. axis [0,0,1] -2C3 -3 -4 120 deg rotation - cryst. axis [0,0,1] E 3C2' 2 5 -6 180 deg rotation - cart. axis [1,0,0] 3C2' 6 -5 -2 180 deg rotation - cryst. axis [1,1,0] i 7 inversion -i -7 inversion E 2S6 9 10 inv. 120 deg rotation - cryst. axis [0,0,1] -2S6 -9 -10 inv. 120 deg rotation - cryst. axis [0,0,1] E 3s_v 8 11 -12 inv. 180 deg rotation - cart. axis [1,0,0] 3s_v 12 -11 -8 inv. 180 deg rotation - cryst. axis [1,1,0] Cartesian axes number of k points= 260 Fermi-Dirac smearing, width (Ry)= 0.0010 cart. coord. in units 2pi/alat k( 1) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0038462 k( 2) = ( 0.0142857 0.0082479 -0.0000000), wk = 0.0038462 k( 3) = ( 0.0285714 0.0164957 -0.0000000), wk = 0.0038462 k( 4) = ( 0.0428571 0.0247436 -0.0000000), wk = 0.0038462 k( 5) = ( 0.0571429 0.0329914 -0.0000000), wk = 0.0038462 k( 6) = ( 0.0714286 0.0412393 -0.0000000), wk = 0.0038462 k( 7) = ( 0.0857143 0.0494872 -0.0000000), wk = 0.0038462 k( 8) = ( 0.1000000 0.0577350 -0.0000000), wk = 0.0038462 k( 9) = ( 0.1142857 0.0659829 -0.0000000), wk = 0.0038462 k( 10) = ( 0.1285714 0.0742307 -0.0000000), wk = 0.0038462 k( 11) = ( 0.1428571 0.0824786 -0.0000000), wk = 0.0038462 k( 12) = ( 0.1571429 0.0907265 -0.0000000), wk = 0.0038462 k( 13) = ( 0.1714286 0.0989743 -0.0000000), wk = 0.0038462 k( 14) = ( 0.1857143 0.1072222 -0.0000000), wk = 0.0038462 k( 15) = ( 0.2000000 0.1154701 -0.0000000), wk = 0.0038462 k( 16) = ( 0.2142857 0.1237179 -0.0000000), wk = 0.0038462 k( 17) = ( 0.2285714 0.1319658 -0.0000000), wk = 0.0038462 k( 18) = ( 0.2428571 0.1402136 -0.0000000), wk = 0.0038462 k( 19) = ( 0.2571429 0.1484615 -0.0000000), wk = 0.0038462 k( 20) = ( 0.2714286 0.1567094 -0.0000000), wk = 0.0038462 k( 21) = ( 0.2857143 0.1649572 -0.0000000), wk = 0.0038462 k( 22) = ( 0.3000000 0.1732051 -0.0000000), wk = 0.0038462 k( 23) = ( 0.3142857 0.1814529 -0.0000000), wk = 0.0038462 k( 24) = ( 0.3285714 0.1897008 -0.0000000), wk = 0.0038462 k( 25) = ( 0.3428571 0.1979487 -0.0000000), wk = 0.0038462 k( 26) = ( 0.3571429 0.2061965 -0.0000000), wk = 0.0038462 k( 27) = ( 0.3714286 0.2144444 -0.0000000), wk = 0.0038462 k( 28) = ( 0.3857143 0.2226922 -0.0000000), wk = 0.0038462 k( 29) = ( 0.4000000 0.2309401 -0.0000000), wk = 0.0038462 k( 30) = ( 0.4142857 0.2391880 -0.0000000), wk = 0.0038462 k( 31) = ( 0.4285714 0.2474358 -0.0000000), wk = 0.0038462 k( 32) = ( 0.4428571 0.2556837 -0.0000000), wk = 0.0038462 k( 33) = ( 0.4571429 0.2639316 -0.0000000), wk = 0.0038462 k( 34) = ( 0.4714286 0.2721794 -0.0000000), wk = 0.0038462 k( 35) = ( 0.4857143 0.2804273 -0.0000000), wk = 0.0038462 k( 36) = ( 0.5000000 0.2886751 -0.0000000), wk = 0.0038462 k( 37) = ( 0.5000000 0.2886751 -0.0000000), wk = 0.0038462 k( 38) = ( 0.4920635 0.3024216 -0.0000000), wk = 0.0038462 k( 39) = ( 0.4841270 0.3161680 -0.0000000), wk = 0.0038462 k( 40) = ( 0.4761905 0.3299144 -0.0000000), wk = 0.0038462 k( 41) = ( 0.4682540 0.3436609 -0.0000000), wk = 0.0038462 k( 42) = ( 0.4603175 0.3574073 -0.0000000), wk = 0.0038462 k( 43) = ( 0.4523810 0.3711537 -0.0000000), wk = 0.0038462 k( 44) = ( 0.4444444 0.3849002 -0.0000000), wk = 0.0038462 k( 45) = ( 0.4365079 0.3986466 -0.0000000), wk = 0.0038462 k( 46) = ( 0.4285714 0.4123930 -0.0000000), wk = 0.0038462 k( 47) = ( 0.4206349 0.4261395 -0.0000000), wk = 0.0038462 k( 48) = ( 0.4126984 0.4398859 -0.0000000), wk = 0.0038462 k( 49) = ( 0.4047619 0.4536324 -0.0000000), wk = 0.0038462 k( 50) = ( 0.3968254 0.4673788 -0.0000000), wk = 0.0038462 k( 51) = ( 0.3888889 0.4811252 -0.0000000), wk = 0.0038462 k( 52) = ( 0.3809524 0.4948717 -0.0000000), wk = 0.0038462 k( 53) = ( 0.3730159 0.5086181 -0.0000000), wk = 0.0038462 k( 54) = ( 0.3650794 0.5223645 -0.0000000), wk = 0.0038462 k( 55) = ( 0.3571429 0.5361110 -0.0000000), wk = 0.0038462 k( 56) = ( 0.3492063 0.5498574 -0.0000000), wk = 0.0038462 k( 57) = ( 0.3412698 0.5636038 -0.0000000), wk = 0.0038462 k( 58) = ( 0.3333333 0.5773503 -0.0000000), wk = 0.0038462 k( 59) = ( 0.3333333 0.5773503 -0.0000000), wk = 0.0038462 k( 60) = ( 0.3252032 0.5632686 -0.0000000), wk = 0.0038462 k( 61) = ( 0.3170732 0.5491868 -0.0000000), wk = 0.0038462 k( 62) = ( 0.3089431 0.5351051 -0.0000000), wk = 0.0038462 k( 63) = ( 0.3008130 0.5210234 -0.0000000), wk = 0.0038462 k( 64) = ( 0.2926829 0.5069417 -0.0000000), wk = 0.0038462 k( 65) = ( 0.2845529 0.4928600 -0.0000000), wk = 0.0038462 k( 66) = ( 0.2764228 0.4787783 -0.0000000), wk = 0.0038462 k( 67) = ( 0.2682927 0.4646966 -0.0000000), wk = 0.0038462 k( 68) = ( 0.2601626 0.4506148 -0.0000000), wk = 0.0038462 k( 69) = ( 0.2520325 0.4365331 -0.0000000), wk = 0.0038462 k( 70) = ( 0.2439024 0.4224514 -0.0000000), wk = 0.0038462 k( 71) = ( 0.2357724 0.4083697 -0.0000000), wk = 0.0038462 k( 72) = ( 0.2276423 0.3942880 -0.0000000), wk = 0.0038462 k( 73) = ( 0.2195122 0.3802063 -0.0000000), wk = 0.0038462 k( 74) = ( 0.2113821 0.3661246 -0.0000000), wk = 0.0038462 k( 75) = ( 0.2032520 0.3520428 -0.0000000), wk = 0.0038462 k( 76) = ( 0.1951219 0.3379611 -0.0000000), wk = 0.0038462 k( 77) = ( 0.1869919 0.3238794 -0.0000000), wk = 0.0038462 k( 78) = ( 0.1788618 0.3097977 -0.0000000), wk = 0.0038462 k( 79) = ( 0.1707317 0.2957160 -0.0000000), wk = 0.0038462 k( 80) = ( 0.1626016 0.2816343 -0.0000000), wk = 0.0038462 k( 81) = ( 0.1544715 0.2675526 -0.0000000), wk = 0.0038462 k( 82) = ( 0.1463415 0.2534708 -0.0000000), wk = 0.0038462 k( 83) = ( 0.1382114 0.2393891 -0.0000000), wk = 0.0038462 k( 84) = ( 0.1300813 0.2253074 -0.0000000), wk = 0.0038462 k( 85) = ( 0.1219512 0.2112257 -0.0000000), wk = 0.0038462 k( 86) = ( 0.1138211 0.1971440 -0.0000000), wk = 0.0038462 k( 87) = ( 0.1056911 0.1830623 -0.0000000), wk = 0.0038462 k( 88) = ( 0.0975610 0.1689806 -0.0000000), wk = 0.0038462 k( 89) = ( 0.0894309 0.1548988 -0.0000000), wk = 0.0038462 k( 90) = ( 0.0813008 0.1408171 -0.0000000), wk = 0.0038462 k( 91) = ( 0.0731707 0.1267354 -0.0000000), wk = 0.0038462 k( 92) = ( 0.0650407 0.1126537 -0.0000000), wk = 0.0038462 k( 93) = ( 0.0569106 0.0985720 -0.0000000), wk = 0.0038462 k( 94) = ( 0.0487805 0.0844903 -0.0000000), wk = 0.0038462 k( 95) = ( 0.0406504 0.0704086 -0.0000000), wk = 0.0038462 k( 96) = ( 0.0325203 0.0563269 -0.0000000), wk = 0.0038462 k( 97) = ( 0.0243902 0.0422451 -0.0000000), wk = 0.0038462 k( 98) = ( 0.0162602 0.0281634 -0.0000000), wk = 0.0038462 k( 99) = ( 0.0081301 0.0140817 -0.0000000), wk = 0.0038462 k( 100) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0038462 k( 101) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0038462 k( 102) = ( 0.0000000 0.0000000 0.0162817), wk = 0.0038462 k( 103) = ( 0.0000000 0.0000000 0.0325633), wk = 0.0038462 k( 104) = ( 0.0000000 0.0000000 0.0488450), wk = 0.0038462 k( 105) = ( 0.0000000 0.0000000 0.0651267), wk = 0.0038462 k( 106) = ( 0.0000000 0.0000000 0.0814083), wk = 0.0038462 k( 107) = ( 0.0000000 0.0000000 0.0976900), wk = 0.0038462 k( 108) = ( 0.0000000 0.0000000 0.1139717), wk = 0.0038462 k( 109) = ( 0.0000000 0.0000000 0.1302533), wk = 0.0038462 k( 110) = ( 0.0000000 0.0000000 0.1465350), wk = 0.0038462 k( 111) = ( 0.0000000 0.0000000 0.1628167), wk = 0.0038462 k( 112) = ( 0.0000000 0.0000000 0.1790983), wk = 0.0038462 k( 113) = ( 0.0000000 0.0000000 0.1953800), wk = 0.0038462 k( 114) = ( 0.0000000 0.0000000 0.2116617), wk = 0.0038462 k( 115) = ( 0.0000000 0.0000000 0.2279433), wk = 0.0038462 k( 116) = ( 0.0000000 0.0000000 0.2442250), wk = 0.0038462 k( 117) = ( 0.0000000 0.0000000 0.2605067), wk = 0.0038462 k( 118) = ( 0.0000000 0.0000000 0.2767883), wk = 0.0038462 k( 119) = ( 0.0000000 0.0000000 0.2930700), wk = 0.0038462 k( 120) = ( 0.0000000 0.0000000 0.3093517), wk = 0.0038462 k( 121) = ( 0.0000000 0.0000000 0.3093517), wk = 0.0038462 k( 122) = ( 0.0142857 0.0082479 0.3093517), wk = 0.0038462 k( 123) = ( 0.0285714 0.0164957 0.3093517), wk = 0.0038462 k( 124) = ( 0.0428571 0.0247436 0.3093517), wk = 0.0038462 k( 125) = ( 0.0571429 0.0329914 0.3093517), wk = 0.0038462 k( 126) = ( 0.0714286 0.0412393 0.3093517), wk = 0.0038462 k( 127) = ( 0.0857143 0.0494872 0.3093517), wk = 0.0038462 k( 128) = ( 0.1000000 0.0577350 0.3093517), wk = 0.0038462 k( 129) = ( 0.1142857 0.0659829 0.3093517), wk = 0.0038462 k( 130) = ( 0.1285714 0.0742307 0.3093517), wk = 0.0038462 k( 131) = ( 0.1428571 0.0824786 0.3093517), wk = 0.0038462 k( 132) = ( 0.1571429 0.0907265 0.3093517), wk = 0.0038462 k( 133) = ( 0.1714286 0.0989743 0.3093517), wk = 0.0038462 k( 134) = ( 0.1857143 0.1072222 0.3093517), wk = 0.0038462 k( 135) = ( 0.2000000 0.1154701 0.3093517), wk = 0.0038462 k( 136) = ( 0.2142857 0.1237179 0.3093517), wk = 0.0038462 k( 137) = ( 0.2285714 0.1319658 0.3093517), wk = 0.0038462 k( 138) = ( 0.2428571 0.1402136 0.3093517), wk = 0.0038462 k( 139) = ( 0.2571429 0.1484615 0.3093517), wk = 0.0038462 k( 140) = ( 0.2714286 0.1567094 0.3093517), wk = 0.0038462 k( 141) = ( 0.2857143 0.1649572 0.3093517), wk = 0.0038462 k( 142) = ( 0.3000000 0.1732051 0.3093517), wk = 0.0038462 k( 143) = ( 0.3142857 0.1814529 0.3093517), wk = 0.0038462 k( 144) = ( 0.3285714 0.1897008 0.3093517), wk = 0.0038462 k( 145) = ( 0.3428571 0.1979487 0.3093517), wk = 0.0038462 k( 146) = ( 0.3571429 0.2061965 0.3093517), wk = 0.0038462 k( 147) = ( 0.3714286 0.2144444 0.3093517), wk = 0.0038462 k( 148) = ( 0.3857143 0.2226922 0.3093517), wk = 0.0038462 k( 149) = ( 0.4000000 0.2309401 0.3093517), wk = 0.0038462 k( 150) = ( 0.4142857 0.2391880 0.3093517), wk = 0.0038462 k( 151) = ( 0.4285714 0.2474358 0.3093517), wk = 0.0038462 k( 152) = ( 0.4428571 0.2556837 0.3093517), wk = 0.0038462 k( 153) = ( 0.4571429 0.2639316 0.3093517), wk = 0.0038462 k( 154) = ( 0.4714286 0.2721794 0.3093517), wk = 0.0038462 k( 155) = ( 0.4857143 0.2804273 0.3093517), wk = 0.0038462 k( 156) = ( 0.5000000 0.2886751 0.3093517), wk = 0.0038462 k( 157) = ( 0.5000000 0.2886751 0.3093517), wk = 0.0038462 k( 158) = ( 0.4920635 0.3024216 0.3093517), wk = 0.0038462 k( 159) = ( 0.4841270 0.3161680 0.3093517), wk = 0.0038462 k( 160) = ( 0.4761905 0.3299144 0.3093517), wk = 0.0038462 k( 161) = ( 0.4682540 0.3436609 0.3093517), wk = 0.0038462 k( 162) = ( 0.4603175 0.3574073 0.3093517), wk = 0.0038462 k( 163) = ( 0.4523810 0.3711537 0.3093517), wk = 0.0038462 k( 164) = ( 0.4444444 0.3849002 0.3093517), wk = 0.0038462 k( 165) = ( 0.4365079 0.3986466 0.3093517), wk = 0.0038462 k( 166) = ( 0.4285714 0.4123930 0.3093517), wk = 0.0038462 k( 167) = ( 0.4206349 0.4261395 0.3093517), wk = 0.0038462 k( 168) = ( 0.4126984 0.4398859 0.3093517), wk = 0.0038462 k( 169) = ( 0.4047619 0.4536324 0.3093517), wk = 0.0038462 k( 170) = ( 0.3968254 0.4673788 0.3093517), wk = 0.0038462 k( 171) = ( 0.3888889 0.4811252 0.3093517), wk = 0.0038462 k( 172) = ( 0.3809524 0.4948717 0.3093517), wk = 0.0038462 k( 173) = ( 0.3730159 0.5086181 0.3093517), wk = 0.0038462 k( 174) = ( 0.3650794 0.5223645 0.3093517), wk = 0.0038462 k( 175) = ( 0.3571429 0.5361110 0.3093517), wk = 0.0038462 k( 176) = ( 0.3492063 0.5498574 0.3093517), wk = 0.0038462 k( 177) = ( 0.3412698 0.5636038 0.3093517), wk = 0.0038462 k( 178) = ( 0.3333333 0.5773503 0.3093517), wk = 0.0038462 k( 179) = ( 0.3333333 0.5773503 0.3093517), wk = 0.0038462 k( 180) = ( 0.3252032 0.5632686 0.3093517), wk = 0.0038462 k( 181) = ( 0.3170732 0.5491868 0.3093517), wk = 0.0038462 k( 182) = ( 0.3089431 0.5351051 0.3093517), wk = 0.0038462 k( 183) = ( 0.3008130 0.5210234 0.3093517), wk = 0.0038462 k( 184) = ( 0.2926829 0.5069417 0.3093517), wk = 0.0038462 k( 185) = ( 0.2845529 0.4928600 0.3093517), wk = 0.0038462 k( 186) = ( 0.2764228 0.4787783 0.3093517), wk = 0.0038462 k( 187) = ( 0.2682927 0.4646966 0.3093517), wk = 0.0038462 k( 188) = ( 0.2601626 0.4506148 0.3093517), wk = 0.0038462 k( 189) = ( 0.2520325 0.4365331 0.3093517), wk = 0.0038462 k( 190) = ( 0.2439024 0.4224514 0.3093517), wk = 0.0038462 k( 191) = ( 0.2357724 0.4083697 0.3093517), wk = 0.0038462 k( 192) = ( 0.2276423 0.3942880 0.3093517), wk = 0.0038462 k( 193) = ( 0.2195122 0.3802063 0.3093517), wk = 0.0038462 k( 194) = ( 0.2113821 0.3661246 0.3093517), wk = 0.0038462 k( 195) = ( 0.2032520 0.3520428 0.3093517), wk = 0.0038462 k( 196) = ( 0.1951219 0.3379611 0.3093517), wk = 0.0038462 k( 197) = ( 0.1869919 0.3238794 0.3093517), wk = 0.0038462 k( 198) = ( 0.1788618 0.3097977 0.3093517), wk = 0.0038462 k( 199) = ( 0.1707317 0.2957160 0.3093517), wk = 0.0038462 k( 200) = ( 0.1626016 0.2816343 0.3093517), wk = 0.0038462 k( 201) = ( 0.1544715 0.2675526 0.3093517), wk = 0.0038462 k( 202) = ( 0.1463415 0.2534708 0.3093517), wk = 0.0038462 k( 203) = ( 0.1382114 0.2393891 0.3093517), wk = 0.0038462 k( 204) = ( 0.1300813 0.2253074 0.3093517), wk = 0.0038462 k( 205) = ( 0.1219512 0.2112257 0.3093517), wk = 0.0038462 k( 206) = ( 0.1138211 0.1971440 0.3093517), wk = 0.0038462 k( 207) = ( 0.1056911 0.1830623 0.3093517), wk = 0.0038462 k( 208) = ( 0.0975610 0.1689806 0.3093517), wk = 0.0038462 k( 209) = ( 0.0894309 0.1548988 0.3093517), wk = 0.0038462 k( 210) = ( 0.0813008 0.1408171 0.3093517), wk = 0.0038462 k( 211) = ( 0.0731707 0.1267354 0.3093517), wk = 0.0038462 k( 212) = ( 0.0650407 0.1126537 0.3093517), wk = 0.0038462 k( 213) = ( 0.0569106 0.0985720 0.3093517), wk = 0.0038462 k( 214) = ( 0.0487805 0.0844903 0.3093517), wk = 0.0038462 k( 215) = ( 0.0406504 0.0704086 0.3093517), wk = 0.0038462 k( 216) = ( 0.0325203 0.0563269 0.3093517), wk = 0.0038462 k( 217) = ( 0.0243902 0.0422451 0.3093517), wk = 0.0038462 k( 218) = ( 0.0162602 0.0281634 0.3093517), wk = 0.0038462 k( 219) = ( 0.0081301 0.0140817 0.3093517), wk = 0.0038462 k( 220) = ( 0.0000000 0.0000000 0.3093517), wk = 0.0038462 k( 221) = ( 0.5000000 0.2886751 0.3093517), wk = 0.0038462 k( 222) = ( 0.5000000 0.2886751 0.2930700), wk = 0.0038462 k( 223) = ( 0.5000000 0.2886751 0.2767883), wk = 0.0038462 k( 224) = ( 0.5000000 0.2886751 0.2605067), wk = 0.0038462 k( 225) = ( 0.5000000 0.2886751 0.2442250), wk = 0.0038462 k( 226) = ( 0.5000000 0.2886751 0.2279433), wk = 0.0038462 k( 227) = ( 0.5000000 0.2886751 0.2116617), wk = 0.0038462 k( 228) = ( 0.5000000 0.2886751 0.1953800), wk = 0.0038462 k( 229) = ( 0.5000000 0.2886751 0.1790983), wk = 0.0038462 k( 230) = ( 0.5000000 0.2886751 0.1628167), wk = 0.0038462 k( 231) = ( 0.5000000 0.2886751 0.1465350), wk = 0.0038462 k( 232) = ( 0.5000000 0.2886751 0.1302533), wk = 0.0038462 k( 233) = ( 0.5000000 0.2886751 0.1139717), wk = 0.0038462 k( 234) = ( 0.5000000 0.2886751 0.0976900), wk = 0.0038462 k( 235) = ( 0.5000000 0.2886751 0.0814083), wk = 0.0038462 k( 236) = ( 0.5000000 0.2886751 0.0651267), wk = 0.0038462 k( 237) = ( 0.5000000 0.2886751 0.0488450), wk = 0.0038462 k( 238) = ( 0.5000000 0.2886751 0.0325633), wk = 0.0038462 k( 239) = ( 0.5000000 0.2886751 0.0162817), wk = 0.0038462 k( 240) = ( 0.5000000 0.2886751 -0.0000000), wk = 0.0038462 k( 241) = ( 0.3333333 0.5773503 -0.0000000), wk = 0.0038462 k( 242) = ( 0.3333333 0.5773503 0.0162817), wk = 0.0038462 k( 243) = ( 0.3333333 0.5773503 0.0325633), wk = 0.0038462 k( 244) = ( 0.3333333 0.5773503 0.0488450), wk = 0.0038462 k( 245) = ( 0.3333333 0.5773503 0.0651267), wk = 0.0038462 k( 246) = ( 0.3333333 0.5773503 0.0814083), wk = 0.0038462 k( 247) = ( 0.3333333 0.5773503 0.0976900), wk = 0.0038462 k( 248) = ( 0.3333333 0.5773503 0.1139717), wk = 0.0038462 k( 249) = ( 0.3333333 0.5773503 0.1302533), wk = 0.0038462 k( 250) = ( 0.3333333 0.5773503 0.1465350), wk = 0.0038462 k( 251) = ( 0.3333333 0.5773503 0.1628167), wk = 0.0038462 k( 252) = ( 0.3333333 0.5773503 0.1790983), wk = 0.0038462 k( 253) = ( 0.3333333 0.5773503 0.1953800), wk = 0.0038462 k( 254) = ( 0.3333333 0.5773503 0.2116617), wk = 0.0038462 k( 255) = ( 0.3333333 0.5773503 0.2279433), wk = 0.0038462 k( 256) = ( 0.3333333 0.5773503 0.2442250), wk = 0.0038462 k( 257) = ( 0.3333333 0.5773503 0.2605067), wk = 0.0038462 k( 258) = ( 0.3333333 0.5773503 0.2767883), wk = 0.0038462 k( 259) = ( 0.3333333 0.5773503 0.2930700), wk = 0.0038462 k( 260) = ( 0.3333333 0.5773503 0.3093517), wk = 0.0038462 cryst. coord. k( 1) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0038462 k( 2) = ( 0.0142857 -0.0000000 0.0000000), wk = 0.0038462 k( 3) = ( 0.0285714 0.0000000 0.0000000), wk = 0.0038462 k( 4) = ( 0.0428571 0.0000000 0.0000000), wk = 0.0038462 k( 5) = ( 0.0571429 0.0000000 0.0000000), wk = 0.0038462 k( 6) = ( 0.0714286 -0.0000000 0.0000000), wk = 0.0038462 k( 7) = ( 0.0857143 0.0000000 0.0000000), wk = 0.0038462 k( 8) = ( 0.1000000 0.0000000 0.0000000), wk = 0.0038462 k( 9) = ( 0.1142857 0.0000000 0.0000000), wk = 0.0038462 k( 10) = ( 0.1285714 0.0000000 0.0000000), wk = 0.0038462 k( 11) = ( 0.1428571 -0.0000000 0.0000000), wk = 0.0038462 k( 12) = ( 0.1571429 0.0000000 0.0000000), wk = 0.0038462 k( 13) = ( 0.1714286 0.0000000 0.0000000), wk = 0.0038462 k( 14) = ( 0.1857143 0.0000000 0.0000000), wk = 0.0038462 k( 15) = ( 0.2000000 0.0000000 0.0000000), wk = 0.0038462 k( 16) = ( 0.2142857 0.0000000 -0.0000000), wk = 0.0038462 k( 17) = ( 0.2285714 0.0000000 0.0000000), wk = 0.0038462 k( 18) = ( 0.2428571 -0.0000000 0.0000000), wk = 0.0038462 k( 19) = ( 0.2571429 0.0000000 0.0000000), wk = 0.0038462 k( 20) = ( 0.2714286 0.0000000 0.0000000), wk = 0.0038462 k( 21) = ( 0.2857143 0.0000000 0.0000000), wk = 0.0038462 k( 22) = ( 0.3000000 0.0000000 0.0000000), wk = 0.0038462 k( 23) = ( 0.3142857 0.0000000 0.0000000), wk = 0.0038462 k( 24) = ( 0.3285714 0.0000000 0.0000000), wk = 0.0038462 k( 25) = ( 0.3428571 0.0000000 0.0000000), wk = 0.0038462 k( 26) = ( 0.3571429 0.0000000 0.0000000), wk = 0.0038462 k( 27) = ( 0.3714286 0.0000000 0.0000000), wk = 0.0038462 k( 28) = ( 0.3857143 0.0000000 0.0000000), wk = 0.0038462 k( 29) = ( 0.4000000 0.0000000 0.0000000), wk = 0.0038462 k( 30) = ( 0.4142857 0.0000000 0.0000000), wk = 0.0038462 k( 31) = ( 0.4285714 0.0000000 0.0000000), wk = 0.0038462 k( 32) = ( 0.4428571 -0.0000000 -0.0000000), wk = 0.0038462 k( 33) = ( 0.4571429 0.0000000 0.0000000), wk = 0.0038462 k( 34) = ( 0.4714286 0.0000000 0.0000000), wk = 0.0038462 k( 35) = ( 0.4857143 -0.0000000 0.0000000), wk = 0.0038462 k( 36) = ( 0.5000000 0.0000000 -0.0000000), wk = 0.0038462 k( 37) = ( 0.5000000 0.0000000 -0.0000000), wk = 0.0038462 k( 38) = ( 0.4920635 0.0158730 -0.0000000), wk = 0.0038462 k( 39) = ( 0.4841270 0.0317460 0.0000000), wk = 0.0038462 k( 40) = ( 0.4761905 0.0476191 0.0000000), wk = 0.0038462 k( 41) = ( 0.4682540 0.0634921 0.0000000), wk = 0.0038462 k( 42) = ( 0.4603175 0.0793651 0.0000000), wk = 0.0038462 k( 43) = ( 0.4523810 0.0952381 -0.0000000), wk = 0.0038462 k( 44) = ( 0.4444444 0.1111111 0.0000000), wk = 0.0038462 k( 45) = ( 0.4365079 0.1269841 0.0000000), wk = 0.0038462 k( 46) = ( 0.4285714 0.1428571 -0.0000000), wk = 0.0038462 k( 47) = ( 0.4206349 0.1587302 0.0000000), wk = 0.0038462 k( 48) = ( 0.4126984 0.1746032 0.0000000), wk = 0.0038462 k( 49) = ( 0.4047619 0.1904762 0.0000000), wk = 0.0038462 k( 50) = ( 0.3968254 0.2063492 0.0000000), wk = 0.0038462 k( 51) = ( 0.3888889 0.2222222 0.0000000), wk = 0.0038462 k( 52) = ( 0.3809524 0.2380952 -0.0000000), wk = 0.0038462 k( 53) = ( 0.3730159 0.2539683 -0.0000000), wk = 0.0038462 k( 54) = ( 0.3650794 0.2698413 0.0000000), wk = 0.0038462 k( 55) = ( 0.3571429 0.2857143 0.0000000), wk = 0.0038462 k( 56) = ( 0.3492063 0.3015873 -0.0000000), wk = 0.0038462 k( 57) = ( 0.3412698 0.3174603 0.0000000), wk = 0.0038462 k( 58) = ( 0.3333333 0.3333333 -0.0000000), wk = 0.0038462 k( 59) = ( 0.3333333 0.3333333 -0.0000000), wk = 0.0038462 k( 60) = ( 0.3252032 0.3252032 0.0000000), wk = 0.0038462 k( 61) = ( 0.3170732 0.3170732 0.0000000), wk = 0.0038462 k( 62) = ( 0.3089431 0.3089431 0.0000000), wk = 0.0038462 k( 63) = ( 0.3008130 0.3008130 0.0000000), wk = 0.0038462 k( 64) = ( 0.2926829 0.2926829 0.0000000), wk = 0.0038462 k( 65) = ( 0.2845529 0.2845529 0.0000000), wk = 0.0038462 k( 66) = ( 0.2764228 0.2764228 -0.0000000), wk = 0.0038462 k( 67) = ( 0.2682927 0.2682927 0.0000000), wk = 0.0038462 k( 68) = ( 0.2601626 0.2601626 0.0000000), wk = 0.0038462 k( 69) = ( 0.2520325 0.2520325 0.0000000), wk = 0.0038462 k( 70) = ( 0.2439024 0.2439024 -0.0000000), wk = 0.0038462 k( 71) = ( 0.2357724 0.2357724 -0.0000000), wk = 0.0038462 k( 72) = ( 0.2276423 0.2276423 -0.0000000), wk = 0.0038462 k( 73) = ( 0.2195122 0.2195122 0.0000000), wk = 0.0038462 k( 74) = ( 0.2113821 0.2113821 0.0000000), wk = 0.0038462 k( 75) = ( 0.2032520 0.2032520 0.0000000), wk = 0.0038462 k( 76) = ( 0.1951219 0.1951219 -0.0000000), wk = 0.0038462 k( 77) = ( 0.1869919 0.1869919 -0.0000000), wk = 0.0038462 k( 78) = ( 0.1788618 0.1788618 -0.0000000), wk = 0.0038462 k( 79) = ( 0.1707317 0.1707317 0.0000000), wk = 0.0038462 k( 80) = ( 0.1626016 0.1626016 0.0000000), wk = 0.0038462 k( 81) = ( 0.1544715 0.1544715 -0.0000000), wk = 0.0038462 k( 82) = ( 0.1463415 0.1463415 0.0000000), wk = 0.0038462 k( 83) = ( 0.1382114 0.1382114 -0.0000000), wk = 0.0038462 k( 84) = ( 0.1300813 0.1300813 0.0000000), wk = 0.0038462 k( 85) = ( 0.1219512 0.1219512 -0.0000000), wk = 0.0038462 k( 86) = ( 0.1138211 0.1138211 -0.0000000), wk = 0.0038462 k( 87) = ( 0.1056911 0.1056911 -0.0000000), wk = 0.0038462 k( 88) = ( 0.0975610 0.0975610 -0.0000000), wk = 0.0038462 k( 89) = ( 0.0894309 0.0894309 0.0000000), wk = 0.0038462 k( 90) = ( 0.0813008 0.0813008 0.0000000), wk = 0.0038462 k( 91) = ( 0.0731707 0.0731707 0.0000000), wk = 0.0038462 k( 92) = ( 0.0650407 0.0650407 0.0000000), wk = 0.0038462 k( 93) = ( 0.0569106 0.0569106 -0.0000000), wk = 0.0038462 k( 94) = ( 0.0487805 0.0487805 -0.0000000), wk = 0.0038462 k( 95) = ( 0.0406504 0.0406504 0.0000000), wk = 0.0038462 k( 96) = ( 0.0325203 0.0325203 -0.0000000), wk = 0.0038462 k( 97) = ( 0.0243902 0.0243902 -0.0000000), wk = 0.0038462 k( 98) = ( 0.0162602 0.0162602 0.0000000), wk = 0.0038462 k( 99) = ( 0.0081301 0.0081301 0.0000000), wk = 0.0038462 k( 100) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0038462 k( 101) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0038462 k( 102) = ( 0.0000000 0.0000000 0.0263158), wk = 0.0038462 k( 103) = ( 0.0000000 0.0000000 0.0526316), wk = 0.0038462 k( 104) = ( 0.0000000 0.0000000 0.0789474), wk = 0.0038462 k( 105) = ( 0.0000000 0.0000000 0.1052632), wk = 0.0038462 k( 106) = ( 0.0000000 0.0000000 0.1315790), wk = 0.0038462 k( 107) = ( 0.0000000 0.0000000 0.1578947), wk = 0.0038462 k( 108) = ( 0.0000000 0.0000000 0.1842105), wk = 0.0038462 k( 109) = ( 0.0000000 0.0000000 0.2105263), wk = 0.0038462 k( 110) = ( 0.0000000 0.0000000 0.2368421), wk = 0.0038462 k( 111) = ( 0.0000000 0.0000000 0.2631579), wk = 0.0038462 k( 112) = ( 0.0000000 0.0000000 0.2894737), wk = 0.0038462 k( 113) = ( 0.0000000 0.0000000 0.3157895), wk = 0.0038462 k( 114) = ( 0.0000000 0.0000000 0.3421053), wk = 0.0038462 k( 115) = ( 0.0000000 0.0000000 0.3684211), wk = 0.0038462 k( 116) = ( 0.0000000 0.0000000 0.3947368), wk = 0.0038462 k( 117) = ( 0.0000000 0.0000000 0.4210526), wk = 0.0038462 k( 118) = ( 0.0000000 0.0000000 0.4473684), wk = 0.0038462 k( 119) = ( 0.0000000 0.0000000 0.4736842), wk = 0.0038462 k( 120) = ( 0.0000000 0.0000000 0.5000000), wk = 0.0038462 k( 121) = ( 0.0000000 0.0000000 0.5000000), wk = 0.0038462 k( 122) = ( 0.0142857 -0.0000000 0.5000000), wk = 0.0038462 k( 123) = ( 0.0285714 0.0000000 0.5000000), wk = 0.0038462 k( 124) = ( 0.0428571 0.0000000 0.5000000), wk = 0.0038462 k( 125) = ( 0.0571429 0.0000000 0.5000000), wk = 0.0038462 k( 126) = ( 0.0714286 -0.0000000 0.5000000), wk = 0.0038462 k( 127) = ( 0.0857143 0.0000000 0.5000000), wk = 0.0038462 k( 128) = ( 0.1000000 0.0000000 0.5000000), wk = 0.0038462 k( 129) = ( 0.1142857 0.0000000 0.5000000), wk = 0.0038462 k( 130) = ( 0.1285714 0.0000000 0.5000000), wk = 0.0038462 k( 131) = ( 0.1428571 -0.0000000 0.5000000), wk = 0.0038462 k( 132) = ( 0.1571429 0.0000000 0.5000000), wk = 0.0038462 k( 133) = ( 0.1714286 0.0000000 0.5000000), wk = 0.0038462 k( 134) = ( 0.1857143 0.0000000 0.5000000), wk = 0.0038462 k( 135) = ( 0.2000000 0.0000000 0.5000000), wk = 0.0038462 k( 136) = ( 0.2142857 0.0000000 0.5000000), wk = 0.0038462 k( 137) = ( 0.2285714 0.0000000 0.5000000), wk = 0.0038462 k( 138) = ( 0.2428571 -0.0000000 0.5000000), wk = 0.0038462 k( 139) = ( 0.2571429 0.0000000 0.5000000), wk = 0.0038462 k( 140) = ( 0.2714286 0.0000000 0.5000000), wk = 0.0038462 k( 141) = ( 0.2857143 0.0000000 0.5000000), wk = 0.0038462 k( 142) = ( 0.3000000 0.0000000 0.5000000), wk = 0.0038462 k( 143) = ( 0.3142857 0.0000000 0.5000000), wk = 0.0038462 k( 144) = ( 0.3285714 0.0000000 0.5000000), wk = 0.0038462 k( 145) = ( 0.3428571 0.0000000 0.5000000), wk = 0.0038462 k( 146) = ( 0.3571429 0.0000000 0.5000000), wk = 0.0038462 k( 147) = ( 0.3714286 0.0000000 0.5000000), wk = 0.0038462 k( 148) = ( 0.3857143 0.0000000 0.5000000), wk = 0.0038462 k( 149) = ( 0.4000000 0.0000000 0.5000000), wk = 0.0038462 k( 150) = ( 0.4142857 0.0000000 0.5000000), wk = 0.0038462 k( 151) = ( 0.4285714 0.0000000 0.5000000), wk = 0.0038462 k( 152) = ( 0.4428571 -0.0000000 0.5000000), wk = 0.0038462 k( 153) = ( 0.4571429 0.0000000 0.5000000), wk = 0.0038462 k( 154) = ( 0.4714286 0.0000000 0.5000000), wk = 0.0038462 k( 155) = ( 0.4857143 -0.0000000 0.5000000), wk = 0.0038462 k( 156) = ( 0.5000000 0.0000000 0.5000000), wk = 0.0038462 k( 157) = ( 0.5000000 0.0000000 0.5000000), wk = 0.0038462 k( 158) = ( 0.4920635 0.0158730 0.5000000), wk = 0.0038462 k( 159) = ( 0.4841270 0.0317460 0.5000000), wk = 0.0038462 k( 160) = ( 0.4761905 0.0476191 0.5000000), wk = 0.0038462 k( 161) = ( 0.4682540 0.0634921 0.5000000), wk = 0.0038462 k( 162) = ( 0.4603175 0.0793651 0.5000000), wk = 0.0038462 k( 163) = ( 0.4523810 0.0952381 0.5000000), wk = 0.0038462 k( 164) = ( 0.4444444 0.1111111 0.5000000), wk = 0.0038462 k( 165) = ( 0.4365079 0.1269841 0.5000000), wk = 0.0038462 k( 166) = ( 0.4285714 0.1428571 0.5000000), wk = 0.0038462 k( 167) = ( 0.4206349 0.1587302 0.5000000), wk = 0.0038462 k( 168) = ( 0.4126984 0.1746032 0.5000000), wk = 0.0038462 k( 169) = ( 0.4047619 0.1904762 0.5000000), wk = 0.0038462 k( 170) = ( 0.3968254 0.2063492 0.5000000), wk = 0.0038462 k( 171) = ( 0.3888889 0.2222222 0.5000000), wk = 0.0038462 k( 172) = ( 0.3809524 0.2380952 0.5000000), wk = 0.0038462 k( 173) = ( 0.3730159 0.2539683 0.5000000), wk = 0.0038462 k( 174) = ( 0.3650794 0.2698413 0.5000000), wk = 0.0038462 k( 175) = ( 0.3571429 0.2857143 0.5000000), wk = 0.0038462 k( 176) = ( 0.3492063 0.3015873 0.5000000), wk = 0.0038462 k( 177) = ( 0.3412698 0.3174603 0.5000000), wk = 0.0038462 k( 178) = ( 0.3333333 0.3333333 0.5000000), wk = 0.0038462 k( 179) = ( 0.3333333 0.3333333 0.5000000), wk = 0.0038462 k( 180) = ( 0.3252032 0.3252032 0.5000000), wk = 0.0038462 k( 181) = ( 0.3170732 0.3170732 0.5000000), wk = 0.0038462 k( 182) = ( 0.3089431 0.3089431 0.5000000), wk = 0.0038462 k( 183) = ( 0.3008130 0.3008130 0.5000000), wk = 0.0038462 k( 184) = ( 0.2926829 0.2926829 0.5000000), wk = 0.0038462 k( 185) = ( 0.2845529 0.2845529 0.5000000), wk = 0.0038462 k( 186) = ( 0.2764228 0.2764228 0.5000000), wk = 0.0038462 k( 187) = ( 0.2682927 0.2682927 0.5000000), wk = 0.0038462 k( 188) = ( 0.2601626 0.2601626 0.5000000), wk = 0.0038462 k( 189) = ( 0.2520325 0.2520325 0.5000000), wk = 0.0038462 k( 190) = ( 0.2439024 0.2439024 0.5000000), wk = 0.0038462 k( 191) = ( 0.2357724 0.2357724 0.5000000), wk = 0.0038462 k( 192) = ( 0.2276423 0.2276423 0.5000000), wk = 0.0038462 k( 193) = ( 0.2195122 0.2195122 0.5000000), wk = 0.0038462 k( 194) = ( 0.2113821 0.2113821 0.5000000), wk = 0.0038462 k( 195) = ( 0.2032520 0.2032520 0.5000000), wk = 0.0038462 k( 196) = ( 0.1951219 0.1951219 0.5000000), wk = 0.0038462 k( 197) = ( 0.1869919 0.1869919 0.5000000), wk = 0.0038462 k( 198) = ( 0.1788618 0.1788618 0.5000000), wk = 0.0038462 k( 199) = ( 0.1707317 0.1707317 0.5000000), wk = 0.0038462 k( 200) = ( 0.1626016 0.1626016 0.5000000), wk = 0.0038462 k( 201) = ( 0.1544715 0.1544715 0.5000000), wk = 0.0038462 k( 202) = ( 0.1463415 0.1463415 0.5000000), wk = 0.0038462 k( 203) = ( 0.1382114 0.1382114 0.5000000), wk = 0.0038462 k( 204) = ( 0.1300813 0.1300813 0.5000000), wk = 0.0038462 k( 205) = ( 0.1219512 0.1219512 0.5000000), wk = 0.0038462 k( 206) = ( 0.1138211 0.1138211 0.5000000), wk = 0.0038462 k( 207) = ( 0.1056911 0.1056911 0.5000000), wk = 0.0038462 k( 208) = ( 0.0975610 0.0975610 0.5000000), wk = 0.0038462 k( 209) = ( 0.0894309 0.0894309 0.5000000), wk = 0.0038462 k( 210) = ( 0.0813008 0.0813008 0.5000000), wk = 0.0038462 k( 211) = ( 0.0731707 0.0731707 0.5000000), wk = 0.0038462 k( 212) = ( 0.0650407 0.0650407 0.5000000), wk = 0.0038462 k( 213) = ( 0.0569106 0.0569106 0.5000000), wk = 0.0038462 k( 214) = ( 0.0487805 0.0487805 0.5000000), wk = 0.0038462 k( 215) = ( 0.0406504 0.0406504 0.5000000), wk = 0.0038462 k( 216) = ( 0.0325203 0.0325203 0.5000000), wk = 0.0038462 k( 217) = ( 0.0243902 0.0243902 0.5000000), wk = 0.0038462 k( 218) = ( 0.0162602 0.0162602 0.5000000), wk = 0.0038462 k( 219) = ( 0.0081301 0.0081301 0.5000000), wk = 0.0038462 k( 220) = ( 0.0000000 0.0000000 0.5000000), wk = 0.0038462 k( 221) = ( 0.5000000 0.0000000 0.5000000), wk = 0.0038462 k( 222) = ( 0.5000000 0.0000000 0.4736842), wk = 0.0038462 k( 223) = ( 0.5000000 0.0000000 0.4473684), wk = 0.0038462 k( 224) = ( 0.5000000 0.0000000 0.4210526), wk = 0.0038462 k( 225) = ( 0.5000000 0.0000000 0.3947368), wk = 0.0038462 k( 226) = ( 0.5000000 0.0000000 0.3684211), wk = 0.0038462 k( 227) = ( 0.5000000 0.0000000 0.3421053), wk = 0.0038462 k( 228) = ( 0.5000000 0.0000000 0.3157895), wk = 0.0038462 k( 229) = ( 0.5000000 0.0000000 0.2894737), wk = 0.0038462 k( 230) = ( 0.5000000 0.0000000 0.2631579), wk = 0.0038462 k( 231) = ( 0.5000000 0.0000000 0.2368421), wk = 0.0038462 k( 232) = ( 0.5000000 0.0000000 0.2105263), wk = 0.0038462 k( 233) = ( 0.5000000 0.0000000 0.1842105), wk = 0.0038462 k( 234) = ( 0.5000000 0.0000000 0.1578947), wk = 0.0038462 k( 235) = ( 0.5000000 0.0000000 0.1315790), wk = 0.0038462 k( 236) = ( 0.5000000 0.0000000 0.1052632), wk = 0.0038462 k( 237) = ( 0.5000000 0.0000000 0.0789474), wk = 0.0038462 k( 238) = ( 0.5000000 0.0000000 0.0526316), wk = 0.0038462 k( 239) = ( 0.5000000 0.0000000 0.0263158), wk = 0.0038462 k( 240) = ( 0.5000000 0.0000000 -0.0000000), wk = 0.0038462 k( 241) = ( 0.3333333 0.3333333 -0.0000000), wk = 0.0038462 k( 242) = ( 0.3333333 0.3333333 0.0263158), wk = 0.0038462 k( 243) = ( 0.3333333 0.3333333 0.0526316), wk = 0.0038462 k( 244) = ( 0.3333333 0.3333333 0.0789474), wk = 0.0038462 k( 245) = ( 0.3333333 0.3333333 0.1052632), wk = 0.0038462 k( 246) = ( 0.3333333 0.3333333 0.1315790), wk = 0.0038462 k( 247) = ( 0.3333333 0.3333333 0.1578947), wk = 0.0038462 k( 248) = ( 0.3333333 0.3333333 0.1842105), wk = 0.0038462 k( 249) = ( 0.3333333 0.3333333 0.2105263), wk = 0.0038462 k( 250) = ( 0.3333333 0.3333333 0.2368421), wk = 0.0038462 k( 251) = ( 0.3333333 0.3333333 0.2631579), wk = 0.0038462 k( 252) = ( 0.3333333 0.3333333 0.2894737), wk = 0.0038462 k( 253) = ( 0.3333333 0.3333333 0.3157895), wk = 0.0038462 k( 254) = ( 0.3333333 0.3333333 0.3421053), wk = 0.0038462 k( 255) = ( 0.3333333 0.3333333 0.3684211), wk = 0.0038462 k( 256) = ( 0.3333333 0.3333333 0.3947368), wk = 0.0038462 k( 257) = ( 0.3333333 0.3333333 0.4210526), wk = 0.0038462 k( 258) = ( 0.3333333 0.3333333 0.4473684), wk = 0.0038462 k( 259) = ( 0.3333333 0.3333333 0.4736842), wk = 0.0038462 k( 260) = ( 0.3333333 0.3333333 0.5000000), wk = 0.0038462 Dense grid: 69529 G-vectors FFT dimensions: ( 45, 45, 75) Smooth grid: 54705 G-vectors FFT dimensions: ( 45, 45, 72) Largest allocated arrays est. size (Mb) dimensions Kohn-Sham Wavefunctions 0.50 Mb ( 384, 86) NL pseudopotentials 0.60 Mb ( 192, 206) Each V/rho on FFT grid 0.09 Mb ( 6075) Each G-vector array 0.01 Mb ( 1931) G-vector shells 0.01 Mb ( 894) Largest temporary arrays est. size (Mb) dimensions Auxiliary wavefunctions 2.02 Mb ( 384, 344) Each subspace H/S matrix 0.11 Mb ( 86, 86) Each matrix 0.54 Mb ( 206, 2, 86) The potential is recalculated from file : ./BaTl2.save/charge-density.dat Starting wfc are 92 randomized atomic wfcs Band Structure Calculation Davidson diagonalization with overlap Computing kpt #: 1 total cpu time spent up to now is 3.3 secs Computing kpt #: 2 total cpu time spent up to now is 4.5 secs Computing kpt #: 3 total cpu time spent up to now is 5.6 secs Computing kpt #: 4 total cpu time spent up to now is 6.8 secs Computing kpt #: 5 total cpu time spent up to now is 7.9 secs Computing kpt #: 6 total cpu time spent up to now is 9.0 secs Computing kpt #: 7 total cpu time spent up to now is 10.0 secs Computing kpt #: 8 total cpu time spent up to now is 11.2 secs Computing kpt #: 9 total cpu time spent up to now is 12.3 secs Computing kpt #: 10 total cpu time spent up to now is 13.6 secs Computing kpt #: 11 total cpu time spent up to now is 14.8 secs Computing kpt #: 12 total cpu time spent up to now is 16.0 secs Computing kpt #: 13 total cpu time spent up to now is 17.2 secs Computing kpt #: 14 total cpu time spent up to now is 18.3 secs Computing kpt #: 15 total cpu time spent up to now is 19.4 secs Computing kpt #: 16 total cpu time spent up to now is 20.5 secs Computing kpt #: 17 total cpu time spent up to now is 21.7 secs Computing kpt #: 18 total cpu time spent up to now is 22.8 secs Computing kpt #: 19 total cpu time spent up to now is 24.0 secs Computing kpt #: 20 total cpu time spent up to now is 25.2 secs Computing kpt #: 21 total cpu time spent up to now is 26.4 secs Computing kpt #: 22 total cpu time spent up to now is 27.6 secs Computing kpt #: 23 total cpu time spent up to now is 28.8 secs Computing kpt #: 24 total cpu time spent up to now is 30.0 secs Computing kpt #: 25 total cpu time spent up to now is 31.3 secs Computing kpt #: 26 total cpu time spent up to now is 32.5 secs Computing kpt #: 27 total cpu time spent up to now is 33.8 secs Computing kpt #: 28 total cpu time spent up to now is 35.2 secs Computing kpt #: 29 total cpu time spent up to now is 36.6 secs Computing kpt #: 30 total cpu time spent up to now is 38.0 secs Computing kpt #: 31 total cpu time spent up to now is 39.3 secs Computing kpt #: 32 total cpu time spent up to now is 40.6 secs Computing kpt #: 33 total cpu time spent up to now is 41.9 secs Computing kpt #: 34 total cpu time spent up to now is 43.1 secs Computing kpt #: 35 total cpu time spent up to now is 44.4 secs Computing kpt #: 36 total cpu time spent up to now is 45.6 secs Computing kpt #: 37 total cpu time spent up to now is 46.9 secs Computing kpt #: 38 total cpu time spent up to now is 48.1 secs Computing kpt #: 39 total cpu time spent up to now is 49.3 secs Computing kpt #: 40 total cpu time spent up to now is 50.6 secs Computing kpt #: 41 total cpu time spent up to now is 51.8 secs Computing kpt #: 42 total cpu time spent up to now is 53.1 secs Computing kpt #: 43 total cpu time spent up to now is 54.3 secs Computing kpt #: 44 total cpu time spent up to now is 55.5 secs Computing kpt #: 45 total cpu time spent up to now is 56.7 secs Computing kpt #: 46 total cpu time spent up to now is 57.8 secs Computing kpt #: 47 total cpu time spent up to now is 59.0 secs Computing kpt #: 48 total cpu time spent up to now is 60.1 secs Computing kpt #: 49 total cpu time spent up to now is 61.2 secs Computing kpt #: 50 total cpu time spent up to now is 62.4 secs Computing kpt #: 51 total cpu time spent up to now is 63.5 secs Computing kpt #: 52 total cpu time spent up to now is 64.8 secs Computing kpt #: 53 total cpu time spent up to now is 65.9 secs Computing kpt #: 54 total cpu time spent up to now is 67.2 secs Computing kpt #: 55 total cpu time spent up to now is 68.4 secs Computing kpt #: 56 total cpu time spent up to now is 69.7 secs Computing kpt #: 57 total cpu time spent up to now is 70.9 secs Computing kpt #: 58 total cpu time spent up to now is 72.2 secs Computing kpt #: 59 total cpu time spent up to now is 73.4 secs Computing kpt #: 60 total cpu time spent up to now is 74.6 secs Computing kpt #: 61 total cpu time spent up to now is 75.9 secs Computing kpt #: 62 total cpu time spent up to now is 77.0 secs Computing kpt #: 63 total cpu time spent up to now is 78.2 secs Computing kpt #: 64 total cpu time spent up to now is 79.5 secs Computing kpt #: 65 total cpu time spent up to now is 80.7 secs Computing kpt #: 66 total cpu time spent up to now is 81.8 secs Computing kpt #: 67 total cpu time spent up to now is 82.9 secs Computing kpt #: 68 total cpu time spent up to now is 84.0 secs Computing kpt #: 69 total cpu time spent up to now is 85.1 secs Computing kpt #: 70 total cpu time spent up to now is 86.3 secs Computing kpt #: 71 total cpu time spent up to now is 87.5 secs Computing kpt #: 72 total cpu time spent up to now is 88.6 secs Computing kpt #: 73 total cpu time spent up to now is 89.7 secs Computing kpt #: 74 total cpu time spent up to now is 90.9 secs Computing kpt #: 75 total cpu time spent up to now is 92.0 secs Computing kpt #: 76 total cpu time spent up to now is 93.1 secs Computing kpt #: 77 total cpu time spent up to now is 94.3 secs Computing kpt #: 78 total cpu time spent up to now is 95.4 secs Computing kpt #: 79 total cpu time spent up to now is 96.6 secs Computing kpt #: 80 total cpu time spent up to now is 97.7 secs Computing kpt #: 81 total cpu time spent up to now is 98.9 secs Computing kpt #: 82 total cpu time spent up to now is 100.0 secs Computing kpt #: 83 total cpu time spent up to now is 101.1 secs Computing kpt #: 84 total cpu time spent up to now is 102.3 secs Computing kpt #: 85 total cpu time spent up to now is 103.4 secs Computing kpt #: 86 total cpu time spent up to now is 104.6 secs Computing kpt #: 87 total cpu time spent up to now is 105.8 secs Computing kpt #: 88 total cpu time spent up to now is 106.9 secs Computing kpt #: 89 total cpu time spent up to now is 108.1 secs Computing kpt #: 90 total cpu time spent up to now is 109.3 secs Computing kpt #: 91 total cpu time spent up to now is 110.6 secs Computing kpt #: 92 total cpu time spent up to now is 111.7 secs Computing kpt #: 93 total cpu time spent up to now is 112.8 secs Computing kpt #: 94 total cpu time spent up to now is 113.9 secs Computing kpt #: 95 total cpu time spent up to now is 115.0 secs Computing kpt #: 96 total cpu time spent up to now is 116.1 secs Computing kpt #: 97 total cpu time spent up to now is 117.3 secs Computing kpt #: 98 total cpu time spent up to now is 118.4 secs Computing kpt #: 99 total cpu time spent up to now is 119.6 secs Computing kpt #: 100 total cpu time spent up to now is 120.8 secs Computing kpt #: 101 total cpu time spent up to now is 122.0 secs Computing kpt #: 102 total cpu time spent up to now is 123.1 secs Computing kpt #: 103 total cpu time spent up to now is 124.3 secs Computing kpt #: 104 total cpu time spent up to now is 125.5 secs Computing kpt #: 105 total cpu time spent up to now is 126.6 secs Computing kpt #: 106 total cpu time spent up to now is 127.7 secs Computing kpt #: 107 total cpu time spent up to now is 128.8 secs Computing kpt #: 108 total cpu time spent up to now is 129.9 secs Computing kpt #: 109 total cpu time spent up to now is 131.0 secs Computing kpt #: 110 total cpu time spent up to now is 132.1 secs Computing kpt #: 111 total cpu time spent up to now is 133.1 secs Computing kpt #: 112 total cpu time spent up to now is 134.2 secs Computing kpt #: 113 total cpu time spent up to now is 135.3 secs Computing kpt #: 114 total cpu time spent up to now is 136.3 secs Computing kpt #: 115 total cpu time spent up to now is 137.4 secs Computing kpt #: 116 total cpu time spent up to now is 138.4 secs Computing kpt #: 117 total cpu time spent up to now is 139.5 secs Computing kpt #: 118 total cpu time spent up to now is 140.6 secs Computing kpt #: 119 total cpu time spent up to now is 141.8 secs Computing kpt #: 120 total cpu time spent up to now is 143.2 secs Computing kpt #: 121 total cpu time spent up to now is 144.6 secs Computing kpt #: 122 total cpu time spent up to now is 145.8 secs Computing kpt #: 123 total cpu time spent up to now is 147.2 secs Computing kpt #: 124 total cpu time spent up to now is 148.6 secs Computing kpt #: 125 total cpu time spent up to now is 150.1 secs Computing kpt #: 126 total cpu time spent up to now is 151.2 secs Computing kpt #: 127 total cpu time spent up to now is 152.4 secs Computing kpt #: 128 total cpu time spent up to now is 153.5 secs Computing kpt #: 129 total cpu time spent up to now is 154.7 secs Computing kpt #: 130 total cpu time spent up to now is 155.9 secs Computing kpt #: 131 total cpu time spent up to now is 157.1 secs Computing kpt #: 132 total cpu time spent up to now is 158.3 secs Computing kpt #: 133 total cpu time spent up to now is 159.4 secs Computing kpt #: 134 total cpu time spent up to now is 160.6 secs Computing kpt #: 135 total cpu time spent up to now is 161.7 secs Computing kpt #: 136 total cpu time spent up to now is 162.9 secs Computing kpt #: 137 total cpu time spent up to now is 164.0 secs Computing kpt #: 138 total cpu time spent up to now is 165.5 secs Computing kpt #: 139 total cpu time spent up to now is 166.9 secs Computing kpt #: 140 total cpu time spent up to now is 168.0 secs Computing kpt #: 141 total cpu time spent up to now is 169.4 secs Computing kpt #: 142 total cpu time spent up to now is 170.6 secs Computing kpt #: 143 total cpu time spent up to now is 171.7 secs Computing kpt #: 144 total cpu time spent up to now is 172.9 secs Computing kpt #: 145 total cpu time spent up to now is 174.0 secs Computing kpt #: 146 total cpu time spent up to now is 175.2 secs Computing kpt #: 147 total cpu time spent up to now is 176.4 secs Computing kpt #: 148 total cpu time spent up to now is 177.6 secs Computing kpt #: 149 total cpu time spent up to now is 178.8 secs Computing kpt #: 150 total cpu time spent up to now is 180.0 secs Computing kpt #: 151 total cpu time spent up to now is 181.1 secs Computing kpt #: 152 total cpu time spent up to now is 182.3 secs Computing kpt #: 153 total cpu time spent up to now is 183.5 secs Computing kpt #: 154 total cpu time spent up to now is 184.7 secs Computing kpt #: 155 total cpu time spent up to now is 185.9 secs Computing kpt #: 156 total cpu time spent up to now is 187.1 secs Computing kpt #: 157 total cpu time spent up to now is 188.3 secs Computing kpt #: 158 total cpu time spent up to now is 189.5 secs Computing kpt #: 159 total cpu time spent up to now is 190.7 secs Computing kpt #: 160 total cpu time spent up to now is 191.9 secs Computing kpt #: 161 total cpu time spent up to now is 193.1 secs Computing kpt #: 162 total cpu time spent up to now is 194.3 secs Computing kpt #: 163 total cpu time spent up to now is 195.5 secs Computing kpt #: 164 total cpu time spent up to now is 196.8 secs Computing kpt #: 165 total cpu time spent up to now is 198.0 secs Computing kpt #: 166 total cpu time spent up to now is 199.2 secs Computing kpt #: 167 total cpu time spent up to now is 200.5 secs Computing kpt #: 168 total cpu time spent up to now is 201.7 secs Computing kpt #: 169 total cpu time spent up to now is 202.9 secs Computing kpt #: 170 total cpu time spent up to now is 204.2 secs Computing kpt #: 171 total cpu time spent up to now is 205.4 secs Computing kpt #: 172 total cpu time spent up to now is 206.6 secs Computing kpt #: 173 total cpu time spent up to now is 207.9 secs Computing kpt #: 174 total cpu time spent up to now is 209.2 secs Computing kpt #: 175 total cpu time spent up to now is 210.4 secs Computing kpt #: 176 total cpu time spent up to now is 211.7 secs Computing kpt #: 177 total cpu time spent up to now is 212.9 secs Computing kpt #: 178 total cpu time spent up to now is 214.2 secs Computing kpt #: 179 total cpu time spent up to now is 215.4 secs Computing kpt #: 180 total cpu time spent up to now is 216.7 secs Computing kpt #: 181 total cpu time spent up to now is 217.9 secs Computing kpt #: 182 total cpu time spent up to now is 219.2 secs Computing kpt #: 183 total cpu time spent up to now is 220.4 secs Computing kpt #: 184 total cpu time spent up to now is 221.6 secs Computing kpt #: 185 total cpu time spent up to now is 222.9 secs Computing kpt #: 186 total cpu time spent up to now is 224.1 secs Computing kpt #: 187 total cpu time spent up to now is 225.4 secs Computing kpt #: 188 total cpu time spent up to now is 226.6 secs Computing kpt #: 189 total cpu time spent up to now is 227.9 secs Computing kpt #: 190 total cpu time spent up to now is 229.1 secs Computing kpt #: 191 total cpu time spent up to now is 230.4 secs Computing kpt #: 192 total cpu time spent up to now is 231.7 secs Computing kpt #: 193 total cpu time spent up to now is 232.9 secs Computing kpt #: 194 total cpu time spent up to now is 234.2 secs Computing kpt #: 195 total cpu time spent up to now is 235.6 secs Computing kpt #: 196 total cpu time spent up to now is 236.9 secs Computing kpt #: 197 total cpu time spent up to now is 238.5 secs Computing kpt #: 198 total cpu time spent up to now is 239.8 secs Computing kpt #: 199 total cpu time spent up to now is 241.0 secs Computing kpt #: 200 total cpu time spent up to now is 242.2 secs Computing kpt #: 201 total cpu time spent up to now is 243.3 secs Computing kpt #: 202 total cpu time spent up to now is 244.5 secs Computing kpt #: 203 total cpu time spent up to now is 245.6 secs Computing kpt #: 204 total cpu time spent up to now is 246.9 secs Computing kpt #: 205 total cpu time spent up to now is 248.0 secs Computing kpt #: 206 total cpu time spent up to now is 249.2 secs Computing kpt #: 207 total cpu time spent up to now is 250.4 secs Computing kpt #: 208 total cpu time spent up to now is 251.6 secs Computing kpt #: 209 total cpu time spent up to now is 252.8 secs Computing kpt #: 210 total cpu time spent up to now is 254.1 secs Computing kpt #: 211 total cpu time spent up to now is 255.3 secs Computing kpt #: 212 total cpu time spent up to now is 256.6 secs Computing kpt #: 213 total cpu time spent up to now is 257.9 secs Computing kpt #: 214 total cpu time spent up to now is 259.2 secs Computing kpt #: 215 total cpu time spent up to now is 260.4 secs Computing kpt #: 216 total cpu time spent up to now is 261.7 secs Computing kpt #: 217 total cpu time spent up to now is 263.0 secs Computing kpt #: 218 total cpu time spent up to now is 264.4 secs Computing kpt #: 219 total cpu time spent up to now is 265.9 secs Computing kpt #: 220 total cpu time spent up to now is 267.0 secs Computing kpt #: 221 total cpu time spent up to now is 268.2 secs Computing kpt #: 222 total cpu time spent up to now is 269.4 secs Computing kpt #: 223 total cpu time spent up to now is 270.6 secs Computing kpt #: 224 total cpu time spent up to now is 271.9 secs Computing kpt #: 225 total cpu time spent up to now is 273.1 secs Computing kpt #: 226 total cpu time spent up to now is 274.3 secs Computing kpt #: 227 total cpu time spent up to now is 275.5 secs Computing kpt #: 228 total cpu time spent up to now is 276.7 secs Computing kpt #: 229 total cpu time spent up to now is 277.9 secs Computing kpt #: 230 total cpu time spent up to now is 279.1 secs Computing kpt #: 231 total cpu time spent up to now is 280.3 secs Computing kpt #: 232 total cpu time spent up to now is 281.4 secs Computing kpt #: 233 total cpu time spent up to now is 282.6 secs Computing kpt #: 234 total cpu time spent up to now is 283.8 secs Computing kpt #: 235 total cpu time spent up to now is 285.0 secs Computing kpt #: 236 total cpu time spent up to now is 286.3 secs Computing kpt #: 237 total cpu time spent up to now is 287.5 secs Computing kpt #: 238 total cpu time spent up to now is 288.8 secs Computing kpt #: 239 total cpu time spent up to now is 290.0 secs Computing kpt #: 240 total cpu time spent up to now is 291.2 secs Computing kpt #: 241 total cpu time spent up to now is 292.5 secs Computing kpt #: 242 total cpu time spent up to now is 293.8 secs Computing kpt #: 243 total cpu time spent up to now is 295.0 secs Computing kpt #: 244 total cpu time spent up to now is 296.3 secs Computing kpt #: 245 total cpu time spent up to now is 297.5 secs Computing kpt #: 246 total cpu time spent up to now is 298.8 secs Computing kpt #: 247 total cpu time spent up to now is 300.0 secs Computing kpt #: 248 total cpu time spent up to now is 301.2 secs Computing kpt #: 249 total cpu time spent up to now is 302.5 secs Computing kpt #: 250 total cpu time spent up to now is 303.7 secs Computing kpt #: 251 total cpu time spent up to now is 304.9 secs Computing kpt #: 252 total cpu time spent up to now is 306.2 secs Computing kpt #: 253 total cpu time spent up to now is 307.4 secs Computing kpt #: 254 total cpu time spent up to now is 308.6 secs Computing kpt #: 255 total cpu time spent up to now is 309.9 secs Computing kpt #: 256 total cpu time spent up to now is 311.1 secs Computing kpt #: 257 total cpu time spent up to now is 312.3 secs Computing kpt #: 258 total cpu time spent up to now is 313.5 secs Computing kpt #: 259 total cpu time spent up to now is 314.8 secs Computing kpt #: 260 total cpu time spent up to now is 316.0 secs ethr = 1.39E-08, avg # of iterations = 18.3 total cpu time spent up to now is 316.0 secs End of band structure calculation k = 0.0000 0.0000 0.0000 ( 6803 PWs) bands (ev): -18.1788 -18.1788 -18.1478 -18.1478 -4.9498 -4.9498 -4.8341 -4.8341 -3.2596 -3.2596 -3.1169 -3.1169 -3.0467 -3.0467 -2.8437 -2.8437 -2.6564 -2.6564 -2.6156 -2.6156 -2.5759 -2.5759 -2.5676 -2.5676 -2.4650 -2.4650 -2.4134 -2.4134 -2.3836 -2.3836 -2.2729 -2.2729 -0.6820 -0.6820 -0.5848 -0.5848 -0.5382 -0.5382 -0.4609 -0.4609 -0.3896 -0.3896 -0.3534 -0.3534 -0.3096 -0.3096 -0.3068 -0.3068 -0.2851 -0.2851 -0.2692 -0.2692 -0.2650 -0.2650 -0.1514 -0.1514 1.4308 1.4308 2.9894 2.9894 5.2450 5.2450 7.9116 7.9116 8.6440 8.6440 9.0336 9.0336 9.3228 9.3228 9.8057 9.8057 10.5689 10.5689 10.8620 10.8620 11.0438 11.0438 11.4125 11.4125 11.4257 11.4257 11.8542 11.8542 12.5532 12.5532 k = 0.0143 0.0082-0.0000 ( 6799 PWs) bands (ev): -18.1788 -18.1788 -18.1478 -18.1478 -4.9498 -4.9498 -4.8342 -4.8342 -3.2594 -3.2594 -3.1169 -3.1169 -3.0466 -3.0466 -2.8440 -2.8440 -2.6563 -2.6563 -2.6156 -2.6156 -2.5759 -2.5759 -2.5677 -2.5677 -2.4656 -2.4656 -2.4128 -2.4128 -2.3836 -2.3836 -2.2733 -2.2733 -0.6817 -0.6817 -0.5851 -0.5851 -0.5380 -0.5380 -0.4608 -0.4608 -0.3899 -0.3899 -0.3533 -0.3533 -0.3107 -0.3107 -0.3069 -0.3069 -0.2851 -0.2851 -0.2724 -0.2724 -0.2604 -0.2604 -0.1515 -0.1515 1.4329 1.4329 2.9901 2.9901 5.2443 5.2443 7.9037 7.9037 8.6283 8.6283 9.0272 9.0272 9.3505 9.3505 9.8022 9.8022 10.5579 10.5579 10.8397 10.8397 11.0620 11.0620 11.4190 11.4190 11.4474 11.4474 11.8491 11.8491 12.5497 12.5497 k = 0.0286 0.0165-0.0000 ( 6813 PWs) bands (ev): -18.1788 -18.1788 -18.1478 -18.1478 -4.9498 -4.9498 -4.8344 -4.8344 -3.2589 -3.2589 -3.1170 -3.1170 -3.0465 -3.0465 -2.8448 -2.8448 -2.6558 -2.6558 -2.6155 -2.6155 -2.5759 -2.5759 -2.5680 -2.5680 -2.4676 -2.4676 -2.4111 -2.4111 -2.3837 -2.3837 -2.2745 -2.2745 -0.6810 -0.6810 -0.5861 -0.5861 -0.5377 -0.5377 -0.4606 -0.4606 -0.3907 -0.3907 -0.3532 -0.3532 -0.3142 -0.3142 -0.3067 -0.3067 -0.2850 -0.2850 -0.2756 -0.2756 -0.2535 -0.2535 -0.1516 -0.1516 1.4392 1.4392 2.9922 2.9922 5.2423 5.2423 7.8802 7.8802 8.5850 8.5850 9.0154 9.0154 9.4218 9.4218 9.7919 9.7919 10.5289 10.5289 10.7838 10.7838 11.1119 11.1119 11.4183 11.4183 11.5218 11.5218 11.8354 11.8354 12.5408 12.5408 k = 0.0429 0.0247-0.0000 ( 6819 PWs) bands (ev): -18.1787 -18.1787 -18.1478 -18.1478 -4.9498 -4.9498 -4.8349 -4.8349 -3.2581 -3.2581 -3.1171 -3.1171 -3.0463 -3.0463 -2.8462 -2.8462 -2.6550 -2.6550 -2.6153 -2.6153 -2.5760 -2.5760 -2.5685 -2.5685 -2.4706 -2.4706 -2.4086 -2.4086 -2.3838 -2.3838 -2.2764 -2.2764 -0.6799 -0.6799 -0.5876 -0.5876 -0.5371 -0.5371 -0.4604 -0.4604 -0.3920 -0.3920 -0.3530 -0.3530 -0.3198 -0.3198 -0.3061 -0.3061 -0.2848 -0.2848 -0.2773 -0.2773 -0.2460 -0.2460 -0.1519 -0.1519 1.4497 1.4497 2.9957 2.9957 5.2389 5.2389 7.8416 7.8416 8.5235 8.5235 9.0067 9.0067 9.5190 9.5190 9.7755 9.7755 10.4891 10.4891 10.7129 10.7129 11.1839 11.1839 11.4152 11.4152 11.6250 11.6250 11.8172 11.8172 12.5289 12.5289 k = 0.0571 0.0330-0.0000 ( 6831 PWs) bands (ev): -18.1787 -18.1787 -18.1477 -18.1477 -4.9498 -4.9498 -4.8355 -4.8355 -3.2570 -3.2570 -3.1173 -3.1173 -3.0460 -3.0460 -2.8482 -2.8482 -2.6540 -2.6540 -2.6150 -2.6150 -2.5760 -2.5760 -2.5693 -2.5693 -2.4743 -2.4743 -2.4057 -2.4057 -2.3838 -2.3838 -2.2791 -2.2791 -0.6782 -0.6782 -0.5897 -0.5897 -0.5364 -0.5364 -0.4602 -0.4602 -0.3937 -0.3937 -0.3530 -0.3530 -0.3267 -0.3267 -0.3052 -0.3052 -0.2845 -0.2845 -0.2780 -0.2780 -0.2383 -0.2383 -0.1522 -0.1522 1.4643 1.4643 3.0005 3.0005 5.2338 5.2338 7.7890 7.7890 8.4525 8.4525 9.0028 9.0028 9.6302 9.6302 9.7541 9.7541 10.4433 10.4433 10.6400 10.6400 11.2691 11.2691 11.4102 11.4102 11.7401 11.7401 11.8035 11.8035 12.5164 12.5164 k = 0.0714 0.0412-0.0000 ( 6835 PWs) bands (ev): -18.1786 -18.1786 -18.1476 -18.1476 -4.9498 -4.9498 -4.8363 -4.8363 -3.2556 -3.2556 -3.1176 -3.1176 -3.0456 -3.0456 -2.8505 -2.8505 -2.6528 -2.6528 -2.6147 -2.6147 -2.5761 -2.5761 -2.5702 -2.5702 -2.4785 -2.4785 -2.4028 -2.4028 -2.3835 -2.3835 -2.2826 -2.2826 -0.6762 -0.6762 -0.5920 -0.5920 -0.5356 -0.5356 -0.4599 -0.4599 -0.3958 -0.3958 -0.3532 -0.3532 -0.3344 -0.3344 -0.3040 -0.3040 -0.2839 -0.2839 -0.2779 -0.2779 -0.2305 -0.2305 -0.1526 -0.1526 1.4830 1.4830 3.0068 3.0068 5.2268 5.2268 7.7236 7.7236 8.3787 8.3787 9.0028 9.0028 9.7166 9.7166 9.7606 9.7606 10.3929 10.3929 10.5735 10.5735 11.3549 11.3549 11.4088 11.4088 11.7774 11.7774 11.8814 11.8814 12.5064 12.5064 k = 0.0857 0.0495-0.0000 ( 6847 PWs) bands (ev): -18.1785 -18.1785 -18.1476 -18.1476 -4.9498 -4.9498 -4.8373 -4.8373 -3.2539 -3.2539 -3.1179 -3.1179 -3.0451 -3.0451 -2.8532 -2.8532 -2.6515 -2.6515 -2.6143 -2.6143 -2.5762 -2.5762 -2.5712 -2.5712 -2.4830 -2.4830 -2.4004 -2.4004 -2.3826 -2.3826 -2.2868 -2.2868 -0.6737 -0.6737 -0.5947 -0.5947 -0.5348 -0.5348 -0.4598 -0.4598 -0.3983 -0.3983 -0.3538 -0.3538 -0.3422 -0.3422 -0.3025 -0.3025 -0.2829 -0.2829 -0.2774 -0.2774 -0.2228 -0.2228 -0.1532 -0.1532 1.5058 1.5058 3.0144 3.0144 5.2177 5.2177 7.6468 7.6468 8.3060 8.3060 9.0057 9.0057 9.6894 9.6894 9.8794 9.8794 10.3374 10.3374 10.5199 10.5199 11.3767 11.3767 11.4680 11.4680 11.7770 11.7770 12.0101 12.0101 12.5037 12.5037 k = 0.1000 0.0577-0.0000 ( 6851 PWs) bands (ev): -18.1783 -18.1783 -18.1475 -18.1475 -4.9498 -4.9498 -4.8384 -4.8384 -3.2520 -3.2520 -3.1182 -3.1182 -3.0446 -3.0446 -2.8562 -2.8562 -2.6502 -2.6502 -2.6139 -2.6139 -2.5762 -2.5762 -2.5724 -2.5724 -2.4876 -2.4876 -2.3988 -2.3988 -2.3807 -2.3807 -2.2917 -2.2917 -0.6708 -0.6708 -0.5975 -0.5975 -0.5340 -0.5340 -0.4598 -0.4598 -0.4010 -0.4010 -0.3555 -0.3555 -0.3492 -0.3492 -0.3007 -0.3007 -0.2817 -0.2817 -0.2765 -0.2765 -0.2154 -0.2154 -0.1539 -0.1539 1.5325 1.5325 3.0233 3.0233 5.2060 5.2060 7.5602 7.5602 8.2370 8.2370 9.0107 9.0107 9.6518 9.6518 10.0018 10.0018 10.2768 10.2768 10.4850 10.4850 11.3616 11.3616 11.5510 11.5510 11.7943 11.7943 12.1323 12.1323 12.5183 12.5183 k = 0.1143 0.0660-0.0000 ( 6853 PWs) bands (ev): -18.1782 -18.1782 -18.1474 -18.1474 -4.9499 -4.9499 -4.8396 -4.8396 -3.2499 -3.2499 -3.1185 -3.1185 -3.0440 -3.0440 -2.8594 -2.8594 -2.6489 -2.6489 -2.6136 -2.6136 -2.5762 -2.5762 -2.5738 -2.5738 -2.4921 -2.4921 -2.3983 -2.3983 -2.3779 -2.3779 -2.2972 -2.2972 -0.6675 -0.6675 -0.6003 -0.6003 -0.5332 -0.5332 -0.4600 -0.4600 -0.4041 -0.4041 -0.3608 -0.3608 -0.3530 -0.3530 -0.2987 -0.2987 -0.2801 -0.2801 -0.2753 -0.2753 -0.2081 -0.2081 -0.1547 -0.1547 1.5632 1.5632 3.0336 3.0336 5.1915 5.1915 7.4654 7.4654 8.1734 8.1734 9.0176 9.0176 9.6086 9.6086 10.1120 10.1120 10.2143 10.2143 10.4763 10.4763 11.3399 11.3399 11.6153 11.6153 11.8411 11.8411 12.2294 12.2294 12.5676 12.5676 k = 0.1286 0.0742-0.0000 ( 6844 PWs) bands (ev): -18.1780 -18.1780 -18.1473 -18.1473 -4.9499 -4.9499 -4.8410 -4.8410 -3.2477 -3.2477 -3.1187 -3.1187 -3.0434 -3.0434 -2.8628 -2.8628 -2.6477 -2.6477 -2.6132 -2.6132 -2.5762 -2.5762 -2.5751 -2.5751 -2.4965 -2.4965 -2.3987 -2.3987 -2.3743 -2.3743 -2.3035 -2.3035 -0.6639 -0.6639 -0.6032 -0.6032 -0.5325 -0.5325 -0.4604 -0.4604 -0.4075 -0.4075 -0.3681 -0.3681 -0.3548 -0.3548 -0.2966 -0.2966 -0.2782 -0.2782 -0.2738 -0.2738 -0.2012 -0.2012 -0.1557 -0.1557 1.5978 1.5978 3.0451 3.0451 5.1737 5.1737 7.3640 7.3640 8.1162 8.1162 9.0258 9.0258 9.5602 9.5602 10.1374 10.1374 10.2076 10.2076 10.5075 10.5075 11.3140 11.3140 11.6566 11.6566 11.9170 11.9170 12.2894 12.2894 12.6642 12.6642 k = 0.1429 0.0825-0.0000 ( 6852 PWs) bands (ev): -18.1779 -18.1779 -18.1471 -18.1471 -4.9500 -4.9500 -4.8425 -4.8425 -3.2453 -3.2453 -3.1190 -3.1190 -3.0428 -3.0428 -2.8662 -2.8662 -2.6467 -2.6467 -2.6131 -2.6131 -2.5772 -2.5772 -2.5755 -2.5755 -2.5006 -2.5006 -2.3997 -2.3997 -2.3702 -2.3702 -2.3104 -2.3104 -0.6600 -0.6600 -0.6059 -0.6059 -0.5319 -0.5319 -0.4612 -0.4612 -0.4112 -0.4112 -0.3754 -0.3754 -0.3563 -0.3563 -0.2943 -0.2943 -0.2761 -0.2761 -0.2720 -0.2720 -0.1945 -0.1945 -0.1568 -0.1568 1.6361 1.6361 3.0580 3.0580 5.1523 5.1523 7.2574 7.2574 8.0663 8.0663 9.0352 9.0352 9.5073 9.5073 10.0730 10.0730 10.2518 10.2518 10.5870 10.5870 11.2847 11.2847 11.6859 11.6859 12.0064 12.0064 12.3252 12.3252 12.7210 12.7210 k = 0.1571 0.0907-0.0000 ( 6856 PWs) bands (ev): -18.1777 -18.1777 -18.1470 -18.1470 -4.9500 -4.9500 -4.8440 -4.8440 -3.2428 -3.2428 -3.1192 -3.1192 -3.0421 -3.0421 -2.8695 -2.8695 -2.6457 -2.6457 -2.6130 -2.6130 -2.5790 -2.5790 -2.5752 -2.5752 -2.5043 -2.5043 -2.4011 -2.4011 -2.3658 -2.3658 -2.3178 -2.3178 -0.6559 -0.6559 -0.6084 -0.6084 -0.5314 -0.5314 -0.4623 -0.4623 -0.4155 -0.4155 -0.3822 -0.3822 -0.3580 -0.3580 -0.2920 -0.2920 -0.2739 -0.2739 -0.2697 -0.2697 -0.1882 -0.1882 -0.1580 -0.1580 1.6780 1.6780 3.0721 3.0721 5.1270 5.1270 7.1468 7.1468 8.0241 8.0241 9.0457 9.0457 9.4504 9.4504 10.0051 10.0051 10.2743 10.2743 10.6986 10.6986 11.2524 11.2524 11.7127 11.7127 12.0940 12.0940 12.3568 12.3568 12.6988 12.6988 k = 0.1714 0.0990-0.0000 ( 6860 PWs) bands (ev): -18.1775 -18.1775 -18.1469 -18.1469 -4.9501 -4.9501 -4.8457 -4.8457 -3.2402 -3.2402 -3.1194 -3.1194 -3.0415 -3.0415 -2.8729 -2.8729 -2.6450 -2.6450 -2.6133 -2.6133 -2.5810 -2.5810 -2.5747 -2.5747 -2.5074 -2.5074 -2.4029 -2.4029 -2.3614 -2.3614 -2.3258 -2.3258 -0.6515 -0.6515 -0.6108 -0.6108 -0.5311 -0.5311 -0.4637 -0.4637 -0.4202 -0.4202 -0.3884 -0.3884 -0.3596 -0.3596 -0.2897 -0.2897 -0.2715 -0.2715 -0.2670 -0.2670 -0.1823 -0.1823 -0.1595 -0.1595 1.7235 1.7235 3.0874 3.0874 5.0975 5.0975 7.0336 7.0336 7.9898 7.9898 9.0570 9.0570 9.3907 9.3907 9.9369 9.9369 10.2890 10.2890 10.8222 10.8222 11.2184 11.2184 11.7413 11.7413 12.1688 12.1688 12.3945 12.3945 12.6886 12.6886 k = 0.1857 0.1072-0.0000 ( 6848 PWs) bands (ev): -18.1773 -18.1773 -18.1467 -18.1467 -4.9502 -4.9502 -4.8474 -4.8474 -3.2377 -3.2377 -3.1194 -3.1194 -3.0409 -3.0409 -2.8760 -2.8760 -2.6444 -2.6444 -2.6137 -2.6137 -2.5833 -2.5833 -2.5740 -2.5740 -2.5099 -2.5099 -2.4048 -2.4048 -2.3570 -2.3570 -2.3343 -2.3343 -0.6469 -0.6469 -0.6128 -0.6128 -0.5310 -0.5310 -0.4655 -0.4655 -0.4254 -0.4254 -0.3938 -0.3938 -0.3613 -0.3613 -0.2876 -0.2876 -0.2689 -0.2689 -0.2640 -0.2640 -0.1768 -0.1768 -0.1610 -0.1610 1.7725 1.7725 3.1039 3.1039 5.0638 5.0638 6.9187 6.9187 7.9636 7.9636 9.0691 9.0691 9.3291 9.3291 9.8687 9.8687 10.3032 10.3032 10.9438 10.9438 11.1861 11.1861 11.7739 11.7739 12.2262 12.2262 12.4358 12.4358 12.7022 12.7022 k = 0.2000 0.1155-0.0000 ( 6850 PWs) bands (ev): -18.1771 -18.1771 -18.1466 -18.1466 -4.9503 -4.9503 -4.8492 -4.8492 -3.2352 -3.2352 -3.1194 -3.1194 -3.0404 -3.0404 -2.8791 -2.8791 -2.6440 -2.6440 -2.6144 -2.6144 -2.5858 -2.5858 -2.5732 -2.5732 -2.5117 -2.5117 -2.4070 -2.4070 -2.3530 -2.3530 -2.3430 -2.3430 -0.6422 -0.6422 -0.6145 -0.6145 -0.5311 -0.5311 -0.4676 -0.4676 -0.4310 -0.4310 -0.3987 -0.3987 -0.3629 -0.3629 -0.2857 -0.2857 -0.2662 -0.2662 -0.2606 -0.2606 -0.1718 -0.1718 -0.1626 -0.1626 1.8247 1.8247 3.1215 3.1215 5.0256 5.0256 6.8030 6.8030 7.9453 7.9453 9.0817 9.0817 9.2665 9.2665 9.8010 9.8010 10.3191 10.3191 11.0381 11.0381 11.1754 11.1754 11.8113 11.8113 12.2706 12.2706 12.4700 12.4700 12.7488 12.7488 k = 0.2143 0.1237-0.0000 ( 6854 PWs) bands (ev): -18.1769 -18.1769 -18.1464 -18.1464 -4.9505 -4.9505 -4.8511 -4.8511 -3.2327 -3.2327 -3.1193 -3.1193 -3.0399 -3.0399 -2.8819 -2.8819 -2.6437 -2.6437 -2.6153 -2.6153 -2.5884 -2.5884 -2.5723 -2.5723 -2.5128 -2.5128 -2.4093 -2.4093 -2.3542 -2.3542 -2.3468 -2.3468 -0.6375 -0.6375 -0.6159 -0.6159 -0.5314 -0.5314 -0.4699 -0.4699 -0.4367 -0.4367 -0.4030 -0.4030 -0.3645 -0.3645 -0.2839 -0.2839 -0.2633 -0.2633 -0.2569 -0.2569 -0.1680 -0.1680 -0.1635 -0.1635 1.8800 1.8800 3.1403 3.1403 4.9830 4.9830 6.6874 6.6874 7.9348 7.9348 9.0947 9.0947 9.2039 9.2039 9.7342 9.7342 10.3369 10.3369 11.0489 11.0489 11.2396 11.2396 11.8538 11.8538 12.3079 12.3079 12.4979 12.4979 12.8235 12.8235 k = 0.2286 0.1320-0.0000 ( 6850 PWs) bands (ev): -18.1766 -18.1766 -18.1462 -18.1462 -4.9506 -4.9506 -4.8529 -4.8529 -3.2304 -3.2304 -3.1190 -3.1190 -3.0394 -3.0394 -2.8845 -2.8845 -2.6435 -2.6435 -2.6164 -2.6164 -2.5910 -2.5910 -2.5714 -2.5714 -2.5132 -2.5132 -2.4118 -2.4118 -2.3633 -2.3633 -2.3432 -2.3432 -0.6328 -0.6328 -0.6168 -0.6168 -0.5319 -0.5319 -0.4725 -0.4725 -0.4426 -0.4426 -0.4068 -0.4068 -0.3659 -0.3659 -0.2823 -0.2823 -0.2602 -0.2602 -0.2531 -0.2531 -0.1680 -0.1680 -0.1613 -0.1613 1.9384 1.9384 3.1600 3.1600 4.9361 4.9361 6.5726 6.5726 7.9316 7.9316 9.1079 9.1079 9.1419 9.1419 9.6687 9.6687 10.3561 10.3561 11.0146 11.0146 11.3383 11.3383 11.9005 11.9005 12.3408 12.3408 12.5312 12.5312 12.9127 12.9127 k = 0.2429 0.1402-0.0000 ( 6854 PWs) bands (ev): -18.1764 -18.1764 -18.1461 -18.1461 -4.9508 -4.9508 -4.8548 -4.8548 -3.2281 -3.2281 -3.1186 -3.1186 -3.0391 -3.0391 -2.8869 -2.8869 -2.6434 -2.6434 -2.6178 -2.6178 -2.5935 -2.5935 -2.5705 -2.5705 -2.5131 -2.5131 -2.4144 -2.4144 -2.3733 -2.3733 -2.3392 -2.3392 -0.6283 -0.6283 -0.6171 -0.6171 -0.5328 -0.5328 -0.4753 -0.4753 -0.4483 -0.4483 -0.4102 -0.4102 -0.3673 -0.3673 -0.2808 -0.2808 -0.2571 -0.2571 -0.2490 -0.2490 -0.1698 -0.1698 -0.1577 -0.1577 1.9996 1.9996 3.1808 3.1808 4.8850 4.8850 6.4592 6.4592 7.9353 7.9353 9.0806 9.0806 9.1216 9.1216 9.6049 9.6049 10.3758 10.3758 10.9720 10.9720 11.4346 11.4346 11.9495 11.9495 12.3707 12.3707 12.5797 12.5797 13.0058 13.0058 k = 0.2571 0.1485-0.0000 ( 6854 PWs) bands (ev): -18.1762 -18.1762 -18.1459 -18.1459 -4.9510 -4.9510 -4.8566 -4.8566 -3.2261 -3.2261 -3.1181 -3.1181 -3.0389 -3.0389 -2.8891 -2.8891 -2.6435 -2.6435 -2.6192 -2.6192 -2.5958 -2.5958 -2.5696 -2.5696 -2.5124 -2.5124 -2.4171 -2.4171 -2.3837 -2.3837 -2.3352 -2.3352 -0.6244 -0.6244 -0.6164 -0.6164 -0.5340 -0.5340 -0.4783 -0.4783 -0.4539 -0.4539 -0.4133 -0.4133 -0.3685 -0.3685 -0.2795 -0.2795 -0.2540 -0.2540 -0.2449 -0.2449 -0.1721 -0.1721 -0.1542 -0.1542 2.0636 2.0636 3.2025 3.2025 4.8300 4.8300 6.3477 6.3477 7.9453 7.9453 9.0214 9.0214 9.1346 9.1346 9.5432 9.5432 10.3946 10.3946 10.9287 10.9287 11.5225 11.5225 11.9980 11.9980 12.3997 12.3997 12.6467 12.6467 13.0961 13.0961 k = 0.2714 0.1567-0.0000 ( 6860 PWs) bands (ev): -18.1760 -18.1760 -18.1457 -18.1457 -4.9512 -4.9512 -4.8584 -4.8584 -3.2242 -3.2242 -3.1174 -3.1174 -3.0388 -3.0388 -2.8911 -2.8911 -2.6436 -2.6436 -2.6208 -2.6208 -2.5977 -2.5977 -2.5686 -2.5686 -2.5115 -2.5115 -2.4200 -2.4200 -2.3943 -2.3943 -2.3314 -2.3314 -0.6218 -0.6218 -0.6142 -0.6142 -0.5354 -0.5354 -0.4814 -0.4814 -0.4591 -0.4591 -0.4161 -0.4161 -0.3697 -0.3697 -0.2781 -0.2781 -0.2508 -0.2508 -0.2407 -0.2407 -0.1745 -0.1745 -0.1510 -0.1510 2.1300 2.1300 3.2249 3.2249 4.7713 4.7713 6.2387 6.2387 7.9608 7.9608 8.9640 8.9640 9.1470 9.1470 9.4844 9.4844 10.4111 10.4111 10.8877 10.8877 11.6018 11.6018 12.0440 12.0440 12.4302 12.4302 12.7309 12.7309 13.1791 13.1791 k = 0.2857 0.1650-0.0000 ( 6866 PWs) bands (ev): -18.1757 -18.1757 -18.1456 -18.1456 -4.9515 -4.9515 -4.8602 -4.8602 -3.2225 -3.2225 -3.1165 -3.1165 -3.0388 -3.0388 -2.8929 -2.8929 -2.6438 -2.6438 -2.6225 -2.6225 -2.5991 -2.5991 -2.5676 -2.5676 -2.5102 -2.5102 -2.4230 -2.4230 -2.4049 -2.4049 -2.3277 -2.3277 -0.6203 -0.6203 -0.6106 -0.6106 -0.5372 -0.5372 -0.4846 -0.4846 -0.4640 -0.4640 -0.4186 -0.4186 -0.3708 -0.3708 -0.2769 -0.2769 -0.2478 -0.2478 -0.2364 -0.2364 -0.1771 -0.1771 -0.1482 -0.1482 2.1987 2.1987 3.2481 3.2481 4.7092 4.7092 6.1327 6.1327 7.9811 7.9811 8.9090 8.9090 9.1582 9.1582 9.4291 9.4291 10.4236 10.4236 10.8516 10.8516 11.6741 11.6741 12.0866 12.0866 12.4634 12.4634 12.8286 12.8286 13.2518 13.2518 k = 0.3000 0.1732-0.0000 ( 6862 PWs) bands (ev): -18.1755 -18.1755 -18.1454 -18.1454 -4.9517 -4.9517 -4.8619 -4.8619 -3.2209 -3.2209 -3.1154 -3.1154 -3.0390 -3.0390 -2.8946 -2.8946 -2.6440 -2.6440 -2.6241 -2.6241 -2.6001 -2.6001 -2.5665 -2.5665 -2.5089 -2.5089 -2.4261 -2.4261 -2.4156 -2.4156 -2.3241 -2.3241 -0.6192 -0.6192 -0.6064 -0.6064 -0.5392 -0.5392 -0.4877 -0.4877 -0.4686 -0.4686 -0.4207 -0.4207 -0.3720 -0.3720 -0.2756 -0.2756 -0.2448 -0.2448 -0.2321 -0.2321 -0.1797 -0.1797 -0.1458 -0.1458 2.2696 2.2696 3.2720 3.2720 4.6440 4.6440 6.0302 6.0302 8.0053 8.0053 8.8564 8.8564 9.1671 9.1671 9.3787 9.3787 10.4305 10.4305 10.8222 10.8222 11.7409 11.7409 12.1262 12.1262 12.4990 12.4990 12.9350 12.9350 13.3126 13.3126 k = 0.3143 0.1815-0.0000 ( 6858 PWs) bands (ev): -18.1753 -18.1753 -18.1453 -18.1453 -4.9520 -4.9520 -4.8636 -4.8636 -3.2196 -3.2196 -3.1142 -3.1142 -3.0394 -3.0394 -2.8962 -2.8962 -2.6443 -2.6443 -2.6256 -2.6256 -2.6004 -2.6004 -2.5653 -2.5653 -2.5077 -2.5077 -2.4299 -2.4299 -2.4256 -2.4256 -2.3208 -2.3208 -0.6180 -0.6180 -0.6022 -0.6022 -0.5415 -0.5415 -0.4908 -0.4908 -0.4728 -0.4728 -0.4224 -0.4224 -0.3733 -0.3733 -0.2743 -0.2743 -0.2420 -0.2420 -0.2279 -0.2279 -0.1823 -0.1823 -0.1437 -0.1437 2.3424 2.3424 3.2962 3.2962 4.5761 4.5761 5.9314 5.9314 8.0328 8.0328 8.8065 8.8065 9.1714 9.1714 9.3354 9.3354 10.4305 10.4305 10.8012 10.8012 11.8039 11.8039 12.1643 12.1643 12.5358 12.5358 13.0453 13.0453 13.3607 13.3607 k = 0.3286 0.1897-0.0000 ( 6840 PWs) bands (ev): -18.1751 -18.1751 -18.1451 -18.1451 -4.9522 -4.9522 -4.8652 -4.8652 -3.2184 -3.2184 -3.1128 -3.1128 -3.0399 -3.0399 -2.8977 -2.8977 -2.6446 -2.6446 -2.6269 -2.6269 -2.6003 -2.6003 -2.5641 -2.5641 -2.5066 -2.5066 -2.4379 -2.4379 -2.4313 -2.4313 -2.3176 -2.3176 -0.6166 -0.6166 -0.5981 -0.5981 -0.5440 -0.5440 -0.4939 -0.4939 -0.4767 -0.4767 -0.4237 -0.4237 -0.3746 -0.3746 -0.2730 -0.2730 -0.2392 -0.2392 -0.2237 -0.2237 -0.1850 -0.1850 -0.1420 -0.1420 2.4169 2.4169 3.3207 3.3207 4.5058 4.5058 5.8370 5.8370 8.0626 8.0626 8.7593 8.7593 9.1673 9.1673 9.3032 9.3032 10.4236 10.4236 10.7888 10.7888 11.8642 11.8642 12.2022 12.2022 12.5725 12.5725 13.1543 13.1543 13.3969 13.3969 k = 0.3429 0.1979-0.0000 ( 6844 PWs) bands (ev): -18.1749 -18.1749 -18.1450 -18.1450 -4.9525 -4.9525 -4.8667 -4.8667 -3.2174 -3.2174 -3.1112 -3.1112 -3.0407 -3.0407 -2.8992 -2.8992 -2.6448 -2.6448 -2.6279 -2.6279 -2.5997 -2.5997 -2.5627 -2.5627 -2.5057 -2.5057 -2.4480 -2.4480 -2.4347 -2.4347 -2.3147 -2.3147 -0.6151 -0.6151 -0.5942 -0.5942 -0.5465 -0.5465 -0.4969 -0.4969 -0.4801 -0.4801 -0.4245 -0.4245 -0.3762 -0.3762 -0.2717 -0.2717 -0.2367 -0.2367 -0.2196 -0.2196 -0.1876 -0.1876 -0.1407 -0.1407 2.4928 2.4928 3.3454 3.3454 4.4335 4.4335 5.7473 5.7473 8.0939 8.0939 8.7151 8.7151 9.1513 9.1513 9.2858 9.2858 10.4109 10.4109 10.7840 10.7840 11.9223 11.9223 12.2409 12.2409 12.6078 12.6078 13.2574 13.2574 13.4245 13.4245 k = 0.3571 0.2062-0.0000 ( 6848 PWs) bands (ev): -18.1747 -18.1747 -18.1448 -18.1448 -4.9527 -4.9527 -4.8681 -4.8681 -3.2166 -3.2166 -3.1094 -3.1094 -3.0416 -3.0416 -2.9006 -2.9006 -2.6451 -2.6451 -2.6286 -2.6286 -2.5987 -2.5987 -2.5612 -2.5612 -2.5053 -2.5053 -2.4580 -2.4580 -2.4378 -2.4378 -2.3119 -2.3119 -0.6134 -0.6134 -0.5906 -0.5906 -0.5492 -0.5492 -0.4998 -0.4998 -0.4832 -0.4832 -0.4249 -0.4249 -0.3779 -0.3779 -0.2704 -0.2704 -0.2343 -0.2343 -0.2157 -0.2157 -0.1901 -0.1901 -0.1396 -0.1396 2.5698 2.5698 3.3698 3.3698 4.3596 4.3596 5.6628 5.6628 8.1261 8.1261 8.6738 8.6738 9.1254 9.1254 9.2811 9.2811 10.3944 10.3944 10.7850 10.7850 11.9784 11.9784 12.2810 12.2810 12.6407 12.6407 13.3501 13.3501 13.4479 13.4479 k = 0.3714 0.2144-0.0000 ( 6836 PWs) bands (ev): -18.1745 -18.1745 -18.1447 -18.1447 -4.9530 -4.9530 -4.8693 -4.8693 -3.2159 -3.2159 -3.1075 -3.1075 -3.0427 -3.0427 -2.9019 -2.9019 -2.6452 -2.6452 -2.6290 -2.6290 -2.5973 -2.5973 -2.5597 -2.5597 -2.5055 -2.5055 -2.4674 -2.4674 -2.4407 -2.4407 -2.3094 -2.3094 -0.6115 -0.6115 -0.5873 -0.5873 -0.5518 -0.5518 -0.5026 -0.5026 -0.4859 -0.4859 -0.4249 -0.4249 -0.3799 -0.3799 -0.2691 -0.2691 -0.2322 -0.2322 -0.2120 -0.2120 -0.1925 -0.1925 -0.1389 -0.1389 2.6477 2.6477 3.3938 3.3938 4.2844 4.2844 5.5839 5.5839 8.1583 8.1583 8.6354 8.6354 9.0952 9.0952 9.2836 9.2836 10.3761 10.3761 10.7897 10.7897 12.0325 12.0325 12.3225 12.3225 12.6705 12.6705 13.4285 13.4285 13.4700 13.4700 k = 0.3857 0.2227-0.0000 ( 6842 PWs) bands (ev): -18.1744 -18.1744 -18.1446 -18.1446 -4.9532 -4.9532 -4.8705 -4.8705 -3.2154 -3.2154 -3.1055 -3.1055 -3.0440 -3.0440 -2.9031 -2.9031 -2.6453 -2.6453 -2.6290 -2.6290 -2.5956 -2.5956 -2.5581 -2.5581 -2.5064 -2.5064 -2.4761 -2.4761 -2.4435 -2.4435 -2.3071 -2.3071 -0.6095 -0.6095 -0.5844 -0.5844 -0.5545 -0.5545 -0.5053 -0.5053 -0.4882 -0.4882 -0.4243 -0.4243 -0.3821 -0.3821 -0.2678 -0.2678 -0.2302 -0.2302 -0.2086 -0.2086 -0.1946 -0.1946 -0.1384 -0.1384 2.7260 2.7260 3.4170 3.4170 4.2084 4.2084 5.5112 5.5112 8.1899 8.1899 8.6000 8.6000 9.0649 9.0649 9.2891 9.2891 10.3579 10.3579 10.7964 10.7964 12.0841 12.0841 12.3650 12.3650 12.6971 12.6971 13.4812 13.4812 13.5009 13.5009 k = 0.4000 0.2309-0.0000 ( 6834 PWs) bands (ev): -18.1743 -18.1743 -18.1445 -18.1445 -4.9534 -4.9534 -4.8716 -4.8716 -3.2149 -3.2149 -3.1035 -3.1035 -3.0454 -3.0454 -2.9043 -2.9043 -2.6453 -2.6453 -2.6287 -2.6287 -2.5935 -2.5935 -2.5566 -2.5566 -2.5081 -2.5081 -2.4837 -2.4837 -2.4460 -2.4460 -2.3051 -2.3051 -0.6075 -0.6075 -0.5818 -0.5818 -0.5570 -0.5570 -0.5079 -0.5079 -0.4901 -0.4901 -0.4233 -0.4233 -0.3845 -0.3845 -0.2666 -0.2666 -0.2285 -0.2285 -0.2055 -0.2055 -0.1965 -0.1965 -0.1381 -0.1381 2.8042 2.8042 3.4390 3.4390 4.1322 4.1322 5.4451 5.4451 8.2205 8.2205 8.5674 8.5674 9.0365 9.0365 9.2957 9.2957 10.3409 10.3409 10.8038 10.8038 12.1327 12.1327 12.4077 12.4077 12.7204 12.7204 13.4997 13.4997 13.5512 13.5512 k = 0.4143 0.2392-0.0000 ( 6834 PWs) bands (ev): -18.1741 -18.1741 -18.1444 -18.1444 -4.9536 -4.9536 -4.8725 -4.8725 -3.2146 -3.2146 -3.1014 -3.1014 -3.0469 -3.0469 -2.9054 -2.9054 -2.6453 -2.6453 -2.6282 -2.6282 -2.5911 -2.5911 -2.5554 -2.5554 -2.5107 -2.5107 -2.4900 -2.4900 -2.4482 -2.4482 -2.3033 -2.3033 -0.6055 -0.6055 -0.5795 -0.5795 -0.5593 -0.5593 -0.5102 -0.5102 -0.4917 -0.4917 -0.4219 -0.4219 -0.3872 -0.3872 -0.2654 -0.2654 -0.2270 -0.2270 -0.2032 -0.2032 -0.1977 -0.1977 -0.1380 -0.1380 2.8815 2.8815 3.4595 3.4595 4.0566 4.0566 5.3863 5.3863 8.2495 8.2495 8.5374 8.5374 9.0111 9.0111 9.3024 9.3024 10.3258 10.3258 10.8112 10.8112 12.1772 12.1772 12.4496 12.4496 12.7407 12.7407 13.5118 13.5118 13.5969 13.5969 k = 0.4286 0.2474-0.0000 ( 6824 PWs) bands (ev): -18.1740 -18.1740 -18.1443 -18.1443 -4.9538 -4.9538 -4.8733 -4.8733 -3.2143 -3.2143 -3.0993 -3.0993 -3.0484 -3.0484 -2.9064 -2.9064 -2.6453 -2.6453 -2.6274 -2.6274 -2.5883 -2.5883 -2.5548 -2.5548 -2.5137 -2.5137 -2.4951 -2.4951 -2.4500 -2.4500 -2.3018 -2.3018 -0.6036 -0.6036 -0.5775 -0.5775 -0.5616 -0.5616 -0.5124 -0.5124 -0.4929 -0.4929 -0.4201 -0.4201 -0.3901 -0.3901 -0.2643 -0.2643 -0.2257 -0.2257 -0.2025 -0.2025 -0.1974 -0.1974 -0.1381 -0.1381 2.9570 2.9570 3.4779 3.4779 3.9825 3.9825 5.3352 5.3352 8.2769 8.2769 8.5101 8.5101 8.9891 8.9891 9.3085 9.3085 10.3132 10.3132 10.8179 10.8179 12.2170 12.2170 12.4893 12.4893 12.7585 12.7585 13.5210 13.5210 13.6185 13.6185 k = 0.4429 0.2557-0.0000 ( 6830 PWs) bands (ev): -18.1739 -18.1739 -18.1443 -18.1443 -4.9540 -4.9540 -4.8740 -4.8740 -3.2141 -3.2141 -3.0974 -3.0974 -3.0499 -3.0499 -2.9072 -2.9072 -2.6453 -2.6453 -2.6266 -2.6266 -2.5852 -2.5852 -2.5553 -2.5553 -2.5163 -2.5163 -2.4993 -2.4993 -2.4515 -2.4515 -2.3005 -2.3005 -0.6019 -0.6019 -0.5758 -0.5758 -0.5636 -0.5636 -0.5142 -0.5142 -0.4939 -0.4939 -0.4179 -0.4179 -0.3932 -0.3932 -0.2633 -0.2633 -0.2247 -0.2247 -0.2031 -0.2031 -0.1959 -0.1959 -0.1382 -0.1382 3.0290 3.0290 3.4938 3.4938 3.9116 3.9116 5.2924 5.2924 8.3023 8.3023 8.4850 8.4850 8.9709 8.9709 9.3138 9.3138 10.3030 10.3030 10.8237 10.8237 12.2510 12.2510 12.5250 12.5250 12.7740 12.7740 13.5282 13.5282 13.6142 13.6142 k = 0.4571 0.2639-0.0000 ( 6834 PWs) bands (ev): -18.1739 -18.1739 -18.1442 -18.1442 -4.9541 -4.9541 -4.8745 -4.8745 -3.2139 -3.2139 -3.0957 -3.0957 -3.0512 -3.0512 -2.9079 -2.9079 -2.6453 -2.6453 -2.6258 -2.6258 -2.5817 -2.5817 -2.5573 -2.5573 -2.5175 -2.5175 -2.5031 -2.5031 -2.4527 -2.4527 -2.2995 -2.2995 -0.6005 -0.6005 -0.5743 -0.5743 -0.5655 -0.5655 -0.5157 -0.5157 -0.4946 -0.4946 -0.4153 -0.4153 -0.3964 -0.3964 -0.2625 -0.2625 -0.2240 -0.2240 -0.2039 -0.2039 -0.1943 -0.1943 -0.1384 -0.1384 3.0951 3.0951 3.5068 3.5068 3.8464 3.8464 5.2585 5.2585 8.3257 8.3257 8.4621 8.4621 8.9567 8.9567 9.3181 9.3181 10.2953 10.2953 10.8283 10.8283 12.2783 12.2783 12.5550 12.5550 12.7870 12.7870 13.5342 13.5342 13.6025 13.6025 k = 0.4714 0.2722-0.0000 ( 6832 PWs) bands (ev): -18.1738 -18.1738 -18.1442 -18.1442 -4.9542 -4.9542 -4.8748 -4.8748 -3.2139 -3.2139 -3.0944 -3.0944 -3.0523 -3.0523 -2.9084 -2.9084 -2.6453 -2.6453 -2.6251 -2.6251 -2.5778 -2.5778 -2.5605 -2.5605 -2.5172 -2.5172 -2.5066 -2.5066 -2.4535 -2.4535 -2.2988 -2.2988 -0.5993 -0.5993 -0.5730 -0.5730 -0.5672 -0.5672 -0.5168 -0.5168 -0.4951 -0.4951 -0.4125 -0.4125 -0.3997 -0.3997 -0.2619 -0.2619 -0.2234 -0.2234 -0.2046 -0.2046 -0.1931 -0.1931 -0.1386 -0.1386 3.1508 3.1508 3.5164 3.5164 3.7914 3.7914 5.2339 5.2339 8.3469 8.3469 8.4414 8.4414 8.9465 8.9465 9.3212 9.3212 10.2900 10.2900 10.8317 10.8317 12.2984 12.2984 12.5776 12.5776 12.7973 12.7973 13.5393 13.5393 13.5892 13.5892 k = 0.4857 0.2804-0.0000 ( 6838 PWs) bands (ev): -18.1738 -18.1738 -18.1441 -18.1441 -4.9542 -4.9542 -4.8751 -4.8751 -3.2138 -3.2138 -3.0935 -3.0935 -3.0531 -3.0531 -2.9087 -2.9087 -2.6452 -2.6452 -2.6247 -2.6247 -2.5736 -2.5736 -2.5646 -2.5646 -2.5156 -2.5156 -2.5100 -2.5100 -2.4539 -2.4539 -2.2984 -2.2984 -0.5986 -0.5986 -0.5718 -0.5718 -0.5686 -0.5686 -0.5175 -0.5175 -0.4953 -0.4953 -0.4095 -0.4095 -0.4030 -0.4030 -0.2616 -0.2616 -0.2231 -0.2231 -0.2050 -0.2050 -0.1923 -0.1923 -0.1387 -0.1387 3.1896 3.1896 3.5223 3.5223 3.7529 3.7529 5.2189 5.2189 8.3650 8.3650 8.4237 8.4237 8.9403 8.9403 9.3231 9.3231 10.2869 10.2869 10.8337 10.8337 12.3106 12.3106 12.5917 12.5917 12.8039 12.8039 13.5435 13.5435 13.5785 13.5785 k = 0.5000 0.2887-0.0000 ( 6836 PWs) bands (ev): -18.1738 -18.1738 -18.1441 -18.1441 -4.9542 -4.9542 -4.8751 -4.8751 -3.2138 -3.2138 -3.0933 -3.0933 -3.0533 -3.0533 -2.9088 -2.9088 -2.6452 -2.6452 -2.6245 -2.6245 -2.5694 -2.5694 -2.5687 -2.5687 -2.5136 -2.5136 -2.5125 -2.5125 -2.4541 -2.4541 -2.2982 -2.2982 -0.5984 -0.5984 -0.5710 -0.5710 -0.5695 -0.5695 -0.5178 -0.5178 -0.4954 -0.4954 -0.4064 -0.4064 -0.4061 -0.4061 -0.2615 -0.2615 -0.2230 -0.2230 -0.2051 -0.2051 -0.1920 -0.1920 -0.1388 -0.1388 3.2038 3.2038 3.5243 3.5243 3.7388 3.7388 5.2139 5.2139 8.3739 8.3739 8.4149 8.4149 8.9383 8.9383 9.3238 9.3238 10.2858 10.2858 10.8344 10.8344 12.3147 12.3147 12.5965 12.5965 12.8063 12.8063 13.5454 13.5454 13.5742 13.5742 k = 0.5000 0.2887-0.0000 ( 6836 PWs) bands (ev): -18.1738 -18.1738 -18.1441 -18.1441 -4.9542 -4.9542 -4.8751 -4.8751 -3.2138 -3.2138 -3.0933 -3.0933 -3.0533 -3.0533 -2.9088 -2.9088 -2.6452 -2.6452 -2.6245 -2.6245 -2.5694 -2.5694 -2.5687 -2.5687 -2.5136 -2.5136 -2.5125 -2.5125 -2.4541 -2.4541 -2.2982 -2.2982 -0.5984 -0.5984 -0.5710 -0.5710 -0.5695 -0.5695 -0.5178 -0.5178 -0.4954 -0.4954 -0.4064 -0.4064 -0.4061 -0.4061 -0.2615 -0.2615 -0.2230 -0.2230 -0.2051 -0.2051 -0.1920 -0.1920 -0.1388 -0.1388 3.2038 3.2038 3.5243 3.5243 3.7388 3.7388 5.2139 5.2139 8.3739 8.3739 8.4149 8.4149 8.9383 8.9383 9.3238 9.3238 10.2858 10.2858 10.8344 10.8344 12.3147 12.3147 12.5965 12.5965 12.8063 12.8063 13.5454 13.5454 13.5742 13.5742 k = 0.4921 0.3024-0.0000 ( 6838 PWs) bands (ev): -18.1738 -18.1738 -18.1441 -18.1441 -4.9542 -4.9542 -4.8751 -4.8751 -3.2139 -3.2139 -3.0932 -3.0932 -3.0533 -3.0533 -2.9085 -2.9085 -2.6452 -2.6452 -2.6245 -2.6245 -2.5695 -2.5695 -2.5687 -2.5687 -2.5160 -2.5160 -2.5109 -2.5109 -2.4533 -2.4533 -2.2985 -2.2985 -0.5984 -0.5984 -0.5716 -0.5716 -0.5688 -0.5688 -0.5179 -0.5179 -0.4953 -0.4953 -0.4082 -0.4082 -0.4043 -0.4043 -0.2626 -0.2626 -0.2229 -0.2229 -0.2046 -0.2046 -0.1921 -0.1921 -0.1383 -0.1383 3.2047 3.2047 3.5256 3.5256 3.7395 3.7395 5.2097 5.2097 8.3748 8.3748 8.4122 8.4122 8.9407 8.9407 9.3168 9.3168 10.2976 10.2976 10.8357 10.8357 12.3145 12.3145 12.5965 12.5965 12.8044 12.8044 13.4794 13.4794 13.6029 13.6029 k = 0.4841 0.3162-0.0000 ( 6828 PWs) bands (ev): -18.1738 -18.1738 -18.1441 -18.1441 -4.9543 -4.9543 -4.8752 -4.8752 -3.2142 -3.2142 -3.0931 -3.0931 -3.0533 -3.0533 -2.9079 -2.9079 -2.6451 -2.6451 -2.6244 -2.6244 -2.5700 -2.5700 -2.5687 -2.5687 -2.5195 -2.5195 -2.5095 -2.5095 -2.4513 -2.4513 -2.2991 -2.2991 -0.5984 -0.5984 -0.5726 -0.5726 -0.5675 -0.5675 -0.5182 -0.5182 -0.4950 -0.4950 -0.4100 -0.4100 -0.4023 -0.4023 -0.2657 -0.2657 -0.2230 -0.2230 -0.2030 -0.2030 -0.1923 -0.1923 -0.1369 -0.1369 3.2076 3.2076 3.5298 3.5298 3.7417 3.7417 5.1969 5.1969 8.3713 8.3713 8.4103 8.4103 8.9479 8.9479 9.2974 9.2974 10.3311 10.3311 10.8397 10.8397 12.3139 12.3139 12.5967 12.5967 12.7989 12.7989 13.3808 13.3808 13.6080 13.6080 k = 0.4762 0.3299-0.0000 ( 6844 PWs) bands (ev): -18.1737 -18.1737 -18.1441 -18.1441 -4.9544 -4.9544 -4.8752 -4.8752 -3.2148 -3.2148 -3.0929 -3.0929 -3.0532 -3.0532 -2.9068 -2.9068 -2.6449 -2.6449 -2.6242 -2.6242 -2.5710 -2.5710 -2.5685 -2.5685 -2.5236 -2.5236 -2.5085 -2.5085 -2.4481 -2.4481 -2.3002 -2.3002 -0.5984 -0.5984 -0.5736 -0.5736 -0.5661 -0.5661 -0.5187 -0.5187 -0.4946 -0.4946 -0.4118 -0.4118 -0.4004 -0.4004 -0.2700 -0.2700 -0.2244 -0.2244 -0.2002 -0.2002 -0.1921 -0.1921 -0.1347 -0.1347 3.2123 3.2123 3.5367 3.5367 3.7451 3.7451 5.1760 5.1760 8.3513 8.3513 8.4210 8.4210 8.9594 8.9594 9.2699 9.2699 10.3822 10.3822 10.8467 10.8467 12.3124 12.3124 12.5972 12.5972 12.7898 12.7898 13.2733 13.2733 13.5918 13.5918 k = 0.4683 0.3437-0.0000 ( 6836 PWs) bands (ev): -18.1737 -18.1737 -18.1441 -18.1441 -4.9545 -4.9545 -4.8752 -4.8752 -3.2155 -3.2155 -3.0927 -3.0927 -3.0529 -3.0529 -2.9053 -2.9053 -2.6447 -2.6447 -2.6240 -2.6240 -2.5724 -2.5724 -2.5685 -2.5685 -2.5280 -2.5280 -2.5078 -2.5078 -2.4442 -2.4442 -2.3017 -2.3017 -0.5983 -0.5983 -0.5747 -0.5747 -0.5645 -0.5645 -0.5194 -0.5194 -0.4939 -0.4939 -0.4136 -0.4136 -0.3984 -0.3984 -0.2750 -0.2750 -0.2271 -0.2271 -0.1977 -0.1977 -0.1904 -0.1904 -0.1321 -0.1321 3.2189 3.2189 3.5464 3.5464 3.7496 3.7496 5.1474 5.1474 8.3169 8.3169 8.4420 8.4420 8.9744 8.9744 9.2395 9.2395 10.4455 10.4455 10.8573 10.8573 12.3095 12.3095 12.5982 12.5982 12.7775 12.7775 13.1634 13.1634 13.5614 13.5614 k = 0.4603 0.3574-0.0000 ( 6836 PWs) bands (ev): -18.1737 -18.1737 -18.1441 -18.1441 -4.9546 -4.9546 -4.8753 -4.8753 -3.2164 -3.2164 -3.0926 -3.0926 -3.0524 -3.0524 -2.9035 -2.9035 -2.6445 -2.6445 -2.6237 -2.6237 -2.5744 -2.5744 -2.5685 -2.5685 -2.5323 -2.5323 -2.5073 -2.5073 -2.4398 -2.4398 -2.3036 -2.3036 -0.5982 -0.5982 -0.5757 -0.5757 -0.5628 -0.5628 -0.5203 -0.5203 -0.4931 -0.4931 -0.4153 -0.4153 -0.3965 -0.3965 -0.2803 -0.2803 -0.2309 -0.2309 -0.1968 -0.1968 -0.1860 -0.1860 -0.1291 -0.1291 3.2273 3.2273 3.5588 3.5588 3.7552 3.7552 5.1119 5.1119 8.2718 8.2718 8.4694 8.4694 8.9912 8.9912 9.2113 9.2113 10.5157 10.5157 10.8723 10.8723 12.3046 12.3046 12.5996 12.5996 12.7620 12.7620 13.0548 13.0548 13.5200 13.5200 k = 0.4524 0.3712-0.0000 ( 6836 PWs) bands (ev): -18.1737 -18.1737 -18.1441 -18.1441 -4.9547 -4.9547 -4.8753 -4.8753 -3.2175 -3.2175 -3.0927 -3.0927 -3.0516 -3.0516 -2.9015 -2.9015 -2.6442 -2.6442 -2.6234 -2.6234 -2.5770 -2.5770 -2.5690 -2.5690 -2.5361 -2.5361 -2.5068 -2.5068 -2.4351 -2.4351 -2.3059 -2.3059 -0.5981 -0.5981 -0.5769 -0.5769 -0.5610 -0.5610 -0.5212 -0.5212 -0.4921 -0.4921 -0.4169 -0.4169 -0.3947 -0.3947 -0.2856 -0.2856 -0.2355 -0.2355 -0.1969 -0.1969 -0.1802 -0.1802 -0.1260 -0.1260 3.2377 3.2377 3.5740 3.5740 3.7614 3.7614 5.0700 5.0700 8.2181 8.2181 8.5012 8.5012 9.0068 9.0068 9.1909 9.1909 10.5877 10.5877 10.8934 10.8934 12.2975 12.2975 12.6002 12.6002 12.7429 12.7429 12.9512 12.9512 13.4698 13.4698 k = 0.4444 0.3849-0.0000 ( 6832 PWs) bands (ev): -18.1736 -18.1736 -18.1440 -18.1440 -4.9549 -4.9549 -4.8754 -4.8754 -3.2187 -3.2187 -3.0929 -3.0929 -3.0504 -3.0504 -2.8992 -2.8992 -2.6438 -2.6438 -2.6230 -2.6230 -2.5803 -2.5803 -2.5699 -2.5699 -2.5389 -2.5389 -2.5062 -2.5062 -2.4303 -2.4303 -2.3085 -2.3085 -0.5979 -0.5979 -0.5781 -0.5781 -0.5592 -0.5592 -0.5220 -0.5220 -0.4909 -0.4909 -0.4186 -0.4186 -0.3929 -0.3929 -0.2908 -0.2908 -0.2406 -0.2406 -0.1973 -0.1973 -0.1739 -0.1739 -0.1229 -0.1229 3.2500 3.2500 3.5921 3.5921 3.7679 3.7679 5.0226 5.0226 8.1577 8.1577 8.5361 8.5361 9.0161 9.0161 9.1840 9.1840 10.6565 10.6565 10.9231 10.9231 12.2880 12.2880 12.5964 12.5964 12.7186 12.7186 12.8591 12.8591 13.4130 13.4130 k = 0.4365 0.3986-0.0000 ( 6836 PWs) bands (ev): -18.1736 -18.1736 -18.1440 -18.1440 -4.9550 -4.9550 -4.8755 -4.8755 -3.2200 -3.2200 -3.0934 -3.0934 -3.0488 -3.0488 -2.8969 -2.8969 -2.6435 -2.6435 -2.6226 -2.6226 -2.5845 -2.5845 -2.5714 -2.5714 -2.5406 -2.5406 -2.5056 -2.5056 -2.4255 -2.4255 -2.3114 -2.3114 -0.5977 -0.5977 -0.5793 -0.5793 -0.5574 -0.5574 -0.5228 -0.5228 -0.4896 -0.4896 -0.4202 -0.4202 -0.3913 -0.3913 -0.2957 -0.2957 -0.2460 -0.2460 -0.1977 -0.1977 -0.1673 -0.1673 -0.1200 -0.1200 3.2641 3.2641 3.6129 3.6129 3.7744 3.7744 4.9706 4.9706 8.0924 8.0924 8.5730 8.5730 9.0158 9.0158 9.1943 9.1943 10.7176 10.7176 10.9640 10.9640 12.2761 12.2761 12.5767 12.5767 12.6890 12.6890 12.7909 12.7909 13.3511 13.3511 k = 0.4286 0.4124-0.0000 ( 6826 PWs) bands (ev): -18.1736 -18.1736 -18.1440 -18.1440 -4.9552 -4.9552 -4.8755 -4.8755 -3.2213 -3.2213 -3.0941 -3.0941 -3.0468 -3.0468 -2.8944 -2.8944 -2.6432 -2.6432 -2.6221 -2.6221 -2.5894 -2.5894 -2.5734 -2.5734 -2.5411 -2.5411 -2.5049 -2.5049 -2.4207 -2.4207 -2.3147 -2.3147 -0.5974 -0.5974 -0.5806 -0.5806 -0.5558 -0.5558 -0.5233 -0.5233 -0.4882 -0.4882 -0.4219 -0.4219 -0.3899 -0.3899 -0.3002 -0.3002 -0.2515 -0.2515 -0.1982 -0.1982 -0.1609 -0.1609 -0.1172 -0.1172 3.2801 3.2801 3.6366 3.6366 3.7804 3.7804 4.9146 4.9146 8.0242 8.0242 8.6108 8.6108 9.0074 9.0074 9.2192 9.2192 10.7686 10.7686 11.0171 11.0171 12.2621 12.2621 12.5232 12.5232 12.6670 12.6670 12.7522 12.7522 13.2857 13.2857 k = 0.4206 0.4261-0.0000 ( 6830 PWs) bands (ev): -18.1735 -18.1735 -18.1439 -18.1439 -4.9554 -4.9554 -4.8756 -4.8756 -3.2227 -3.2227 -3.0950 -3.0950 -3.0443 -3.0443 -2.8921 -2.8921 -2.6428 -2.6428 -2.6216 -2.6216 -2.5948 -2.5948 -2.5758 -2.5758 -2.5406 -2.5406 -2.5042 -2.5042 -2.4161 -2.4161 -2.3181 -2.3181 -0.5970 -0.5970 -0.5819 -0.5819 -0.5543 -0.5543 -0.5234 -0.5234 -0.4867 -0.4867 -0.4237 -0.4237 -0.3886 -0.3886 -0.3045 -0.3045 -0.2570 -0.2570 -0.1987 -0.1987 -0.1545 -0.1545 -0.1147 -0.1147 3.2980 3.2980 3.6631 3.6631 3.7856 3.7856 4.8554 4.8554 7.9550 7.9550 8.6486 8.6486 8.9952 8.9952 9.2534 9.2534 10.8109 10.8109 11.0801 11.0801 12.2460 12.2460 12.4435 12.4435 12.6567 12.6567 12.7322 12.7322 13.2182 13.2182 k = 0.4127 0.4399-0.0000 ( 6830 PWs) bands (ev): -18.1735 -18.1735 -18.1439 -18.1439 -4.9556 -4.9556 -4.8757 -4.8757 -3.2241 -3.2241 -3.0961 -3.0961 -3.0415 -3.0415 -2.8898 -2.8898 -2.6425 -2.6425 -2.6212 -2.6212 -2.6005 -2.6005 -2.5784 -2.5784 -2.5394 -2.5394 -2.5034 -2.5034 -2.4117 -2.4117 -2.3217 -2.3217 -0.5966 -0.5966 -0.5833 -0.5833 -0.5533 -0.5533 -0.5232 -0.5232 -0.4851 -0.4851 -0.4256 -0.4256 -0.3875 -0.3875 -0.3083 -0.3083 -0.2623 -0.2623 -0.1991 -0.1991 -0.1484 -0.1484 -0.1124 -0.1124 3.3178 3.3178 3.6924 3.6924 3.7893 3.7893 4.7938 4.7938 7.8864 7.8864 8.6856 8.6856 8.9823 8.9823 9.2923 9.2923 10.8482 10.8482 11.1490 11.1490 12.2270 12.2270 12.3564 12.3564 12.6486 12.6486 12.7232 12.7232 13.1496 13.1496 k = 0.4048 0.4536-0.0000 ( 6836 PWs) bands (ev): -18.1734 -18.1734 -18.1439 -18.1439 -4.9558 -4.9558 -4.8758 -4.8758 -3.2254 -3.2254 -3.0973 -3.0973 -3.0385 -3.0385 -2.8877 -2.8877 -2.6422 -2.6422 -2.6208 -2.6208 -2.6063 -2.6063 -2.5810 -2.5810 -2.5377 -2.5377 -2.5027 -2.5027 -2.4075 -2.4075 -2.3255 -2.3255 -0.5961 -0.5961 -0.5846 -0.5846 -0.5525 -0.5525 -0.5224 -0.5224 -0.4836 -0.4836 -0.4275 -0.4275 -0.3865 -0.3865 -0.3118 -0.3118 -0.2673 -0.2673 -0.1995 -0.1995 -0.1426 -0.1426 -0.1105 -0.1105 3.3395 3.3395 3.7246 3.7246 3.7912 3.7912 4.7303 4.7303 7.8200 7.8200 8.7210 8.7210 8.9701 8.9701 9.3329 9.3329 10.8837 10.8837 11.2200 11.2200 12.1992 12.1992 12.2764 12.2764 12.6384 12.6384 12.7223 12.7223 13.0813 13.0813 k = 0.3968 0.4674-0.0000 ( 6836 PWs) bands (ev): -18.1734 -18.1734 -18.1438 -18.1438 -4.9560 -4.9560 -4.8759 -4.8759 -3.2267 -3.2267 -3.0985 -3.0985 -3.0353 -3.0353 -2.8857 -2.8857 -2.6419 -2.6419 -2.6206 -2.6206 -2.6118 -2.6118 -2.5837 -2.5837 -2.5355 -2.5355 -2.5020 -2.5020 -2.4036 -2.4036 -2.3292 -2.3292 -0.5956 -0.5956 -0.5860 -0.5860 -0.5522 -0.5522 -0.5212 -0.5212 -0.4821 -0.4821 -0.4294 -0.4294 -0.3856 -0.3856 -0.3149 -0.3149 -0.2719 -0.2719 -0.1999 -0.1999 -0.1371 -0.1371 -0.1089 -0.1089 3.3629 3.3629 3.7592 3.7592 3.7909 3.7909 4.6656 4.6656 7.7573 7.7573 8.7542 8.7542 8.9595 8.9595 9.3729 9.3729 10.9200 10.9200 11.2900 11.2900 12.1430 12.1430 12.2264 12.2264 12.6258 12.6258 12.7280 12.7280 13.0143 13.0143 k = 0.3889 0.4811-0.0000 ( 6832 PWs) bands (ev): -18.1733 -18.1733 -18.1438 -18.1438 -4.9562 -4.9562 -4.8761 -4.8761 -3.2279 -3.2279 -3.0997 -3.0997 -3.0321 -3.0321 -2.8840 -2.8840 -2.6416 -2.6416 -2.6212 -2.6212 -2.6162 -2.6162 -2.5862 -2.5862 -2.5331 -2.5331 -2.5015 -2.5015 -2.4000 -2.4000 -2.3329 -2.3329 -0.5951 -0.5951 -0.5873 -0.5873 -0.5521 -0.5521 -0.5196 -0.5196 -0.4807 -0.4807 -0.4314 -0.4314 -0.3848 -0.3848 -0.3178 -0.3178 -0.2760 -0.2760 -0.2001 -0.2001 -0.1321 -0.1321 -0.1077 -0.1077 3.3881 3.3881 3.7841 3.7841 3.8003 3.8003 4.6002 4.6002 7.6994 7.6994 8.7844 8.7844 8.9508 8.9508 9.4105 9.4105 10.9585 10.9585 11.3570 11.3570 12.0651 12.0651 12.2021 12.2021 12.6116 12.6116 12.7395 12.7395 12.9498 12.9498 k = 0.3810 0.4949-0.0000 ( 6828 PWs) bands (ev): -18.1733 -18.1733 -18.1438 -18.1438 -4.9563 -4.9563 -4.8762 -4.8762 -3.2289 -3.2289 -3.1009 -3.1009 -3.0289 -3.0289 -2.8826 -2.8826 -2.6413 -2.6413 -2.6241 -2.6241 -2.6180 -2.6180 -2.5886 -2.5886 -2.5305 -2.5305 -2.5012 -2.5012 -2.3968 -2.3968 -2.3364 -2.3364 -0.5945 -0.5945 -0.5885 -0.5885 -0.5523 -0.5523 -0.5177 -0.5177 -0.4794 -0.4794 -0.4333 -0.4333 -0.3842 -0.3842 -0.3204 -0.3204 -0.2796 -0.2796 -0.2004 -0.2004 -0.1275 -0.1275 -0.1068 -0.1068 3.4151 3.4151 3.7785 3.7785 3.8396 3.8396 4.5345 4.5345 7.6474 7.6474 8.8107 8.8107 8.9446 8.9446 9.4442 9.4442 11.0000 11.0000 11.4186 11.4186 11.9860 11.9860 12.1848 12.1848 12.5967 12.5967 12.7563 12.7563 12.8893 12.8893 k = 0.3730 0.5086-0.0000 ( 6826 PWs) bands (ev): -18.1732 -18.1732 -18.1437 -18.1437 -4.9565 -4.9565 -4.8763 -4.8763 -3.2298 -3.2298 -3.1020 -3.1020 -3.0260 -3.0260 -2.8815 -2.8815 -2.6412 -2.6412 -2.6279 -2.6279 -2.6184 -2.6184 -2.5907 -2.5907 -2.5278 -2.5278 -2.5012 -2.5012 -2.3939 -2.3939 -2.3396 -2.3396 -0.5940 -0.5940 -0.5896 -0.5896 -0.5526 -0.5526 -0.5157 -0.5157 -0.4784 -0.4784 -0.4350 -0.4350 -0.3835 -0.3835 -0.3228 -0.3228 -0.2826 -0.2826 -0.2006 -0.2006 -0.1233 -0.1233 -0.1063 -0.1063 3.4437 3.4437 3.7677 3.7677 3.8832 3.8832 4.4689 4.4689 7.6021 7.6021 8.8323 8.8323 8.9414 8.9414 9.4732 9.4732 11.0445 11.0445 11.4719 11.4719 11.9126 11.9126 12.1704 12.1704 12.5821 12.5821 12.7752 12.7752 12.8379 12.8379 k = 0.3651 0.5224-0.0000 ( 6834 PWs) bands (ev): -18.1732 -18.1732 -18.1437 -18.1437 -4.9566 -4.9566 -4.8764 -4.8764 -3.2306 -3.2306 -3.1029 -3.1029 -3.0234 -3.0234 -2.8806 -2.8806 -2.6411 -2.6411 -2.6313 -2.6313 -2.6186 -2.6186 -2.5924 -2.5924 -2.5250 -2.5250 -2.5015 -2.5015 -2.3916 -2.3916 -2.3424 -2.3424 -0.5936 -0.5936 -0.5905 -0.5905 -0.5529 -0.5529 -0.5138 -0.5138 -0.4777 -0.4777 -0.4365 -0.4365 -0.3830 -0.3830 -0.3249 -0.3249 -0.2850 -0.2850 -0.2007 -0.2007 -0.1197 -0.1197 -0.1061 -0.1061 3.4737 3.4737 3.7527 3.7527 3.9298 3.9298 4.4039 4.4039 7.5643 7.5643 8.8483 8.8483 8.9412 8.9412 9.4966 9.4966 11.0915 11.0915 11.5126 11.5126 11.8498 11.8498 12.1582 12.1582 12.5690 12.5690 12.7646 12.7646 12.8287 12.8287 k = 0.3571 0.5361-0.0000 ( 6836 PWs) bands (ev): -18.1732 -18.1732 -18.1437 -18.1437 -4.9567 -4.9567 -4.8765 -4.8765 -3.2312 -3.2312 -3.1036 -3.1036 -3.0212 -3.0212 -2.8800 -2.8800 -2.6413 -2.6413 -2.6337 -2.6337 -2.6189 -2.6189 -2.5938 -2.5938 -2.5224 -2.5224 -2.5022 -2.5022 -2.3898 -2.3898 -2.3446 -2.3446 -0.5933 -0.5933 -0.5911 -0.5911 -0.5532 -0.5532 -0.5121 -0.5121 -0.4772 -0.4772 -0.4377 -0.4377 -0.3825 -0.3825 -0.3268 -0.3268 -0.2867 -0.2867 -0.2007 -0.2007 -0.1167 -0.1167 -0.1062 -0.1062 3.5046 3.5046 3.7336 3.7336 3.9791 3.9791 4.3399 4.3399 7.5345 7.5345 8.8588 8.8588 8.9438 8.9438 9.5143 9.5143 11.1389 11.1389 11.5344 11.5344 11.8040 11.8040 12.1484 12.1484 12.5583 12.5583 12.7258 12.7258 12.8627 12.8627 k = 0.3492 0.5499-0.0000 ( 6854 PWs) bands (ev): -18.1732 -18.1732 -18.1437 -18.1437 -4.9568 -4.9568 -4.8765 -4.8765 -3.2317 -3.2317 -3.1042 -3.1042 -3.0196 -3.0196 -2.8796 -2.8796 -2.6418 -2.6418 -2.6351 -2.6351 -2.6192 -2.6192 -2.5947 -2.5947 -2.5200 -2.5200 -2.5032 -2.5032 -2.3885 -2.3885 -2.3463 -2.3463 -0.5933 -0.5933 -0.5914 -0.5914 -0.5535 -0.5535 -0.5107 -0.5107 -0.4770 -0.4770 -0.4386 -0.4386 -0.3822 -0.3822 -0.3282 -0.3282 -0.2879 -0.2879 -0.2007 -0.2007 -0.1143 -0.1143 -0.1065 -0.1065 3.5355 3.5355 3.7113 3.7113 4.0307 4.0307 4.2774 4.2774 7.5130 7.5130 8.8647 8.8647 8.9477 8.9477 9.5263 9.5263 11.1833 11.1833 11.5338 11.5338 11.7798 11.7798 12.1415 12.1415 12.5507 12.5507 12.6917 12.6917 12.9090 12.9090 k = 0.3413 0.5636-0.0000 ( 6850 PWs) bands (ev): -18.1732 -18.1732 -18.1437 -18.1437 -4.9568 -4.9568 -4.8766 -4.8766 -3.2319 -3.2319 -3.1045 -3.1045 -3.0185 -3.0185 -2.8794 -2.8794 -2.6423 -2.6423 -2.6357 -2.6357 -2.6195 -2.6195 -2.5952 -2.5952 -2.5181 -2.5181 -2.5041 -2.5041 -2.3878 -2.3878 -2.3472 -2.3472 -0.5934 -0.5934 -0.5915 -0.5915 -0.5537 -0.5537 -0.5098 -0.5098 -0.4770 -0.4770 -0.4390 -0.4390 -0.3819 -0.3819 -0.3292 -0.3292 -0.2886 -0.2886 -0.2007 -0.2007 -0.1126 -0.1126 -0.1069 -0.1069 3.5631 3.5631 3.6889 3.6889 4.0830 4.0830 4.2185 4.2185 7.5001 7.5001 8.8676 8.8676 8.9509 8.9509 9.5330 9.5330 11.2175 11.2175 11.5201 11.5201 11.7724 11.7724 12.1379 12.1379 12.5463 12.5463 12.6689 12.6689 12.9633 12.9633 k = 0.3333 0.5774-0.0000 ( 6846 PWs) bands (ev): -18.1731 -18.1731 -18.1437 -18.1437 -4.9569 -4.9569 -4.8766 -4.8766 -3.2320 -3.2320 -3.1046 -3.1046 -3.0182 -3.0182 -2.8794 -2.8794 -2.6425 -2.6425 -2.6358 -2.6358 -2.6196 -2.6196 -2.5954 -2.5954 -2.5173 -2.5173 -2.5046 -2.5046 -2.3876 -2.3876 -2.3475 -2.3475 -0.5935 -0.5935 -0.5914 -0.5914 -0.5537 -0.5537 -0.5095 -0.5095 -0.4770 -0.4770 -0.4392 -0.4392 -0.3818 -0.3818 -0.3295 -0.3295 -0.2888 -0.2888 -0.2007 -0.2007 -0.1120 -0.1120 -0.1071 -0.1071 3.5767 3.5767 3.6771 3.6771 4.1183 4.1183 4.1810 4.1810 7.4958 7.4958 8.8685 8.8685 8.9522 8.9522 9.5351 9.5351 11.2310 11.2310 11.5122 11.5122 11.7715 11.7715 12.1371 12.1371 12.5448 12.5448 12.6608 12.6608 13.0101 13.0101 k = 0.3333 0.5774-0.0000 ( 6846 PWs) bands (ev): -18.1731 -18.1731 -18.1437 -18.1437 -4.9569 -4.9569 -4.8766 -4.8766 -3.2320 -3.2320 -3.1046 -3.1046 -3.0182 -3.0182 -2.8794 -2.8794 -2.6425 -2.6425 -2.6358 -2.6358 -2.6196 -2.6196 -2.5954 -2.5954 -2.5173 -2.5173 -2.5046 -2.5046 -2.3876 -2.3876 -2.3475 -2.3475 -0.5935 -0.5935 -0.5914 -0.5914 -0.5537 -0.5537 -0.5095 -0.5095 -0.4770 -0.4770 -0.4392 -0.4392 -0.3818 -0.3818 -0.3295 -0.3295 -0.2888 -0.2888 -0.2007 -0.2007 -0.1120 -0.1120 -0.1071 -0.1071 3.5767 3.5767 3.6771 3.6771 4.1183 4.1183 4.1810 4.1810 7.4958 7.4958 8.8685 8.8685 8.9522 8.9522 9.5351 9.5351 11.2310 11.2310 11.5122 11.5122 11.7715 11.7715 12.1371 12.1371 12.5448 12.5448 12.6608 12.6608 13.0101 13.0101 k = 0.3252 0.5633-0.0000 ( 6842 PWs) bands (ev): -18.1732 -18.1732 -18.1437 -18.1437 -4.9568 -4.9568 -4.8766 -4.8766 -3.2319 -3.2319 -3.1045 -3.1045 -3.0186 -3.0186 -2.8794 -2.8794 -2.6422 -2.6422 -2.6357 -2.6357 -2.6194 -2.6194 -2.5952 -2.5952 -2.5182 -2.5182 -2.5040 -2.5040 -2.3878 -2.3878 -2.3472 -2.3472 -0.5934 -0.5934 -0.5915 -0.5915 -0.5537 -0.5537 -0.5098 -0.5098 -0.4769 -0.4769 -0.4390 -0.4390 -0.3819 -0.3819 -0.3291 -0.3291 -0.2886 -0.2886 -0.2007 -0.2007 -0.1126 -0.1126 -0.1070 -0.1070 3.5603 3.5603 3.6917 3.6917 4.0811 4.0811 4.2206 4.2206 7.5002 7.5002 8.8675 8.8675 8.9509 8.9509 9.5332 9.5332 11.2167 11.2167 11.5208 11.5208 11.7725 11.7725 12.1371 12.1371 12.5469 12.5469 12.6692 12.6692 12.9596 12.9596 k = 0.3171 0.5492-0.0000 ( 6858 PWs) bands (ev): -18.1732 -18.1732 -18.1437 -18.1437 -4.9568 -4.9568 -4.8765 -4.8765 -3.2317 -3.2317 -3.1041 -3.1041 -3.0197 -3.0197 -2.8796 -2.8796 -2.6415 -2.6415 -2.6357 -2.6357 -2.6186 -2.6186 -2.5948 -2.5948 -2.5207 -2.5207 -2.5024 -2.5024 -2.3883 -2.3883 -2.3465 -2.3465 -0.5933 -0.5933 -0.5915 -0.5915 -0.5535 -0.5535 -0.5107 -0.5107 -0.4769 -0.4769 -0.4387 -0.4387 -0.3822 -0.3822 -0.3280 -0.3280 -0.2880 -0.2880 -0.2008 -0.2008 -0.1141 -0.1141 -0.1068 -0.1068 3.5219 3.5219 3.7249 3.7249 4.0253 4.0253 4.2836 4.2836 7.5134 7.5134 8.8639 8.8639 8.9475 8.9475 9.5283 9.5283 11.1800 11.1800 11.5368 11.5368 11.7798 11.7798 12.1355 12.1355 12.5549 12.5549 12.6930 12.6930 12.8979 12.8979 k = 0.3089 0.5351-0.0000 ( 6842 PWs) bands (ev): -18.1732 -18.1732 -18.1437 -18.1437 -4.9567 -4.9567 -4.8764 -4.8764 -3.2312 -3.2312 -3.1036 -3.1036 -3.0214 -3.0214 -2.8798 -2.8798 -2.6403 -2.6403 -2.6358 -2.6358 -2.6172 -2.6172 -2.5941 -2.5941 -2.5242 -2.5242 -2.5003 -2.5003 -2.3890 -2.3890 -2.3454 -2.3454 -0.5933 -0.5933 -0.5912 -0.5912 -0.5533 -0.5533 -0.5120 -0.5120 -0.4768 -0.4768 -0.4382 -0.4382 -0.3825 -0.3825 -0.3262 -0.3262 -0.2870 -0.2870 -0.2010 -0.2010 -0.1161 -0.1161 -0.1067 -0.1067 3.4730 3.4730 3.7655 3.7655 3.9690 3.9690 4.3521 4.3521 7.5348 7.5348 8.8559 8.8559 8.9437 8.9437 9.5212 9.5212 11.1315 11.1315 11.5425 11.5425 11.8023 11.8023 12.1303 12.1303 12.5691 12.5691 12.7280 12.7280 12.8432 12.8432 k = 0.3008 0.5210-0.0000 ( 6844 PWs) bands (ev): -18.1732 -18.1732 -18.1437 -18.1437 -4.9566 -4.9566 -4.8762 -4.8762 -3.2307 -3.2307 -3.1028 -3.1028 -3.0238 -3.0238 -2.8801 -2.8801 -2.6390 -2.6390 -2.6359 -2.6359 -2.6150 -2.6150 -2.5932 -2.5932 -2.5283 -2.5283 -2.4980 -2.4980 -2.3899 -2.3899 -2.3440 -2.3440 -0.5939 -0.5939 -0.5904 -0.5904 -0.5530 -0.5530 -0.5136 -0.5136 -0.4767 -0.4767 -0.4376 -0.4376 -0.3830 -0.3830 -0.3238 -0.3238 -0.2858 -0.2858 -0.2013 -0.2013 -0.1185 -0.1185 -0.1071 -0.1071 3.4174 3.4174 3.8098 3.8098 3.9141 3.9141 4.4243 4.4243 7.5641 7.5641 8.8415 8.8415 8.9415 8.9415 9.5131 9.5131 11.0779 11.0779 11.5296 11.5296 11.8429 11.8429 12.1216 12.1216 12.5867 12.5867 12.7545 12.7545 12.8165 12.8165 k = 0.2927 0.5069-0.0000 ( 6842 PWs) bands (ev): -18.1733 -18.1733 -18.1438 -18.1438 -4.9564 -4.9564 -4.8760 -4.8760 -3.2300 -3.2300 -3.1019 -3.1019 -3.0267 -3.0267 -2.8804 -2.8804 -2.6380 -2.6380 -2.6356 -2.6356 -2.6122 -2.6122 -2.5920 -2.5920 -2.5325 -2.5325 -2.4957 -2.4957 -2.3909 -2.3909 -2.3426 -2.3426 -0.5948 -0.5948 -0.5892 -0.5892 -0.5529 -0.5529 -0.5152 -0.5152 -0.4768 -0.4768 -0.4369 -0.4369 -0.3834 -0.3834 -0.3208 -0.3208 -0.2842 -0.2842 -0.2018 -0.2018 -0.1213 -0.1213 -0.1077 -0.1077 3.3569 3.3569 3.8526 3.8526 3.8650 3.8650 4.4998 4.4998 7.6006 7.6006 8.8196 8.8196 8.9423 8.9423 9.5049 9.5049 11.0227 11.0227 11.5011 11.5011 11.8956 11.8956 12.1110 12.1110 12.6002 12.6002 12.7360 12.7360 12.8587 12.8587 k = 0.2846 0.4929-0.0000 ( 6842 PWs) bands (ev): -18.1734 -18.1734 -18.1438 -18.1438 -4.9562 -4.9562 -4.8757 -4.8757 -3.2292 -3.2292 -3.1009 -3.1009 -3.0299 -3.0299 -2.8808 -2.8808 -2.6379 -2.6379 -2.6344 -2.6344 -2.6088 -2.6088 -2.5906 -2.5906 -2.5367 -2.5367 -2.4934 -2.4934 -2.3919 -2.3919 -2.3410 -2.3410 -0.5961 -0.5961 -0.5876 -0.5876 -0.5529 -0.5529 -0.5165 -0.5165 -0.4769 -0.4769 -0.4361 -0.4361 -0.3838 -0.3838 -0.3175 -0.3175 -0.2822 -0.2822 -0.2026 -0.2026 -0.1244 -0.1244 -0.1085 -0.1085 3.2922 3.2922 3.8084 3.8084 3.9067 3.9067 4.5785 4.5785 7.6437 7.6437 8.7904 8.7904 8.9460 8.9460 9.4976 9.4976 10.9674 10.9674 11.4628 11.4628 11.9499 11.9499 12.1037 12.1037 12.5969 12.5969 12.7243 12.7243 12.9266 12.9266 k = 0.2764 0.4788-0.0000 ( 6830 PWs) bands (ev): -18.1734 -18.1734 -18.1439 -18.1439 -4.9560 -4.9560 -4.8753 -4.8753 -3.2283 -3.2283 -3.0999 -3.0999 -3.0333 -3.0333 -2.8814 -2.8814 -2.6383 -2.6383 -2.6328 -2.6328 -2.6053 -2.6053 -2.5890 -2.5890 -2.5405 -2.5405 -2.4911 -2.4911 -2.3929 -2.3929 -2.3395 -2.3395 -0.5976 -0.5976 -0.5858 -0.5858 -0.5532 -0.5532 -0.5175 -0.5175 -0.4773 -0.4773 -0.4352 -0.4352 -0.3840 -0.3840 -0.3139 -0.3139 -0.2800 -0.2800 -0.2035 -0.2035 -0.1279 -0.1279 -0.1096 -0.1096 3.2241 3.2241 3.7589 3.7589 3.9574 3.9574 4.6604 4.6604 7.6928 7.6928 8.7549 8.7549 8.9520 8.9520 9.4920 9.4920 10.9130 10.9130 11.4189 11.4189 11.9889 11.9889 12.1130 12.1130 12.5747 12.5747 12.7333 12.7333 13.0046 13.0046 k = 0.2683 0.4647-0.0000 ( 6834 PWs) bands (ev): -18.1735 -18.1735 -18.1440 -18.1440 -4.9558 -4.9558 -4.8748 -4.8748 -3.2274 -3.2274 -3.0989 -3.0989 -3.0367 -3.0367 -2.8820 -2.8820 -2.6387 -2.6387 -2.6311 -2.6311 -2.6020 -2.6020 -2.5873 -2.5873 -2.5433 -2.5433 -2.4888 -2.4888 -2.3939 -2.3939 -2.3381 -2.3381 -0.5993 -0.5993 -0.5838 -0.5838 -0.5538 -0.5538 -0.5178 -0.5178 -0.4777 -0.4777 -0.4343 -0.4343 -0.3841 -0.3841 -0.3102 -0.3102 -0.2774 -0.2774 -0.2047 -0.2047 -0.1317 -0.1317 -0.1109 -0.1109 3.1533 3.1533 3.7112 3.7112 4.0099 4.0099 4.7453 4.7453 7.7472 7.7472 8.7141 8.7141 8.9596 8.9596 9.4888 9.4888 10.8600 10.8600 11.3721 11.3721 11.9966 11.9966 12.1527 12.1527 12.5459 12.5459 12.7507 12.7507 13.0892 13.0892 k = 0.2602 0.4506-0.0000 ( 6835 PWs) bands (ev): -18.1736 -18.1736 -18.1440 -18.1440 -4.9555 -4.9555 -4.8742 -4.8742 -3.2265 -3.2265 -3.0981 -3.0981 -3.0399 -3.0399 -2.8828 -2.8828 -2.6391 -2.6391 -2.6294 -2.6294 -2.5994 -2.5994 -2.5856 -2.5856 -2.5447 -2.5447 -2.4866 -2.4866 -2.3950 -2.3950 -2.3368 -2.3368 -0.6012 -0.6012 -0.5818 -0.5818 -0.5547 -0.5547 -0.5176 -0.5176 -0.4783 -0.4783 -0.4334 -0.4334 -0.3841 -0.3841 -0.3066 -0.3066 -0.2744 -0.2744 -0.2061 -0.2061 -0.1358 -0.1358 -0.1123 -0.1123 3.0802 3.0802 3.6654 3.6654 4.0639 4.0639 4.8331 4.8331 7.8060 7.8060 8.6690 8.6690 8.9686 8.9686 9.4887 9.4887 10.8085 10.8085 11.3242 11.3242 11.9838 11.9838 12.2092 12.2092 12.5192 12.5192 12.7672 12.7672 13.1773 13.1773 k = 0.2520 0.4365-0.0000 ( 6837 PWs) bands (ev): -18.1737 -18.1737 -18.1441 -18.1441 -4.9552 -4.9552 -4.8735 -4.8735 -3.2256 -3.2256 -3.0975 -3.0975 -3.0428 -3.0428 -2.8836 -2.8836 -2.6395 -2.6395 -2.6278 -2.6278 -2.5976 -2.5976 -2.5844 -2.5844 -2.5442 -2.5442 -2.4841 -2.4841 -2.3959 -2.3959 -2.3356 -2.3356 -0.6032 -0.6032 -0.5800 -0.5800 -0.5556 -0.5556 -0.5167 -0.5167 -0.4789 -0.4789 -0.4324 -0.4324 -0.3838 -0.3838 -0.3032 -0.3032 -0.2711 -0.2711 -0.2078 -0.2078 -0.1402 -0.1402 -0.1138 -0.1138 3.0053 3.0053 3.6215 3.6215 4.1192 4.1192 4.9239 4.9239 7.8686 7.8686 8.6207 8.6207 8.9784 8.9784 9.4920 9.4920 10.7589 10.7589 11.2764 11.2764 11.9632 11.9632 12.2660 12.2660 12.5006 12.5006 12.7787 12.7787 13.2642 13.2642 k = 0.2439 0.4225-0.0000 ( 6841 PWs) bands (ev): -18.1739 -18.1739 -18.1442 -18.1442 -4.9549 -4.9549 -4.8727 -4.8727 -3.2247 -3.2247 -3.0974 -3.0974 -3.0452 -3.0452 -2.8845 -2.8845 -2.6397 -2.6397 -2.6263 -2.6263 -2.5966 -2.5966 -2.5837 -2.5837 -2.5418 -2.5418 -2.4814 -2.4814 -2.3969 -2.3969 -2.3346 -2.3346 -0.6054 -0.6054 -0.5788 -0.5788 -0.5561 -0.5561 -0.5152 -0.5152 -0.4796 -0.4796 -0.4313 -0.4313 -0.3833 -0.3833 -0.3000 -0.3000 -0.2675 -0.2675 -0.2097 -0.2097 -0.1449 -0.1449 -0.1154 -0.1154 2.9291 2.9291 3.5794 3.5794 4.1756 4.1756 5.0175 5.0175 7.9340 7.9340 8.5702 8.5702 8.9891 8.9891 9.4990 9.4990 10.7110 10.7110 11.2298 11.2298 11.9392 11.9392 12.3107 12.3107 12.4976 12.4976 12.7832 12.7832 13.3422 13.3422 k = 0.2358 0.4084-0.0000 ( 6839 PWs) bands (ev): -18.1740 -18.1740 -18.1443 -18.1443 -4.9545 -4.9545 -4.8719 -4.8719 -3.2239 -3.2239 -3.0977 -3.0977 -3.0469 -3.0469 -2.8854 -2.8854 -2.6399 -2.6399 -2.6250 -2.6250 -2.5966 -2.5966 -2.5833 -2.5833 -2.5380 -2.5380 -2.4782 -2.4782 -2.3978 -2.3978 -2.3339 -2.3339 -0.6075 -0.6075 -0.5785 -0.5785 -0.5560 -0.5560 -0.5131 -0.5131 -0.4801 -0.4801 -0.4302 -0.4302 -0.3827 -0.3827 -0.2972 -0.2972 -0.2637 -0.2637 -0.2118 -0.2118 -0.1498 -0.1498 -0.1171 -0.1171 2.8521 2.8521 3.5392 3.5392 4.2330 4.2330 5.1140 5.1140 8.0013 8.0013 8.5187 8.5187 9.0005 9.0005 9.5098 9.5098 10.6651 10.6651 11.1853 11.1853 11.9132 11.9132 12.3322 12.3322 12.5190 12.5190 12.7804 12.7804 13.3978 13.3978 k = 0.2276 0.3943-0.0000 ( 6843 PWs) bands (ev): -18.1742 -18.1742 -18.1444 -18.1444 -4.9542 -4.9542 -4.8709 -4.8709 -3.2232 -3.2232 -3.0985 -3.0985 -3.0479 -3.0479 -2.8864 -2.8864 -2.6400 -2.6400 -2.6239 -2.6239 -2.5972 -2.5972 -2.5827 -2.5827 -2.5337 -2.5337 -2.4743 -2.4743 -2.3986 -2.3986 -2.3333 -2.3333 -0.6098 -0.6098 -0.5794 -0.5794 -0.5547 -0.5547 -0.5107 -0.5107 -0.4805 -0.4805 -0.4291 -0.4291 -0.3819 -0.3819 -0.2948 -0.2948 -0.2598 -0.2598 -0.2140 -0.2140 -0.1548 -0.1548 -0.1188 -0.1188 2.7747 2.7747 3.5007 3.5007 4.2913 4.2913 5.2131 5.2131 8.0690 8.0690 8.4678 8.4678 9.0128 9.0128 9.5242 9.5242 10.6211 10.6211 11.1438 11.1438 11.8859 11.8859 12.3319 12.3319 12.5602 12.5602 12.7709 12.7709 13.4135 13.4135 k = 0.2195 0.3802-0.0000 ( 6863 PWs) bands (ev): -18.1743 -18.1743 -18.1446 -18.1446 -4.9538 -4.9538 -4.8698 -4.8698 -3.2227 -3.2227 -3.0998 -3.0998 -3.0483 -3.0483 -2.8873 -2.8873 -2.6400 -2.6400 -2.6231 -2.6231 -2.5981 -2.5981 -2.5819 -2.5819 -2.5296 -2.5296 -2.4694 -2.4694 -2.3992 -2.3992 -2.3331 -2.3331 -0.6119 -0.6119 -0.5815 -0.5815 -0.5526 -0.5526 -0.5080 -0.5080 -0.4807 -0.4807 -0.4278 -0.4278 -0.3809 -0.3809 -0.2928 -0.2928 -0.2561 -0.2561 -0.2163 -0.2163 -0.1599 -0.1599 -0.1207 -0.1207 2.6972 2.6972 3.4639 3.4639 4.3501 4.3501 5.3149 5.3149 8.1343 8.1343 8.4204 8.4204 9.0261 9.0261 9.5419 9.5419 10.5789 10.5789 11.1061 11.1061 11.8575 11.8575 12.3202 12.3202 12.6068 12.6068 12.7577 12.7577 13.3811 13.3811 k = 0.2114 0.3661-0.0000 ( 6859 PWs) bands (ev): -18.1745 -18.1745 -18.1447 -18.1447 -4.9535 -4.9535 -4.8686 -4.8686 -3.2223 -3.2223 -3.1015 -3.1015 -3.0482 -3.0482 -2.8882 -2.8882 -2.6400 -2.6400 -2.6226 -2.6226 -2.5989 -2.5989 -2.5808 -2.5808 -2.5261 -2.5261 -2.4633 -2.4633 -2.3997 -2.3997 -2.3331 -2.3331 -0.6140 -0.6140 -0.5844 -0.5844 -0.5498 -0.5498 -0.5049 -0.5049 -0.4805 -0.4805 -0.4265 -0.4265 -0.3797 -0.3797 -0.2911 -0.2911 -0.2526 -0.2526 -0.2186 -0.2186 -0.1649 -0.1649 -0.1226 -0.1226 2.6200 2.6200 3.4288 3.4288 4.4093 4.4093 5.4193 5.4193 8.1897 8.1897 8.3843 8.3843 9.0405 9.0405 9.5624 9.5624 10.5388 10.5388 11.0730 11.0730 11.8280 11.8280 12.3031 12.3031 12.6424 12.6424 12.7491 12.7491 13.3111 13.3111 k = 0.2033 0.3520-0.0000 ( 6855 PWs) bands (ev): -18.1747 -18.1747 -18.1448 -18.1448 -4.9531 -4.9531 -4.8673 -4.8673 -3.2221 -3.2221 -3.1034 -3.1034 -3.0476 -3.0476 -2.8889 -2.8889 -2.6399 -2.6399 -2.6223 -2.6223 -2.5992 -2.5992 -2.5796 -2.5796 -2.5236 -2.5236 -2.4560 -2.4560 -2.4001 -2.4001 -2.3334 -2.3334 -0.6160 -0.6160 -0.5878 -0.5878 -0.5467 -0.5467 -0.5017 -0.5017 -0.4799 -0.4799 -0.4251 -0.4251 -0.3783 -0.3783 -0.2898 -0.2898 -0.2498 -0.2498 -0.2207 -0.2207 -0.1696 -0.1696 -0.1247 -0.1247 2.5435 2.5435 3.3953 3.3953 4.4687 4.4687 5.5260 5.5260 8.2147 8.2147 8.3799 8.3799 9.0565 9.0565 9.5853 9.5853 10.5006 10.5006 11.0452 11.0452 11.7971 11.7971 12.2826 12.2826 12.6484 12.6484 12.7591 12.7591 13.2212 13.2212 k = 0.1951 0.3380-0.0000 ( 6859 PWs) bands (ev): -18.1749 -18.1749 -18.1450 -18.1450 -4.9528 -4.9528 -4.8659 -4.8659 -3.2221 -3.2221 -3.1055 -3.1055 -3.0467 -3.0467 -2.8895 -2.8895 -2.6399 -2.6399 -2.6222 -2.6222 -2.5991 -2.5991 -2.5783 -2.5783 -2.5220 -2.5220 -2.4478 -2.4478 -2.4002 -2.4002 -2.3340 -2.3340 -0.6178 -0.6178 -0.5917 -0.5917 -0.5436 -0.5436 -0.4983 -0.4983 -0.4788 -0.4788 -0.4236 -0.4236 -0.3769 -0.3769 -0.2888 -0.2888 -0.2478 -0.2478 -0.2227 -0.2227 -0.1740 -0.1740 -0.1270 -0.1270 2.4678 2.4678 3.3633 3.3633 4.5279 4.5279 5.6351 5.6351 8.1979 8.1979 8.4191 8.4191 9.0740 9.0740 9.6100 9.6100 10.4644 10.4644 11.0233 11.0233 11.7644 11.7644 12.2590 12.2590 12.6287 12.6287 12.7777 12.7777 13.1286 13.1286 k = 0.1870 0.3239-0.0000 ( 6861 PWs) bands (ev): -18.1751 -18.1751 -18.1451 -18.1451 -4.9525 -4.9525 -4.8644 -4.8644 -3.2224 -3.2224 -3.1076 -3.1076 -3.0457 -3.0457 -2.8898 -2.8898 -2.6400 -2.6400 -2.6221 -2.6221 -2.5985 -2.5985 -2.5770 -2.5770 -2.5212 -2.5212 -2.4389 -2.4389 -2.4000 -2.4000 -2.3348 -2.3348 -0.6195 -0.6195 -0.5957 -0.5957 -0.5406 -0.5406 -0.4948 -0.4948 -0.4770 -0.4770 -0.4221 -0.4221 -0.3753 -0.3753 -0.2881 -0.2881 -0.2469 -0.2469 -0.2245 -0.2245 -0.1776 -0.1776 -0.1294 -0.1294 2.3934 2.3934 3.3328 3.3328 4.5867 4.5867 5.7463 5.7463 8.1622 8.1622 8.4789 8.4789 9.0935 9.0935 9.6359 9.6359 10.4304 10.4304 11.0080 11.0080 11.7290 11.7290 12.2317 12.2317 12.5995 12.5995 12.7759 12.7759 13.0535 13.0535 k = 0.1789 0.3098-0.0000 ( 6863 PWs) bands (ev): -18.1753 -18.1753 -18.1453 -18.1453 -4.9521 -4.9521 -4.8629 -4.8629 -3.2229 -3.2229 -3.1096 -3.1096 -3.0446 -3.0446 -2.8899 -2.8899 -2.6401 -2.6401 -2.6218 -2.6218 -2.5976 -2.5976 -2.5757 -2.5757 -2.5209 -2.5209 -2.4297 -2.4297 -2.3993 -2.3993 -2.3360 -2.3360 -0.6210 -0.6210 -0.6000 -0.6000 -0.5379 -0.5379 -0.4913 -0.4913 -0.4744 -0.4744 -0.4204 -0.4204 -0.3736 -0.3736 -0.2877 -0.2877 -0.2472 -0.2472 -0.2263 -0.2263 -0.1804 -0.1804 -0.1320 -0.1320 2.3204 2.3204 3.3038 3.3038 4.6448 4.6448 5.8596 5.8596 8.1227 8.1227 8.5441 8.5441 9.1149 9.1149 9.6627 9.6627 10.3986 10.3986 10.9997 10.9997 11.6899 11.6899 12.1994 12.1994 12.5683 12.5683 12.7329 12.7329 13.0148 13.0148 k = 0.1707 0.2957-0.0000 ( 6855 PWs) bands (ev): -18.1755 -18.1755 -18.1454 -18.1454 -4.9518 -4.9518 -4.8613 -4.8613 -3.2237 -3.2237 -3.1115 -3.1115 -3.0436 -3.0436 -2.8896 -2.8896 -2.6404 -2.6404 -2.6214 -2.6214 -2.5963 -2.5963 -2.5745 -2.5745 -2.5210 -2.5210 -2.4208 -2.4208 -2.3979 -2.3979 -2.3375 -2.3375 -0.6223 -0.6223 -0.6041 -0.6041 -0.5355 -0.5355 -0.4878 -0.4878 -0.4711 -0.4711 -0.4186 -0.4186 -0.3718 -0.3718 -0.2875 -0.2875 -0.2485 -0.2485 -0.2284 -0.2284 -0.1821 -0.1821 -0.1347 -0.1347 2.2491 2.2491 3.2761 3.2761 4.7017 4.7017 5.9746 5.9746 8.0847 8.0847 8.6098 8.6098 9.1384 9.1384 9.6901 9.6901 10.3692 10.3692 10.9987 10.9987 11.6453 11.6453 12.1609 12.1609 12.5384 12.5384 12.6581 12.6581 13.0039 13.0039 k = 0.1626 0.2816-0.0000 ( 6851 PWs) bands (ev): -18.1758 -18.1758 -18.1456 -18.1456 -4.9516 -4.9516 -4.8596 -4.8596 -3.2248 -3.2248 -3.1132 -3.1132 -3.0427 -3.0427 -2.8891 -2.8891 -2.6407 -2.6407 -2.6207 -2.6207 -2.5948 -2.5948 -2.5734 -2.5734 -2.5213 -2.5213 -2.4132 -2.4132 -2.3948 -2.3948 -2.3393 -2.3393 -0.6237 -0.6237 -0.6081 -0.6081 -0.5337 -0.5337 -0.4844 -0.4844 -0.4669 -0.4669 -0.4166 -0.4166 -0.3700 -0.3700 -0.2876 -0.2876 -0.2504 -0.2504 -0.2311 -0.2311 -0.1827 -0.1827 -0.1377 -0.1377 2.1797 2.1797 3.2498 3.2498 4.7572 4.7572 6.0913 6.0913 8.0502 8.0502 8.6737 8.6737 9.1640 9.1640 9.7182 9.7182 10.3424 10.3424 11.0049 11.0049 11.5932 11.5932 12.1150 12.1150 12.5121 12.5121 12.5755 12.5755 12.9980 12.9980 k = 0.1545 0.2676-0.0000 ( 6851 PWs) bands (ev): -18.1760 -18.1760 -18.1458 -18.1458 -4.9513 -4.9513 -4.8578 -4.8578 -3.2261 -3.2261 -3.1147 -3.1147 -3.0420 -3.0420 -2.8882 -2.8882 -2.6411 -2.6411 -2.6197 -2.6197 -2.5932 -2.5932 -2.5725 -2.5725 -2.5214 -2.5214 -2.4082 -2.4082 -2.3890 -2.3890 -2.3413 -2.3413 -0.6254 -0.6254 -0.6116 -0.6116 -0.5322 -0.5322 -0.4811 -0.4811 -0.4620 -0.4620 -0.4146 -0.4146 -0.3681 -0.3681 -0.2878 -0.2878 -0.2528 -0.2528 -0.2346 -0.2346 -0.1824 -0.1824 -0.1408 -0.1408 2.1124 2.1124 3.2249 3.2249 4.8108 4.8108 6.2094 6.2094 8.0205 8.0205 8.7344 8.7344 9.1918 9.1918 9.7473 9.7473 10.3183 10.3183 11.0179 11.0179 11.5312 11.5312 12.0621 12.0621 12.4872 12.4872 12.5030 12.5030 12.9837 12.9837 k = 0.1463 0.2535-0.0000 ( 6847 PWs) bands (ev): -18.1762 -18.1762 -18.1459 -18.1459 -4.9511 -4.9511 -4.8560 -4.8560 -3.2277 -3.2277 -3.1159 -3.1159 -3.0414 -3.0414 -2.8869 -2.8869 -2.6415 -2.6415 -2.6187 -2.6187 -2.5914 -2.5914 -2.5719 -2.5719 -2.5213 -2.5213 -2.4055 -2.4055 -2.3810 -2.3810 -2.3435 -2.3435 -0.6277 -0.6277 -0.6141 -0.6141 -0.5312 -0.5312 -0.4779 -0.4779 -0.4565 -0.4565 -0.4123 -0.4123 -0.3662 -0.3662 -0.2883 -0.2883 -0.2554 -0.2554 -0.2385 -0.2385 -0.1816 -0.1816 -0.1441 -0.1441 2.0475 2.0475 3.2012 3.2012 4.8622 4.8622 6.3285 6.3285 7.9966 7.9966 8.7906 8.7906 9.2218 9.2218 9.7779 9.7779 10.2971 10.2971 11.0372 11.0372 11.4569 11.4569 12.0047 12.0047 12.4295 12.4295 12.4802 12.4802 12.9548 12.9548 k = 0.1382 0.2394-0.0000 ( 6845 PWs) bands (ev): -18.1764 -18.1764 -18.1461 -18.1461 -4.9508 -4.9508 -4.8542 -4.8542 -3.2295 -3.2295 -3.1169 -3.1169 -3.0411 -3.0411 -2.8852 -2.8852 -2.6420 -2.6420 -2.6176 -2.6176 -2.5897 -2.5897 -2.5715 -2.5715 -2.5208 -2.5208 -2.4038 -2.4038 -2.3722 -2.3722 -2.3458 -2.3458 -0.6309 -0.6309 -0.6154 -0.6154 -0.5305 -0.5305 -0.4749 -0.4749 -0.4504 -0.4504 -0.4098 -0.4098 -0.3643 -0.3643 -0.2889 -0.2889 -0.2582 -0.2582 -0.2428 -0.2428 -0.1805 -0.1805 -0.1474 -0.1474 1.9850 1.9850 3.1787 3.1787 4.9109 4.9109 6.4484 6.4484 7.9792 7.9792 8.8413 8.8413 9.2542 9.2542 9.8105 9.8105 10.2792 10.2792 11.0619 11.0619 11.3688 11.3688 11.9470 11.9470 12.3741 12.3741 12.4722 12.4722 12.9099 12.9099 k = 0.1301 0.2253-0.0000 ( 6859 PWs) bands (ev): -18.1767 -18.1767 -18.1463 -18.1463 -4.9506 -4.9506 -4.8524 -4.8524 -3.2315 -3.2315 -3.1178 -3.1178 -3.0410 -3.0410 -2.8832 -2.8832 -2.6424 -2.6424 -2.6164 -2.6164 -2.5879 -2.5879 -2.5715 -2.5715 -2.5196 -2.5196 -2.4026 -2.4026 -2.3639 -2.3639 -2.3475 -2.3475 -0.6348 -0.6348 -0.6156 -0.6156 -0.5301 -0.5301 -0.4721 -0.4721 -0.4441 -0.4441 -0.4069 -0.4069 -0.3624 -0.3624 -0.2897 -0.2897 -0.2611 -0.2611 -0.2473 -0.2473 -0.1797 -0.1797 -0.1506 -0.1506 1.9252 1.9252 3.1575 3.1575 4.9567 4.9567 6.5687 6.5687 7.9691 7.9691 8.8855 8.8855 9.2891 9.2891 9.8460 9.8460 10.2648 10.2648 11.0908 11.0908 11.2669 11.2669 11.8929 11.8929 12.3269 12.3269 12.4694 12.4694 12.8518 12.8518 k = 0.1220 0.2112-0.0000 ( 6867 PWs) bands (ev): -18.1769 -18.1769 -18.1464 -18.1464 -4.9505 -4.9505 -4.8506 -4.8506 -3.2336 -3.2336 -3.1183 -3.1183 -3.0410 -3.0410 -2.8809 -2.8809 -2.6429 -2.6429 -2.6154 -2.6154 -2.5861 -2.5861 -2.5717 -2.5717 -2.5179 -2.5179 -2.4015 -2.4015 -2.3588 -2.3588 -2.3464 -2.3464 -0.6391 -0.6391 -0.6151 -0.6151 -0.5300 -0.5300 -0.4695 -0.4695 -0.4377 -0.4377 -0.4037 -0.4037 -0.3606 -0.3606 -0.2907 -0.2907 -0.2639 -0.2639 -0.2517 -0.2517 -0.1795 -0.1795 -0.1534 -0.1534 1.8682 1.8682 3.1376 3.1376 4.9992 4.9992 6.6890 6.6890 7.9666 7.9666 8.9224 8.9224 9.3267 9.3267 9.8848 9.8848 10.2542 10.2542 11.1225 11.1225 11.1532 11.1532 11.8447 11.8447 12.2855 12.2855 12.4680 12.4680 12.7872 12.7872 k = 0.1138 0.1971-0.0000 ( 6865 PWs) bands (ev): -18.1771 -18.1771 -18.1466 -18.1466 -4.9503 -4.9503 -4.8488 -4.8488 -3.2359 -3.2359 -3.1187 -3.1187 -3.0412 -3.0412 -2.8782 -2.8782 -2.6435 -2.6435 -2.6145 -2.6145 -2.5843 -2.5843 -2.5721 -2.5721 -2.5155 -2.5155 -2.4006 -2.4006 -2.3593 -2.3593 -2.3402 -2.3402 -0.6435 -0.6435 -0.6139 -0.6139 -0.5300 -0.5300 -0.4672 -0.4672 -0.4313 -0.4313 -0.3999 -0.3999 -0.3588 -0.3588 -0.2918 -0.2918 -0.2667 -0.2667 -0.2561 -0.2561 -0.1803 -0.1803 -0.1555 -0.1555 1.8142 1.8142 3.1188 3.1188 5.0381 5.0381 6.8087 6.8087 7.9723 7.9723 8.9518 8.9518 9.3669 9.3669 9.9272 9.9272 10.2474 10.2474 11.0299 11.0299 11.1566 11.1566 11.8026 11.8026 12.2461 12.2461 12.4605 12.4605 12.7288 12.7288 k = 0.1057 0.1831-0.0000 ( 6853 PWs) bands (ev): -18.1773 -18.1773 -18.1467 -18.1467 -4.9502 -4.9502 -4.8471 -4.8471 -3.2383 -3.2383 -3.1189 -3.1189 -3.0415 -3.0415 -2.8753 -2.8753 -2.6441 -2.6441 -2.6138 -2.6138 -2.5826 -2.5826 -2.5727 -2.5727 -2.5126 -2.5126 -2.3996 -2.3996 -2.3620 -2.3620 -2.3322 -2.3322 -0.6480 -0.6480 -0.6123 -0.6123 -0.5303 -0.5303 -0.4652 -0.4652 -0.4253 -0.4253 -0.3954 -0.3954 -0.3571 -0.3571 -0.2929 -0.2929 -0.2694 -0.2694 -0.2601 -0.2601 -0.1826 -0.1826 -0.1566 -0.1566 1.7633 1.7633 3.1013 3.1013 5.0733 5.0733 6.9273 6.9273 7.9865 7.9865 8.9738 8.9738 9.4093 9.4093 9.9731 9.9731 10.2444 10.2444 10.9010 10.9010 11.1910 11.1910 11.7664 11.7664 12.2033 12.2033 12.4379 12.4379 12.6926 12.6926 k = 0.0976 0.1690-0.0000 ( 6865 PWs) bands (ev): -18.1775 -18.1775 -18.1469 -18.1469 -4.9501 -4.9501 -4.8454 -4.8454 -3.2408 -3.2408 -3.1190 -3.1190 -3.0420 -3.0420 -2.8722 -2.8722 -2.6449 -2.6449 -2.6133 -2.6133 -2.5810 -2.5810 -2.5732 -2.5732 -2.5091 -2.5091 -2.3988 -2.3988 -2.3653 -2.3653 -2.3242 -2.3242 -0.6524 -0.6524 -0.6103 -0.6103 -0.5307 -0.5307 -0.4635 -0.4635 -0.4198 -0.4198 -0.3901 -0.3901 -0.3555 -0.3555 -0.2942 -0.2942 -0.2720 -0.2720 -0.2638 -0.2638 -0.1862 -0.1862 -0.1569 -0.1569 1.7156 1.7156 3.0850 3.0850 5.1048 5.1048 7.0440 7.0440 8.0092 8.0092 8.9892 8.9892 9.4532 9.4532 10.0224 10.0224 10.2446 10.2446 10.7702 10.7702 11.2251 11.2251 11.7349 11.7349 12.1500 12.1500 12.4008 12.4008 12.6858 12.6858 k = 0.0894 0.1549-0.0000 ( 6853 PWs) bands (ev): -18.1777 -18.1777 -18.1470 -18.1470 -4.9500 -4.9500 -4.8438 -4.8438 -3.2432 -3.2432 -3.1190 -3.1190 -3.0424 -3.0424 -2.8690 -2.8690 -2.6457 -2.6457 -2.6131 -2.6131 -2.5795 -2.5795 -2.5737 -2.5737 -2.5052 -2.5052 -2.3980 -2.3980 -2.3689 -2.3689 -2.3165 -2.3165 -0.6566 -0.6566 -0.6080 -0.6080 -0.5312 -0.5312 -0.4621 -0.4621 -0.4150 -0.4150 -0.3839 -0.3839 -0.3540 -0.3540 -0.2956 -0.2956 -0.2745 -0.2745 -0.2671 -0.2671 -0.1909 -0.1909 -0.1566 -0.1566 1.6713 1.6713 3.0700 3.0700 5.1323 5.1323 7.1582 7.1582 8.0406 8.0406 8.9988 8.9988 9.4977 9.4977 10.0744 10.0744 10.2452 10.2452 10.6426 10.6426 11.2580 11.2580 11.7070 11.7070 12.0806 12.0806 12.3626 12.3626 12.7000 12.7000 k = 0.0813 0.1408-0.0000 ( 6849 PWs) bands (ev): -18.1779 -18.1779 -18.1472 -18.1472 -4.9500 -4.9500 -4.8422 -4.8422 -3.2456 -3.2456 -3.1189 -3.1189 -3.0430 -3.0430 -2.8657 -2.8657 -2.6467 -2.6467 -2.6131 -2.6131 -2.5781 -2.5781 -2.5739 -2.5739 -2.5010 -2.5010 -2.3974 -2.3974 -2.3725 -2.3725 -2.3093 -2.3093 -0.6606 -0.6606 -0.6055 -0.6055 -0.5318 -0.5318 -0.4611 -0.4611 -0.4107 -0.4107 -0.3771 -0.3771 -0.3526 -0.3526 -0.2970 -0.2970 -0.2768 -0.2768 -0.2700 -0.2700 -0.1965 -0.1965 -0.1560 -0.1560 1.6304 1.6304 3.0562 3.0562 5.1562 5.1562 7.2688 7.2688 8.0803 8.0803 9.0040 9.0040 9.5418 9.5418 10.1284 10.1284 10.2377 10.2377 10.5295 10.5295 11.2890 11.2890 11.6804 11.6804 11.9976 11.9976 12.3285 12.3285 12.7239 12.7239 k = 0.0732 0.1267-0.0000 ( 6859 PWs) bands (ev): -18.1781 -18.1781 -18.1473 -18.1473 -4.9499 -4.9499 -4.8408 -4.8408 -3.2480 -3.2480 -3.1186 -3.1186 -3.0436 -3.0436 -2.8623 -2.8623 -2.6478 -2.6478 -2.6133 -2.6133 -2.5771 -2.5771 -2.5737 -2.5737 -2.4965 -2.4965 -2.3971 -2.3971 -2.3760 -2.3760 -2.3026 -2.3026 -0.6644 -0.6644 -0.6028 -0.6028 -0.5325 -0.5325 -0.4604 -0.4604 -0.4070 -0.4070 -0.3698 -0.3698 -0.3513 -0.3513 -0.2985 -0.2985 -0.2789 -0.2789 -0.2723 -0.2723 -0.2026 -0.2026 -0.1552 -0.1552 1.5932 1.5932 3.0436 3.0436 5.1765 5.1765 7.3749 7.3749 8.1282 8.1282 9.0058 9.0058 9.5846 9.5846 10.1779 10.1779 10.2044 10.2044 10.4561 10.4561 11.3175 11.3175 11.6508 11.6508 11.9115 11.9115 12.2885 12.2885 12.6481 12.6481 k = 0.0650 0.1127-0.0000 ( 6857 PWs) bands (ev): -18.1782 -18.1782 -18.1474 -18.1474 -4.9499 -4.9499 -4.8395 -4.8395 -3.2502 -3.2502 -3.1184 -3.1184 -3.0441 -3.0441 -2.8591 -2.8591 -2.6490 -2.6490 -2.6136 -2.6136 -2.5766 -2.5766 -2.5731 -2.5731 -2.4919 -2.4919 -2.3974 -2.3974 -2.3791 -2.3791 -2.2966 -2.2966 -0.6679 -0.6679 -0.6000 -0.6000 -0.5332 -0.5332 -0.4599 -0.4599 -0.4037 -0.4037 -0.3627 -0.3627 -0.3496 -0.3496 -0.3001 -0.3001 -0.2807 -0.2807 -0.2743 -0.2743 -0.2093 -0.2093 -0.1545 -0.1545 1.5595 1.5595 3.0324 3.0324 5.1935 5.1935 7.4752 7.4752 8.1835 8.1835 9.0054 9.0054 9.6251 9.6251 10.1074 10.1074 10.2429 10.2429 10.4412 10.4412 11.3428 11.3428 11.6087 11.6087 11.8382 11.8382 12.2230 12.2230 12.5583 12.5583 k = 0.0569 0.0986-0.0000 ( 6845 PWs) bands (ev): -18.1783 -18.1783 -18.1475 -18.1475 -4.9498 -4.9498 -4.8382 -4.8382 -3.2522 -3.2522 -3.1181 -3.1181 -3.0447 -3.0447 -2.8559 -2.8559 -2.6503 -2.6503 -2.6140 -2.6140 -2.5763 -2.5763 -2.5721 -2.5721 -2.4873 -2.4873 -2.3984 -2.3984 -2.3814 -2.3814 -2.2911 -2.2911 -0.6711 -0.6711 -0.5972 -0.5972 -0.5340 -0.5340 -0.4597 -0.4597 -0.4007 -0.4007 -0.3571 -0.3571 -0.3465 -0.3465 -0.3015 -0.3015 -0.2821 -0.2821 -0.2759 -0.2759 -0.2163 -0.2163 -0.1537 -0.1537 1.5297 1.5297 3.0224 3.0224 5.2074 5.2074 7.5685 7.5685 8.2456 8.2456 9.0039 9.0039 9.6627 9.6627 9.9923 9.9923 10.2974 10.2974 10.4659 10.4659 11.3640 11.3640 11.5438 11.5438 11.7933 11.7933 12.1221 12.1221 12.5149 12.5149 k = 0.0488 0.0845-0.0000 ( 6841 PWs) bands (ev): -18.1785 -18.1785 -18.1476 -18.1476 -4.9498 -4.9498 -4.8372 -4.8372 -3.2541 -3.2541 -3.1178 -3.1178 -3.0452 -3.0452 -2.8530 -2.8530 -2.6516 -2.6516 -2.6144 -2.6144 -2.5762 -2.5762 -2.5711 -2.5711 -2.4826 -2.4826 -2.4003 -2.4003 -2.3829 -2.3829 -2.2864 -2.2864 -0.6739 -0.6739 -0.5945 -0.5945 -0.5348 -0.5348 -0.4598 -0.4598 -0.3981 -0.3981 -0.3543 -0.3543 -0.3407 -0.3407 -0.3029 -0.3029 -0.2833 -0.2833 -0.2770 -0.2770 -0.2236 -0.2236 -0.1531 -0.1531 1.5037 1.5037 3.0137 3.0137 5.2186 5.2186 7.6535 7.6535 8.3131 8.3131 9.0021 9.0021 9.6967 9.6967 9.8688 9.8688 10.3501 10.3501 10.5124 10.5124 11.3786 11.3786 11.4610 11.4610 11.7769 11.7769 11.9996 11.9996 12.5032 12.5032 k = 0.0407 0.0704-0.0000 ( 6829 PWs) bands (ev): -18.1786 -18.1786 -18.1477 -18.1477 -4.9498 -4.9498 -4.8362 -4.8362 -3.2557 -3.2557 -3.1176 -3.1176 -3.0456 -3.0456 -2.8503 -2.8503 -2.6529 -2.6529 -2.6147 -2.6147 -2.5761 -2.5761 -2.5701 -2.5701 -2.4782 -2.4782 -2.4029 -2.4029 -2.3836 -2.3836 -2.2823 -2.2823 -0.6763 -0.6763 -0.5919 -0.5919 -0.5357 -0.5357 -0.4599 -0.4599 -0.3957 -0.3957 -0.3533 -0.3533 -0.3336 -0.3336 -0.3042 -0.3042 -0.2840 -0.2840 -0.2777 -0.2777 -0.2311 -0.2311 -0.1526 -0.1526 1.4815 1.4815 3.0063 3.0063 5.2274 5.2274 7.7285 7.7285 8.3844 8.3844 9.0012 9.0012 9.7225 9.7225 9.7498 9.7498 10.3999 10.3999 10.5728 10.5728 11.3514 11.3514 11.4073 11.4073 11.7773 11.7773 11.8730 11.8730 12.5068 12.5068 k = 0.0325 0.0563-0.0000 ( 6829 PWs) bands (ev): -18.1787 -18.1787 -18.1477 -18.1477 -4.9498 -4.9498 -4.8355 -4.8355 -3.2571 -3.2571 -3.1173 -3.1173 -3.0460 -3.0460 -2.8480 -2.8480 -2.6541 -2.6541 -2.6150 -2.6150 -2.5760 -2.5760 -2.5692 -2.5692 -2.4741 -2.4741 -2.4059 -2.4059 -2.3838 -2.3838 -2.2789 -2.2789 -0.6783 -0.6783 -0.5895 -0.5895 -0.5365 -0.5365 -0.4602 -0.4602 -0.3936 -0.3936 -0.3530 -0.3530 -0.3262 -0.3262 -0.3053 -0.3053 -0.2845 -0.2845 -0.2779 -0.2779 -0.2387 -0.2387 -0.1522 -0.1522 1.4633 1.4633 3.0002 3.0002 5.2342 5.2342 7.7923 7.7923 8.4569 8.4569 9.0024 9.0024 9.6244 9.6244 9.7552 9.7552 10.4471 10.4471 10.6423 10.6423 11.2648 11.2648 11.4104 11.4104 11.7334 11.7334 11.8040 11.8040 12.5171 12.5171 k = 0.0244 0.0422-0.0000 ( 6819 PWs) bands (ev): -18.1787 -18.1787 -18.1478 -18.1478 -4.9498 -4.9498 -4.8349 -4.8349 -3.2581 -3.2581 -3.1171 -3.1171 -3.0463 -3.0463 -2.8462 -2.8462 -2.6551 -2.6551 -2.6153 -2.6153 -2.5760 -2.5760 -2.5685 -2.5685 -2.4704 -2.4704 -2.4087 -2.4087 -2.3838 -2.3838 -2.2763 -2.2763 -0.6799 -0.6799 -0.5876 -0.5876 -0.5371 -0.5371 -0.4604 -0.4604 -0.3919 -0.3919 -0.3530 -0.3530 -0.3195 -0.3195 -0.3061 -0.3061 -0.2848 -0.2848 -0.2773 -0.2773 -0.2463 -0.2463 -0.1519 -0.1519 1.4491 1.4491 2.9955 2.9955 5.2391 5.2391 7.8436 7.8436 8.5264 8.5264 9.0068 9.0068 9.5146 9.5146 9.7763 9.7763 10.4912 10.4912 10.7156 10.7156 11.1807 11.1807 11.4153 11.4153 11.6201 11.6201 11.8181 11.8181 12.5294 12.5294 k = 0.0163 0.0282-0.0000 ( 6813 PWs) bands (ev): -18.1788 -18.1788 -18.1478 -18.1478 -4.9498 -4.9498 -4.8344 -4.8344 -3.2589 -3.2589 -3.1170 -3.1170 -3.0465 -3.0465 -2.8448 -2.8448 -2.6558 -2.6558 -2.6155 -2.6155 -2.5759 -2.5759 -2.5680 -2.5680 -2.4675 -2.4675 -2.4112 -2.4112 -2.3837 -2.3837 -2.2744 -2.2744 -0.6811 -0.6811 -0.5861 -0.5861 -0.5377 -0.5377 -0.4607 -0.4607 -0.3907 -0.3907 -0.3532 -0.3532 -0.3141 -0.3141 -0.3067 -0.3067 -0.2850 -0.2850 -0.2755 -0.2755 -0.2537 -0.2537 -0.1516 -0.1516 1.4390 1.4390 2.9921 2.9921 5.2424 5.2424 7.8811 7.8811 8.5866 8.5866 9.0157 9.0157 9.4193 9.4193 9.7923 9.7923 10.5299 10.5299 10.7857 10.7857 11.1101 11.1101 11.4184 11.4184 11.5191 11.5191 11.8359 11.8359 12.5411 12.5411 k = 0.0081 0.0141-0.0000 ( 6801 PWs) bands (ev): -18.1788 -18.1788 -18.1478 -18.1478 -4.9498 -4.9498 -4.8341 -4.8341 -3.2594 -3.2594 -3.1169 -3.1169 -3.0466 -3.0466 -2.8439 -2.8439 -2.6563 -2.6563 -2.6156 -2.6156 -2.5759 -2.5759 -2.5677 -2.5677 -2.4656 -2.4656 -2.4128 -2.4128 -2.3836 -2.3836 -2.2733 -2.2733 -0.6817 -0.6817 -0.5851 -0.5851 -0.5380 -0.5380 -0.4608 -0.4608 -0.3899 -0.3899 -0.3533 -0.3533 -0.3106 -0.3106 -0.3069 -0.3069 -0.2851 -0.2851 -0.2724 -0.2724 -0.2605 -0.2605 -0.1515 -0.1515 1.4329 1.4329 2.9901 2.9901 5.2444 5.2444 7.9039 7.9039 8.6287 8.6287 9.0273 9.0273 9.3497 9.3497 9.8023 9.8023 10.5582 10.5582 10.8403 10.8403 11.0615 11.0615 11.4190 11.4190 11.4467 11.4467 11.8492 11.8492 12.5498 12.5498 k = 0.0000 0.0000 0.0000 ( 6803 PWs) bands (ev): -18.1788 -18.1788 -18.1478 -18.1478 -4.9498 -4.9498 -4.8341 -4.8341 -3.2596 -3.2596 -3.1169 -3.1169 -3.0467 -3.0467 -2.8437 -2.8437 -2.6564 -2.6564 -2.6156 -2.6156 -2.5759 -2.5759 -2.5676 -2.5676 -2.4650 -2.4650 -2.4134 -2.4134 -2.3836 -2.3836 -2.2729 -2.2729 -0.6820 -0.6820 -0.5848 -0.5848 -0.5382 -0.5382 -0.4609 -0.4609 -0.3896 -0.3896 -0.3534 -0.3534 -0.3096 -0.3096 -0.3068 -0.3068 -0.2851 -0.2851 -0.2692 -0.2692 -0.2650 -0.2650 -0.1514 -0.1514 1.4308 1.4308 2.9894 2.9894 5.2450 5.2450 7.9116 7.9116 8.6440 8.6440 9.0336 9.0336 9.3228 9.3228 9.8057 9.8057 10.5689 10.5689 10.8620 10.8620 11.0438 11.0438 11.4125 11.4125 11.4257 11.4257 11.8542 11.8542 12.5532 12.5532 k = 0.0000 0.0000 0.0000 ( 6803 PWs) bands (ev): -18.1788 -18.1788 -18.1478 -18.1478 -4.9498 -4.9498 -4.8341 -4.8341 -3.2596 -3.2596 -3.1169 -3.1169 -3.0467 -3.0467 -2.8437 -2.8437 -2.6564 -2.6564 -2.6156 -2.6156 -2.5759 -2.5759 -2.5676 -2.5676 -2.4650 -2.4650 -2.4134 -2.4134 -2.3836 -2.3836 -2.2729 -2.2729 -0.6820 -0.6820 -0.5848 -0.5848 -0.5382 -0.5382 -0.4609 -0.4609 -0.3896 -0.3896 -0.3534 -0.3534 -0.3096 -0.3096 -0.3068 -0.3068 -0.2851 -0.2851 -0.2692 -0.2692 -0.2650 -0.2650 -0.1514 -0.1514 1.4308 1.4308 2.9894 2.9894 5.2450 5.2450 7.9116 7.9116 8.6440 8.6440 9.0336 9.0336 9.3228 9.3228 9.8057 9.8057 10.5689 10.5689 10.8620 10.8620 11.0438 11.0438 11.4125 11.4125 11.4257 11.4257 11.8542 11.8542 12.5532 12.5532 k = 0.0000 0.0000 0.0163 ( 6796 PWs) bands (ev): -18.1788 -18.1788 -18.1479 -18.1479 -4.9496 -4.9496 -4.8342 -4.8342 -3.2590 -3.2590 -3.1167 -3.1167 -3.0468 -3.0468 -2.8447 -2.8447 -2.6564 -2.6564 -2.6154 -2.6154 -2.5759 -2.5759 -2.5679 -2.5679 -2.4649 -2.4649 -2.4129 -2.4129 -2.3837 -2.3837 -2.2731 -2.2731 -0.6818 -0.6818 -0.5851 -0.5851 -0.5378 -0.5378 -0.4607 -0.4607 -0.3899 -0.3899 -0.3537 -0.3537 -0.3095 -0.3095 -0.3066 -0.3066 -0.2851 -0.2851 -0.2697 -0.2697 -0.2643 -0.2643 -0.1516 -0.1516 1.4328 1.4328 2.9845 2.9845 5.2513 5.2513 7.9063 7.9063 8.6456 8.6456 9.0357 9.0357 9.3246 9.3246 9.8058 9.8058 10.5642 10.5642 10.8638 10.8638 11.0458 11.0458 11.3901 11.3901 11.4300 11.4300 11.8756 11.8756 12.5584 12.5584 k = 0.0000 0.0000 0.0326 ( 6820 PWs) bands (ev): -18.1786 -18.1786 -18.1480 -18.1480 -4.9489 -4.9489 -4.8347 -4.8347 -3.2574 -3.2574 -3.1164 -3.1164 -3.0471 -3.0471 -2.8477 -2.8477 -2.6562 -2.6562 -2.6147 -2.6147 -2.5759 -2.5759 -2.5689 -2.5689 -2.4645 -2.4645 -2.4117 -2.4117 -2.3842 -2.3842 -2.2736 -2.2736 -0.6815 -0.6815 -0.5859 -0.5859 -0.5369 -0.5369 -0.4603 -0.4603 -0.3908 -0.3908 -0.3546 -0.3546 -0.3091 -0.3091 -0.3061 -0.3061 -0.2851 -0.2851 -0.2706 -0.2706 -0.2629 -0.2629 -0.1522 -0.1522 1.4385 1.4385 2.9702 2.9702 5.2700 5.2700 7.8906 7.8906 8.6504 8.6504 9.0421 9.0421 9.3299 9.3299 9.8061 9.8061 10.5509 10.5509 10.8691 10.8691 11.0517 11.0517 11.3328 11.3328 11.4423 11.4423 11.9297 11.9297 12.5725 12.5725 k = 0.0000 0.0000 0.0488 ( 6808 PWs) bands (ev): -18.1783 -18.1783 -18.1483 -18.1483 -4.9477 -4.9477 -4.8355 -4.8355 -3.2547 -3.2547 -3.1157 -3.1157 -3.0477 -3.0477 -2.8526 -2.8526 -2.6558 -2.6558 -2.6137 -2.6137 -2.5760 -2.5760 -2.5706 -2.5706 -2.4640 -2.4640 -2.4097 -2.4097 -2.3850 -2.3850 -2.2745 -2.2745 -0.6808 -0.6808 -0.5873 -0.5873 -0.5353 -0.5353 -0.4595 -0.4595 -0.3924 -0.3924 -0.3561 -0.3561 -0.3085 -0.3085 -0.3053 -0.3053 -0.2851 -0.2851 -0.2717 -0.2717 -0.2610 -0.2610 -0.1531 -0.1531 1.4480 1.4480 2.9468 2.9468 5.3005 5.3005 7.8648 7.8648 8.6584 8.6584 9.0527 9.0527 9.3388 9.3388 9.8055 9.8055 10.5305 10.5305 10.8780 10.8780 11.0616 11.0616 11.2567 11.2567 11.4610 11.4610 11.9994 11.9994 12.5756 12.5756 k = 0.0000 0.0000 0.0651 ( 6832 PWs) bands (ev): -18.1780 -18.1780 -18.1487 -18.1487 -4.9461 -4.9461 -4.8366 -4.8366 -3.2509 -3.2509 -3.1149 -3.1149 -3.0485 -3.0485 -2.8593 -2.8593 -2.6552 -2.6552 -2.6122 -2.6122 -2.5761 -2.5761 -2.5728 -2.5728 -2.4632 -2.4632 -2.4069 -2.4069 -2.3860 -2.3860 -2.2756 -2.2756 -0.6799 -0.6799 -0.5892 -0.5892 -0.5331 -0.5331 -0.4586 -0.4586 -0.3944 -0.3944 -0.3581 -0.3581 -0.3076 -0.3076 -0.3043 -0.3043 -0.2852 -0.2852 -0.2727 -0.2727 -0.2588 -0.2588 -0.1543 -0.1543 1.4613 1.4613 2.9152 2.9152 5.3422 5.3422 7.8295 7.8295 8.6696 8.6696 9.0676 9.0676 9.3512 9.3512 9.8025 9.8025 10.5051 10.5051 10.8904 10.8904 11.0747 11.0747 11.1723 11.1723 11.4840 11.4840 12.0733 12.0733 12.5340 12.5340 k = 0.0000 0.0000 0.0814 ( 6832 PWs) bands (ev): -18.1775 -18.1775 -18.1491 -18.1491 -4.9440 -4.9440 -4.8380 -4.8380 -3.2461 -3.2461 -3.1138 -3.1138 -3.0495 -3.0495 -2.8677 -2.8677 -2.6545 -2.6545 -2.6105 -2.6105 -2.5763 -2.5763 -2.5755 -2.5755 -2.4622 -2.4622 -2.4036 -2.4036 -2.3874 -2.3874 -2.2772 -2.2772 -0.6787 -0.6787 -0.5914 -0.5914 -0.5305 -0.5305 -0.4572 -0.4572 -0.3970 -0.3970 -0.3606 -0.3606 -0.3066 -0.3066 -0.3032 -0.3032 -0.2852 -0.2852 -0.2737 -0.2737 -0.2564 -0.2564 -0.1559 -0.1559 1.4784 1.4784 2.8764 2.8764 5.3938 5.3938 7.7855 7.7855 8.6839 8.6839 9.0867 9.0867 9.3672 9.3672 9.7956 9.7956 10.4770 10.4770 10.9063 10.9063 11.0730 11.0730 11.1027 11.1027 11.5090 11.5090 12.1441 12.1441 12.4810 12.4810 k = 0.0000 0.0000 0.0977 ( 6844 PWs) bands (ev): -18.1770 -18.1770 -18.1497 -18.1497 -4.9415 -4.9415 -4.8398 -4.8398 -3.2402 -3.2402 -3.1125 -3.1125 -3.0507 -3.0507 -2.8777 -2.8777 -2.6537 -2.6537 -2.6086 -2.6086 -2.5786 -2.5786 -2.5765 -2.5765 -2.4610 -2.4610 -2.3996 -2.3996 -2.3891 -2.3891 -2.2790 -2.2790 -0.6773 -0.6773 -0.5940 -0.5940 -0.5275 -0.5275 -0.4557 -0.4557 -0.4001 -0.4001 -0.3634 -0.3634 -0.3055 -0.3055 -0.3019 -0.3019 -0.2852 -0.2852 -0.2747 -0.2747 -0.2537 -0.2537 -0.1578 -0.1578 1.4990 1.4990 2.8314 2.8314 5.4544 5.4544 7.7336 7.7336 8.7013 8.7013 9.1101 9.1101 9.3866 9.3866 9.7830 9.7830 10.4476 10.4476 10.9256 10.9256 10.9888 10.9888 11.1181 11.1181 11.5340 11.5340 12.2059 12.2059 12.4260 12.4260 k = 0.0000 0.0000 0.1140 ( 6868 PWs) bands (ev): -18.1763 -18.1763 -18.1504 -18.1504 -4.9387 -4.9387 -4.8418 -4.8418 -3.2333 -3.2333 -3.1110 -3.1110 -3.0521 -3.0521 -2.8891 -2.8891 -2.6527 -2.6527 -2.6065 -2.6065 -2.5820 -2.5820 -2.5768 -2.5768 -2.4595 -2.4595 -2.3952 -2.3952 -2.3910 -2.3910 -2.2812 -2.2812 -0.6756 -0.6756 -0.5968 -0.5968 -0.5241 -0.5241 -0.4538 -0.4538 -0.4036 -0.4036 -0.3666 -0.3666 -0.3042 -0.3042 -0.3006 -0.3006 -0.2853 -0.2853 -0.2757 -0.2757 -0.2508 -0.2508 -0.1600 -0.1600 1.5232 1.5232 2.7811 2.7811 5.5228 5.5228 7.6745 7.6745 8.7219 8.7219 9.1377 9.1377 9.4096 9.4096 9.7635 9.7635 10.4177 10.4177 10.8983 10.8983 10.9483 10.9483 11.1434 11.1434 11.5576 11.5576 12.2534 12.2534 12.3726 12.3726 k = 0.0000 0.0000 0.1303 ( 6880 PWs) bands (ev): -18.1756 -18.1756 -18.1511 -18.1511 -4.9355 -4.9355 -4.8442 -4.8442 -3.2253 -3.2253 -3.1092 -3.1092 -3.0537 -3.0537 -2.9018 -2.9018 -2.6516 -2.6516 -2.6044 -2.6044 -2.5857 -2.5857 -2.5771 -2.5771 -2.4579 -2.4579 -2.3932 -2.3932 -2.3904 -2.3904 -2.2837 -2.2837 -0.6737 -0.6737 -0.5999 -0.5999 -0.5203 -0.5203 -0.4517 -0.4517 -0.4075 -0.4075 -0.3700 -0.3700 -0.3029 -0.3029 -0.2992 -0.2992 -0.2853 -0.2853 -0.2766 -0.2766 -0.2476 -0.2476 -0.1625 -0.1625 1.5509 1.5509 2.7267 2.7267 5.5980 5.5980 7.6091 7.6091 8.7455 8.7455 9.1696 9.1696 9.4360 9.4360 9.7367 9.7367 10.3869 10.3869 10.8080 10.8080 10.9744 10.9744 11.1731 11.1731 11.5791 11.5791 12.2821 12.2821 12.3230 12.3230 k = 0.0000 0.0000 0.1465 ( 6874 PWs) bands (ev): -18.1747 -18.1747 -18.1519 -18.1519 -4.9319 -4.9319 -4.8468 -4.8468 -3.2164 -3.2164 -3.1073 -3.1073 -3.0555 -3.0555 -2.9155 -2.9155 -2.6502 -2.6502 -2.6022 -2.6022 -2.5895 -2.5895 -2.5774 -2.5774 -2.4560 -2.4560 -2.3956 -2.3956 -2.3853 -2.3853 -2.2865 -2.2865 -0.6715 -0.6715 -0.6031 -0.6031 -0.5163 -0.5163 -0.4494 -0.4494 -0.4117 -0.4117 -0.3736 -0.3736 -0.3015 -0.3015 -0.2979 -0.2979 -0.2854 -0.2854 -0.2775 -0.2775 -0.2443 -0.2443 -0.1653 -0.1653 1.5819 1.5819 2.6690 2.6690 5.6789 5.6789 7.5380 7.5380 8.7721 8.7721 9.2056 9.2056 9.4659 9.4659 9.7027 9.7027 10.3540 10.3540 10.7189 10.7189 11.0038 11.0038 11.2066 11.2066 11.5984 11.5984 12.2783 12.2783 12.2892 12.2892 k = 0.0000 0.0000 0.1628 ( 6886 PWs) bands (ev): -18.1738 -18.1738 -18.1529 -18.1529 -4.9281 -4.9281 -4.8497 -4.8497 -3.2065 -3.2065 -3.1052 -3.1052 -3.0575 -3.0575 -2.9302 -2.9302 -2.6487 -2.6487 -2.6001 -2.6001 -2.5934 -2.5934 -2.5778 -2.5778 -2.4539 -2.4539 -2.3982 -2.3982 -2.3799 -2.3799 -2.2896 -2.2896 -0.6692 -0.6692 -0.6065 -0.6065 -0.5119 -0.5119 -0.4468 -0.4468 -0.4163 -0.4163 -0.3775 -0.3775 -0.3000 -0.3000 -0.2966 -0.2966 -0.2855 -0.2855 -0.2784 -0.2784 -0.2407 -0.2407 -0.1683 -0.1683 1.6162 1.6162 2.6088 2.6088 5.7646 5.7646 7.4621 7.4621 8.8017 8.8017 9.2458 9.2458 9.4992 9.4992 9.6622 9.6622 10.3173 10.3173 10.6313 10.6313 11.0363 11.0363 11.2441 11.2441 11.6158 11.6158 12.2399 12.2399 12.2750 12.2750 k = 0.0000 0.0000 0.1791 ( 6904 PWs) bands (ev): -18.1729 -18.1729 -18.1538 -18.1538 -4.9239 -4.9239 -4.8529 -4.8529 -3.1956 -3.1956 -3.1029 -3.1029 -3.0597 -3.0597 -2.9456 -2.9456 -2.6470 -2.6470 -2.5980 -2.5980 -2.5975 -2.5975 -2.5783 -2.5783 -2.4516 -2.4516 -2.4011 -2.4011 -2.3744 -2.3744 -2.2930 -2.2930 -0.6666 -0.6666 -0.6101 -0.6101 -0.5074 -0.5074 -0.4439 -0.4439 -0.4211 -0.4211 -0.3814 -0.3814 -0.2986 -0.2986 -0.2954 -0.2954 -0.2856 -0.2856 -0.2793 -0.2793 -0.2370 -0.2370 -0.1715 -0.1715 1.6536 1.6536 2.5469 2.5469 5.8543 5.8543 7.3819 7.3819 8.8342 8.8342 9.2901 9.2901 9.5359 9.5359 9.6165 9.6165 10.2755 10.2755 10.5456 10.5456 11.0720 11.0720 11.2852 11.2852 11.6305 11.6305 12.2097 12.2097 12.2424 12.2424 k = 0.0000 0.0000 0.1954 ( 6886 PWs) bands (ev): -18.1718 -18.1718 -18.1549 -18.1549 -4.9196 -4.9196 -4.8564 -4.8564 -3.1839 -3.1839 -3.1005 -3.1005 -3.0620 -3.0620 -2.9617 -2.9617 -2.6452 -2.6452 -2.6015 -2.6015 -2.5959 -2.5959 -2.5788 -2.5788 -2.4491 -2.4491 -2.4040 -2.4040 -2.3687 -2.3687 -2.2967 -2.2967 -0.6638 -0.6638 -0.6137 -0.6137 -0.5026 -0.5026 -0.4409 -0.4409 -0.4261 -0.4261 -0.3855 -0.3855 -0.2971 -0.2971 -0.2942 -0.2942 -0.2858 -0.2858 -0.2803 -0.2803 -0.2331 -0.2331 -0.1750 -0.1750 1.6941 1.6941 2.4839 2.4839 5.9473 5.9473 7.2978 7.2978 8.8695 8.8695 9.3384 9.3384 9.5667 9.5667 9.5759 9.5759 10.2277 10.2277 10.4619 10.4619 11.1105 11.1105 11.3300 11.3300 11.6406 11.6406 12.1913 12.1913 12.1957 12.1957 k = 0.0000 0.0000 0.2117 ( 6892 PWs) bands (ev): -18.1707 -18.1707 -18.1560 -18.1560 -4.9151 -4.9151 -4.8601 -4.8601 -3.1712 -3.1712 -3.0979 -3.0979 -3.0644 -3.0644 -2.9783 -2.9783 -2.6431 -2.6431 -2.6055 -2.6055 -2.5940 -2.5940 -2.5794 -2.5794 -2.4464 -2.4464 -2.4071 -2.4071 -2.3630 -2.3630 -2.3006 -2.3006 -0.6609 -0.6609 -0.6175 -0.6175 -0.4976 -0.4976 -0.4376 -0.4376 -0.4313 -0.4313 -0.3896 -0.3896 -0.2957 -0.2957 -0.2931 -0.2931 -0.2860 -0.2860 -0.2812 -0.2812 -0.2290 -0.2290 -0.1786 -0.1786 1.7374 1.7374 2.4203 2.4203 6.0427 6.0427 7.2105 7.2105 8.9075 8.9075 9.3906 9.3906 9.5141 9.5141 9.6193 9.6193 10.1738 10.1738 10.3806 10.3806 11.1519 11.1519 11.3783 11.3783 11.6425 11.6425 12.1389 12.1389 12.1898 12.1898 k = 0.0000 0.0000 0.2279 ( 6904 PWs) bands (ev): -18.1696 -18.1696 -18.1571 -18.1571 -4.9104 -4.9104 -4.8640 -4.8640 -3.1578 -3.1578 -3.0953 -3.0953 -3.0670 -3.0670 -2.9953 -2.9953 -2.6409 -2.6409 -2.6094 -2.6094 -2.5922 -2.5922 -2.5801 -2.5801 -2.4435 -2.4435 -2.4104 -2.4104 -2.3572 -2.3572 -2.3048 -2.3048 -0.6578 -0.6578 -0.6213 -0.6213 -0.4924 -0.4924 -0.4366 -0.4366 -0.4342 -0.4342 -0.3938 -0.3938 -0.2943 -0.2943 -0.2921 -0.2921 -0.2862 -0.2862 -0.2822 -0.2822 -0.2249 -0.2249 -0.1825 -0.1825 1.7834 1.7834 2.3566 2.3566 6.1401 6.1401 7.1202 7.1202 8.9482 8.9482 9.4466 9.4466 9.4597 9.4597 9.6659 9.6659 10.1142 10.1142 10.3016 10.3016 11.1958 11.1958 11.4300 11.4300 11.6330 11.6330 12.0757 12.0757 12.2094 12.2094 k = 0.0000 0.0000 0.2442 ( 6898 PWs) bands (ev): -18.1684 -18.1684 -18.1583 -18.1583 -4.9057 -4.9057 -4.8681 -4.8681 -3.1437 -3.1437 -3.0925 -3.0925 -3.0696 -3.0696 -3.0124 -3.0124 -2.6385 -2.6385 -2.6132 -2.6132 -2.5905 -2.5905 -2.5809 -2.5809 -2.4405 -2.4405 -2.4137 -2.4137 -2.3515 -2.3515 -2.3093 -2.3093 -0.6546 -0.6546 -0.6251 -0.6251 -0.4871 -0.4871 -0.4421 -0.4421 -0.4306 -0.4306 -0.3981 -0.3981 -0.2929 -0.2929 -0.2912 -0.2912 -0.2865 -0.2865 -0.2833 -0.2833 -0.2207 -0.2207 -0.1864 -0.1864 1.8320 1.8320 2.2932 2.2932 6.2390 6.2390 7.0275 7.0275 8.9913 8.9913 9.4044 9.4044 9.5060 9.5060 9.7158 9.7158 10.0500 10.0500 10.2252 10.2252 11.2419 11.2419 11.4850 11.4850 11.6108 11.6108 12.0086 12.0086 12.2521 12.2521 k = 0.0000 0.0000 0.2605 ( 6886 PWs) bands (ev): -18.1672 -18.1672 -18.1596 -18.1596 -4.9008 -4.9008 -4.8725 -4.8725 -3.1288 -3.1288 -3.0897 -3.0897 -3.0724 -3.0724 -3.0297 -3.0297 -2.6360 -2.6360 -2.6169 -2.6169 -2.5889 -2.5889 -2.5817 -2.5817 -2.4374 -2.4374 -2.4171 -2.4171 -2.3457 -2.3457 -2.3139 -2.3139 -0.6511 -0.6511 -0.6289 -0.6289 -0.4816 -0.4816 -0.4477 -0.4477 -0.4268 -0.4268 -0.4023 -0.4023 -0.2916 -0.2916 -0.2903 -0.2903 -0.2868 -0.2868 -0.2843 -0.2843 -0.2164 -0.2164 -0.1905 -0.1905 1.8831 1.8831 2.2305 2.2305 6.3387 6.3387 6.9327 6.9327 9.0369 9.0369 9.3488 9.3488 9.5686 9.5686 9.7689 9.7689 9.9824 9.9824 10.1514 10.1514 11.2901 11.2901 11.5431 11.5431 11.5775 11.5775 11.9396 11.9396 12.3166 12.3166 k = 0.0000 0.0000 0.2768 ( 6874 PWs) bands (ev): -18.1659 -18.1659 -18.1608 -18.1608 -4.8960 -4.8960 -4.8769 -4.8769 -3.1133 -3.1133 -3.0868 -3.0868 -3.0752 -3.0752 -3.0469 -3.0469 -2.6332 -2.6332 -2.6205 -2.6205 -2.5874 -2.5874 -2.5826 -2.5826 -2.4342 -2.4342 -2.4206 -2.4206 -2.3401 -2.3401 -2.3188 -2.3188 -0.6476 -0.6476 -0.6327 -0.6327 -0.4761 -0.4761 -0.4534 -0.4534 -0.4230 -0.4230 -0.4065 -0.4065 -0.2902 -0.2902 -0.2896 -0.2896 -0.2872 -0.2872 -0.2854 -0.2854 -0.2120 -0.2120 -0.1947 -0.1947 1.9364 1.9364 2.1687 2.1687 6.4389 6.4389 6.8361 6.8361 9.0847 9.0847 9.2936 9.2936 9.6341 9.6341 9.8252 9.8252 9.9127 9.9127 10.0804 10.0804 11.3396 11.3396 11.5363 11.5363 11.6040 11.6040 11.8701 11.8701 12.3999 12.3999 k = 0.0000 0.0000 0.2931 ( 6886 PWs) bands (ev): -18.1647 -18.1647 -18.1621 -18.1621 -4.8911 -4.8911 -4.8816 -4.8816 -3.0973 -3.0973 -3.0839 -3.0839 -3.0781 -3.0781 -3.0640 -3.0640 -2.6303 -2.6303 -2.6239 -2.6239 -2.5861 -2.5861 -2.5837 -2.5837 -2.4308 -2.4308 -2.4240 -2.4240 -2.3346 -2.3346 -2.3239 -2.3239 -0.6440 -0.6440 -0.6366 -0.6366 -0.4704 -0.4704 -0.4591 -0.4591 -0.4190 -0.4190 -0.4107 -0.4107 -0.2890 -0.2890 -0.2889 -0.2889 -0.2877 -0.2877 -0.2866 -0.2866 -0.2077 -0.2077 -0.1990 -0.1990 1.9918 1.9918 2.1082 2.1082 6.5391 6.5391 6.7380 6.7380 9.1345 9.1345 9.2392 9.2392 9.7019 9.7019 9.8420 9.8420 9.8845 9.8845 10.0122 10.0122 11.3901 11.3901 11.4898 11.4898 11.6676 11.6676 11.8011 11.8011 12.4990 12.4990 k = 0.0000 0.0000 0.3094 ( 6886 PWs) bands (ev): -18.1634 -18.1634 -18.1634 -18.1634 -4.8863 -4.8863 -4.8863 -4.8863 -3.0810 -3.0810 -3.0810 -3.0810 -3.0808 -3.0808 -3.0808 -3.0808 -2.6272 -2.6272 -2.6272 -2.6272 -2.5848 -2.5848 -2.5848 -2.5848 -2.4274 -2.4274 -2.4274 -2.4274 -2.3292 -2.3292 -2.3291 -2.3291 -0.6404 -0.6404 -0.6403 -0.6403 -0.4648 -0.4648 -0.4647 -0.4647 -0.4149 -0.4149 -0.4149 -0.4149 -0.2883 -0.2883 -0.2883 -0.2883 -0.2878 -0.2878 -0.2877 -0.2877 -0.2033 -0.2033 -0.2033 -0.2033 2.0491 2.0491 2.0492 2.0492 6.6389 6.6389 6.6389 6.6389 9.1860 9.1860 9.1861 9.1861 9.7714 9.7714 9.7714 9.7714 9.9468 9.9468 9.9469 9.9469 11.4405 11.4405 11.4406 11.4406 11.7334 11.7334 11.7335 11.7335 12.6114 12.6114 k = 0.0000 0.0000 0.3094 ( 6886 PWs) bands (ev): -18.1634 -18.1634 -18.1634 -18.1634 -4.8863 -4.8863 -4.8863 -4.8863 -3.0810 -3.0810 -3.0810 -3.0810 -3.0808 -3.0808 -3.0808 -3.0808 -2.6272 -2.6272 -2.6272 -2.6272 -2.5848 -2.5848 -2.5848 -2.5848 -2.4274 -2.4274 -2.4274 -2.4274 -2.3292 -2.3292 -2.3291 -2.3291 -0.6404 -0.6404 -0.6403 -0.6403 -0.4648 -0.4648 -0.4647 -0.4647 -0.4149 -0.4149 -0.4149 -0.4149 -0.2883 -0.2883 -0.2883 -0.2883 -0.2878 -0.2878 -0.2877 -0.2877 -0.2033 -0.2033 -0.2033 -0.2033 2.0491 2.0491 2.0492 2.0492 6.6389 6.6389 6.6389 6.6389 9.1860 9.1860 9.1861 9.1861 9.7714 9.7714 9.7714 9.7714 9.9468 9.9468 9.9469 9.9469 11.4405 11.4405 11.4406 11.4406 11.7334 11.7334 11.7335 11.7335 12.6114 12.6114 k = 0.0143 0.0082 0.3094 ( 6878 PWs) bands (ev): -18.1634 -18.1634 -18.1634 -18.1634 -4.8863 -4.8863 -4.8863 -4.8863 -3.0819 -3.0819 -3.0819 -3.0819 -3.0798 -3.0798 -3.0798 -3.0798 -2.6273 -2.6273 -2.6272 -2.6272 -2.5848 -2.5848 -2.5848 -2.5848 -2.4277 -2.4277 -2.4276 -2.4276 -2.3292 -2.3292 -2.3292 -2.3292 -0.6403 -0.6403 -0.6402 -0.6402 -0.4649 -0.4649 -0.4648 -0.4648 -0.4151 -0.4151 -0.4151 -0.4151 -0.2902 -0.2902 -0.2902 -0.2902 -0.2859 -0.2859 -0.2858 -0.2858 -0.2031 -0.2031 -0.2030 -0.2030 2.0508 2.0508 2.0508 2.0508 6.6347 6.6347 6.6348 6.6348 9.1808 9.1808 9.1808 9.1808 9.7554 9.7554 9.7554 9.7554 9.9708 9.9708 9.9708 9.9708 11.4410 11.4410 11.4410 11.4410 11.7320 11.7320 11.7321 11.7321 12.6173 12.6173 k = 0.0286 0.0165 0.3094 ( 6876 PWs) bands (ev): -18.1633 -18.1633 -18.1633 -18.1633 -4.8865 -4.8865 -4.8865 -4.8865 -3.0829 -3.0829 -3.0829 -3.0829 -3.0787 -3.0787 -3.0787 -3.0787 -2.6275 -2.6275 -2.6274 -2.6274 -2.5847 -2.5847 -2.5847 -2.5847 -2.4283 -2.4283 -2.4283 -2.4283 -2.3294 -2.3294 -2.3294 -2.3294 -0.6401 -0.6401 -0.6400 -0.6400 -0.4651 -0.4651 -0.4651 -0.4651 -0.4158 -0.4158 -0.4158 -0.4158 -0.2924 -0.2924 -0.2924 -0.2924 -0.2838 -0.2838 -0.2838 -0.2838 -0.2023 -0.2023 -0.2022 -0.2022 2.0558 2.0558 2.0558 2.0558 6.6223 6.6223 6.6223 6.6223 9.1657 9.1657 9.1657 9.1657 9.7223 9.7223 9.7224 9.7224 10.0271 10.0271 10.0271 10.0271 11.4422 11.4422 11.4422 11.4422 11.7282 11.7282 11.7283 11.7283 12.6345 12.6345 k = 0.0429 0.0247 0.3094 ( 6884 PWs) bands (ev): -18.1633 -18.1633 -18.1633 -18.1633 -4.8867 -4.8867 -4.8867 -4.8867 -3.0837 -3.0837 -3.0837 -3.0837 -3.0775 -3.0775 -3.0775 -3.0775 -2.6278 -2.6278 -2.6278 -2.6278 -2.5846 -2.5846 -2.5846 -2.5846 -2.4293 -2.4293 -2.4293 -2.4293 -2.3297 -2.3297 -2.3296 -2.3296 -0.6398 -0.6398 -0.6397 -0.6397 -0.4655 -0.4655 -0.4655 -0.4655 -0.4169 -0.4169 -0.4168 -0.4168 -0.2947 -0.2947 -0.2947 -0.2947 -0.2818 -0.2818 -0.2818 -0.2818 -0.2010 -0.2010 -0.2009 -0.2009 2.0640 2.0640 2.0641 2.0641 6.6016 6.6016 6.6017 6.6017 9.1425 9.1425 9.1425 9.1425 9.6871 9.6871 9.6872 9.6872 10.0984 10.0984 10.0984 10.0984 11.4441 11.4441 11.4442 11.4442 11.7230 11.7230 11.7231 11.7231 12.6618 12.6618 k = 0.0571 0.0330 0.3094 ( 6888 PWs) bands (ev): -18.1632 -18.1632 -18.1632 -18.1632 -4.8870 -4.8870 -4.8870 -4.8870 -3.0846 -3.0846 -3.0846 -3.0846 -3.0762 -3.0762 -3.0762 -3.0762 -2.6282 -2.6282 -2.6282 -2.6282 -2.5846 -2.5846 -2.5845 -2.5845 -2.4307 -2.4307 -2.4307 -2.4307 -2.3301 -2.3301 -2.3300 -2.3300 -0.6393 -0.6393 -0.6393 -0.6393 -0.4661 -0.4661 -0.4661 -0.4661 -0.4183 -0.4183 -0.4183 -0.4183 -0.2968 -0.2968 -0.2968 -0.2968 -0.2800 -0.2800 -0.2800 -0.2800 -0.1992 -0.1992 -0.1992 -0.1992 2.0755 2.0755 2.0756 2.0756 6.5730 6.5730 6.5730 6.5730 9.1137 9.1137 9.1137 9.1137 9.6542 9.6542 9.6542 9.6542 10.1775 10.1775 10.1775 10.1775 11.4466 11.4466 11.4467 11.4467 11.7179 11.7179 11.7179 11.7179 12.6975 12.6975 k = 0.0714 0.0412 0.3094 ( 6888 PWs) bands (ev): -18.1632 -18.1632 -18.1632 -18.1632 -4.8875 -4.8875 -4.8875 -4.8875 -3.0853 -3.0853 -3.0853 -3.0853 -3.0748 -3.0748 -3.0748 -3.0748 -2.6288 -2.6288 -2.6287 -2.6287 -2.5845 -2.5845 -2.5845 -2.5845 -2.4325 -2.4325 -2.4325 -2.4325 -2.3306 -2.3306 -2.3305 -2.3305 -0.6387 -0.6387 -0.6387 -0.6387 -0.4669 -0.4669 -0.4669 -0.4669 -0.4201 -0.4201 -0.4200 -0.4200 -0.2989 -0.2989 -0.2989 -0.2989 -0.2782 -0.2782 -0.2782 -0.2782 -0.1971 -0.1971 -0.1971 -0.1971 2.0903 2.0903 2.0903 2.0903 6.5366 6.5366 6.5367 6.5367 9.0819 9.0819 9.0819 9.0819 9.6238 9.6238 9.6238 9.6238 10.2603 10.2603 10.2604 10.2604 11.4497 11.4497 11.4497 11.4497 11.7145 11.7145 11.7146 11.7146 12.7388 12.7388 k = 0.0857 0.0495 0.3094 ( 6896 PWs) bands (ev): -18.1631 -18.1631 -18.1631 -18.1631 -4.8880 -4.8880 -4.8880 -4.8880 -3.0860 -3.0860 -3.0860 -3.0860 -3.0734 -3.0734 -3.0733 -3.0733 -2.6293 -2.6293 -2.6293 -2.6293 -2.5844 -2.5844 -2.5844 -2.5844 -2.4346 -2.4346 -2.4346 -2.4346 -2.3312 -2.3312 -2.3312 -2.3312 -0.6380 -0.6380 -0.6380 -0.6380 -0.4680 -0.4680 -0.4679 -0.4679 -0.4221 -0.4221 -0.4220 -0.4220 -0.3009 -0.3009 -0.3008 -0.3008 -0.2766 -0.2766 -0.2765 -0.2765 -0.1947 -0.1947 -0.1946 -0.1946 2.1082 2.1082 2.1082 2.1082 6.4928 6.4928 6.4929 6.4929 9.0494 9.0494 9.0494 9.0494 9.5954 9.5954 9.5954 9.5954 10.3440 10.3440 10.3440 10.3440 11.4534 11.4534 11.4535 11.4535 11.7145 11.7145 11.7146 11.7146 12.7822 12.7823 k = 0.1000 0.0577 0.3094 ( 6898 PWs) bands (ev): -18.1630 -18.1630 -18.1630 -18.1630 -4.8885 -4.8885 -4.8885 -4.8885 -3.0867 -3.0867 -3.0867 -3.0867 -3.0719 -3.0719 -3.0719 -3.0719 -2.6300 -2.6300 -2.6299 -2.6299 -2.5845 -2.5845 -2.5844 -2.5844 -2.4370 -2.4370 -2.4370 -2.4370 -2.3319 -2.3319 -2.3319 -2.3319 -0.6372 -0.6372 -0.6371 -0.6371 -0.4692 -0.4692 -0.4692 -0.4692 -0.4243 -0.4243 -0.4243 -0.4243 -0.3026 -0.3026 -0.3026 -0.3026 -0.2750 -0.2750 -0.2750 -0.2750 -0.1921 -0.1921 -0.1920 -0.1920 2.1292 2.1292 2.1292 2.1292 6.4420 6.4420 6.4421 6.4421 9.0180 9.0180 9.0180 9.0180 9.5682 9.5682 9.5682 9.5682 10.4256 10.4256 10.4256 10.4256 11.4586 11.4586 11.4586 11.4586 11.7192 11.7192 11.7193 11.7193 12.8233 12.8233 k = 0.1143 0.0660 0.3094 ( 6894 PWs) bands (ev): -18.1628 -18.1628 -18.1628 -18.1628 -4.8892 -4.8892 -4.8892 -4.8892 -3.0873 -3.0873 -3.0873 -3.0873 -3.0703 -3.0703 -3.0703 -3.0703 -2.6306 -2.6306 -2.6305 -2.6305 -2.5846 -2.5846 -2.5845 -2.5845 -2.4397 -2.4397 -2.4397 -2.4397 -2.3327 -2.3327 -2.3327 -2.3327 -0.6362 -0.6362 -0.6361 -0.6361 -0.4708 -0.4708 -0.4707 -0.4707 -0.4266 -0.4266 -0.4266 -0.4266 -0.3043 -0.3043 -0.3042 -0.3042 -0.2735 -0.2735 -0.2734 -0.2734 -0.1893 -0.1893 -0.1892 -0.1892 2.1532 2.1532 2.1533 2.1533 6.3847 6.3847 6.3848 6.3848 8.9890 8.9890 8.9890 8.9890 9.5416 9.5416 9.5417 9.5417 10.5024 10.5024 10.5024 10.5024 11.4663 11.4663 11.4663 11.4663 11.7294 11.7294 11.7295 11.7295 12.8566 12.8566 k = 0.1286 0.0742 0.3094 ( 6904 PWs) bands (ev): -18.1627 -18.1627 -18.1627 -18.1627 -4.8899 -4.8899 -4.8899 -4.8899 -3.0879 -3.0879 -3.0879 -3.0879 -3.0688 -3.0688 -3.0688 -3.0688 -2.6311 -2.6311 -2.6311 -2.6311 -2.5848 -2.5848 -2.5848 -2.5848 -2.4426 -2.4426 -2.4426 -2.4426 -2.3337 -2.3337 -2.3337 -2.3337 -0.6351 -0.6351 -0.6351 -0.6351 -0.4726 -0.4726 -0.4726 -0.4726 -0.4291 -0.4291 -0.4290 -0.4290 -0.3057 -0.3057 -0.3056 -0.3056 -0.2720 -0.2720 -0.2719 -0.2719 -0.1864 -0.1864 -0.1864 -0.1864 2.1802 2.1802 2.1802 2.1802 6.3214 6.3214 6.3215 6.3215 8.9633 8.9633 8.9633 8.9633 9.5153 9.5153 9.5153 9.5153 10.5714 10.5714 10.5714 10.5714 11.4783 11.4783 11.4783 11.4783 11.7455 11.7455 11.7456 11.7456 12.8775 12.8775 k = 0.1429 0.0825 0.3094 ( 6896 PWs) bands (ev): -18.1626 -18.1626 -18.1626 -18.1626 -4.8907 -4.8907 -4.8907 -4.8907 -3.0884 -3.0884 -3.0884 -3.0884 -3.0672 -3.0672 -3.0672 -3.0672 -2.6316 -2.6316 -2.6316 -2.6316 -2.5851 -2.5851 -2.5851 -2.5851 -2.4456 -2.4456 -2.4456 -2.4456 -2.3348 -2.3348 -2.3347 -2.3347 -0.6339 -0.6339 -0.6338 -0.6338 -0.4747 -0.4747 -0.4747 -0.4747 -0.4315 -0.4315 -0.4314 -0.4314 -0.3069 -0.3069 -0.3068 -0.3068 -0.2705 -0.2705 -0.2704 -0.2704 -0.1836 -0.1836 -0.1835 -0.1835 2.2100 2.2100 2.2101 2.2101 6.2528 6.2528 6.2528 6.2528 8.9414 8.9414 8.9414 8.9414 9.4889 9.4889 9.4890 9.4890 10.6298 10.6298 10.6298 10.6298 11.4962 11.4962 11.4962 11.4962 11.7676 11.7676 11.7676 11.7676 12.8852 12.8852 k = 0.1571 0.0907 0.3094 ( 6900 PWs) bands (ev): -18.1624 -18.1624 -18.1624 -18.1624 -4.8915 -4.8915 -4.8915 -4.8915 -3.0889 -3.0889 -3.0889 -3.0889 -3.0657 -3.0657 -3.0657 -3.0657 -2.6321 -2.6321 -2.6320 -2.6320 -2.5856 -2.5856 -2.5856 -2.5856 -2.4489 -2.4489 -2.4489 -2.4489 -2.3359 -2.3359 -2.3359 -2.3359 -0.6326 -0.6326 -0.6325 -0.6325 -0.4771 -0.4771 -0.4771 -0.4771 -0.4339 -0.4339 -0.4338 -0.4338 -0.3079 -0.3079 -0.3078 -0.3078 -0.2690 -0.2690 -0.2690 -0.2690 -0.1808 -0.1808 -0.1807 -0.1807 2.2426 2.2426 2.2426 2.2426 6.1793 6.1793 6.1794 6.1794 8.9234 8.9234 8.9235 8.9235 9.4626 9.4626 9.4626 9.4626 10.6756 10.6756 10.6756 10.6756 11.5210 11.5210 11.5210 11.5210 11.7953 11.7953 11.7953 11.7953 12.8833 12.8833 k = 0.1714 0.0990 0.3094 ( 6884 PWs) bands (ev): -18.1622 -18.1622 -18.1622 -18.1622 -4.8924 -4.8924 -4.8924 -4.8924 -3.0893 -3.0893 -3.0893 -3.0893 -3.0642 -3.0642 -3.0642 -3.0642 -2.6324 -2.6324 -2.6323 -2.6323 -2.5863 -2.5863 -2.5862 -2.5862 -2.4522 -2.4522 -2.4522 -2.4522 -2.3372 -2.3372 -2.3371 -2.3371 -0.6311 -0.6311 -0.6311 -0.6311 -0.4798 -0.4798 -0.4798 -0.4798 -0.4362 -0.4362 -0.4361 -0.4361 -0.3086 -0.3086 -0.3086 -0.3086 -0.2675 -0.2675 -0.2675 -0.2675 -0.1781 -0.1781 -0.1780 -0.1780 2.2778 2.2778 2.2779 2.2779 6.1017 6.1017 6.1018 6.1018 8.9095 8.9095 8.9095 8.9095 9.4363 9.4363 9.4364 9.4364 10.7078 10.7078 10.7078 10.7078 11.5524 11.5524 11.5524 11.5524 11.8284 11.8284 11.8284 11.8284 12.8778 12.8779 k = 0.1857 0.1072 0.3094 ( 6878 PWs) bands (ev): -18.1621 -18.1621 -18.1621 -18.1621 -4.8934 -4.8934 -4.8934 -4.8934 -3.0896 -3.0896 -3.0896 -3.0896 -3.0628 -3.0628 -3.0628 -3.0628 -2.6325 -2.6325 -2.6325 -2.6325 -2.5871 -2.5871 -2.5871 -2.5871 -2.4556 -2.4556 -2.4556 -2.4556 -2.3385 -2.3385 -2.3385 -2.3385 -0.6296 -0.6296 -0.6295 -0.6295 -0.4827 -0.4827 -0.4827 -0.4827 -0.4384 -0.4384 -0.4384 -0.4384 -0.3092 -0.3092 -0.3092 -0.3092 -0.2659 -0.2659 -0.2659 -0.2659 -0.1755 -0.1755 -0.1755 -0.1755 2.3156 2.3156 2.3156 2.3156 6.0205 6.0205 6.0206 6.0206 8.8993 8.8993 8.8994 8.8994 9.4103 9.4103 9.4103 9.4103 10.7270 10.7270 10.7270 10.7270 11.5886 11.5886 11.5887 11.5887 11.8663 11.8663 11.8663 11.8663 12.8750 12.8750 k = 0.2000 0.1155 0.3094 ( 6878 PWs) bands (ev): -18.1619 -18.1619 -18.1619 -18.1619 -4.8944 -4.8944 -4.8944 -4.8944 -3.0899 -3.0899 -3.0899 -3.0899 -3.0614 -3.0614 -3.0614 -3.0614 -2.6325 -2.6325 -2.6325 -2.6325 -2.5881 -2.5881 -2.5880 -2.5880 -2.4591 -2.4591 -2.4590 -2.4590 -2.3399 -2.3399 -2.3399 -2.3399 -0.6280 -0.6280 -0.6279 -0.6279 -0.4858 -0.4858 -0.4858 -0.4858 -0.4405 -0.4405 -0.4405 -0.4405 -0.3096 -0.3096 -0.3096 -0.3096 -0.2643 -0.2643 -0.2643 -0.2643 -0.1732 -0.1732 -0.1732 -0.1732 2.3557 2.3557 2.3558 2.3558 5.9364 5.9364 5.9364 5.9364 8.8927 8.8927 8.8927 8.8927 9.3847 9.3847 9.3847 9.3847 10.7347 10.7347 10.7347 10.7347 11.6268 11.6268 11.6268 11.6268 11.9083 11.9083 11.9083 11.9083 12.8798 12.8798 k = 0.2143 0.1237 0.3094 ( 6872 PWs) bands (ev): -18.1617 -18.1617 -18.1617 -18.1617 -4.8954 -4.8954 -4.8954 -4.8954 -3.0901 -3.0901 -3.0901 -3.0901 -3.0602 -3.0602 -3.0602 -3.0602 -2.6324 -2.6324 -2.6323 -2.6323 -2.5892 -2.5892 -2.5892 -2.5892 -2.4625 -2.4625 -2.4625 -2.4625 -2.3415 -2.3415 -2.3414 -2.3414 -0.6263 -0.6263 -0.6262 -0.6262 -0.4891 -0.4891 -0.4890 -0.4890 -0.4426 -0.4426 -0.4425 -0.4425 -0.3099 -0.3099 -0.3098 -0.3098 -0.2626 -0.2626 -0.2625 -0.2625 -0.1711 -0.1711 -0.1711 -0.1711 2.3982 2.3982 2.3982 2.3982 5.8499 5.8499 5.8499 5.8499 8.8892 8.8892 8.8892 8.8892 9.3598 9.3598 9.3599 9.3599 10.7334 10.7334 10.7334 10.7334 11.6635 11.6635 11.6635 11.6635 11.9534 11.9534 11.9534 11.9534 12.8958 12.8958 k = 0.2286 0.1320 0.3094 ( 6870 PWs) bands (ev): -18.1615 -18.1615 -18.1615 -18.1615 -4.8964 -4.8964 -4.8964 -4.8964 -3.0902 -3.0902 -3.0902 -3.0902 -3.0591 -3.0591 -3.0591 -3.0591 -2.6320 -2.6320 -2.6320 -2.6320 -2.5904 -2.5904 -2.5904 -2.5904 -2.4660 -2.4660 -2.4660 -2.4660 -2.3430 -2.3430 -2.3430 -2.3430 -0.6245 -0.6245 -0.6245 -0.6245 -0.4924 -0.4924 -0.4924 -0.4924 -0.4445 -0.4445 -0.4445 -0.4445 -0.3100 -0.3100 -0.3099 -0.3099 -0.2607 -0.2607 -0.2607 -0.2607 -0.1693 -0.1693 -0.1693 -0.1693 2.4427 2.4427 2.4428 2.4428 5.7615 5.7615 5.7615 5.7615 8.8882 8.8882 8.8883 8.8883 9.3362 9.3362 9.3362 9.3362 10.7253 10.7253 10.7253 10.7253 11.6958 11.6958 11.6958 11.6958 12.0007 12.0007 12.0008 12.0008 12.9255 12.9255 k = 0.2429 0.1402 0.3094 ( 6862 PWs) bands (ev): -18.1613 -18.1613 -18.1613 -18.1613 -4.8974 -4.8974 -4.8974 -4.8974 -3.0902 -3.0902 -3.0902 -3.0902 -3.0582 -3.0582 -3.0582 -3.0582 -2.6315 -2.6315 -2.6315 -2.6315 -2.5918 -2.5918 -2.5918 -2.5918 -2.4694 -2.4694 -2.4694 -2.4694 -2.3447 -2.3447 -2.3446 -2.3446 -0.6227 -0.6227 -0.6227 -0.6227 -0.4958 -0.4958 -0.4957 -0.4957 -0.4464 -0.4464 -0.4463 -0.4463 -0.3099 -0.3099 -0.3099 -0.3099 -0.2587 -0.2587 -0.2587 -0.2587 -0.1678 -0.1678 -0.1677 -0.1677 2.4893 2.4893 2.4894 2.4894 5.6718 5.6718 5.6719 5.6719 8.8893 8.8893 8.8894 8.8894 9.3140 9.3140 9.3141 9.3141 10.7126 10.7126 10.7126 10.7126 11.7211 11.7211 11.7211 11.7211 12.0497 12.0497 12.0497 12.0497 12.9700 12.9700 k = 0.2571 0.1485 0.3094 ( 6866 PWs) bands (ev): -18.1611 -18.1611 -18.1611 -18.1611 -4.8985 -4.8985 -4.8985 -4.8985 -3.0901 -3.0901 -3.0901 -3.0901 -3.0574 -3.0574 -3.0574 -3.0574 -2.6308 -2.6308 -2.6308 -2.6308 -2.5932 -2.5932 -2.5932 -2.5932 -2.4729 -2.4729 -2.4728 -2.4728 -2.3463 -2.3463 -2.3463 -2.3463 -0.6209 -0.6209 -0.6208 -0.6208 -0.4992 -0.4992 -0.4991 -0.4991 -0.4482 -0.4482 -0.4481 -0.4481 -0.3099 -0.3099 -0.3098 -0.3098 -0.2566 -0.2566 -0.2565 -0.2565 -0.1665 -0.1665 -0.1665 -0.1665 2.5377 2.5377 2.5378 2.5378 5.5813 5.5813 5.5813 5.5813 8.8918 8.8918 8.8918 8.8918 9.2939 9.2939 9.2939 9.2939 10.6972 10.6972 10.6973 10.6973 11.7379 11.7379 11.7379 11.7379 12.1003 12.1003 12.1003 12.1003 13.0287 13.0287 k = 0.2714 0.1567 0.3094 ( 6862 PWs) bands (ev): -18.1609 -18.1609 -18.1609 -18.1609 -4.8995 -4.8995 -4.8995 -4.8995 -3.0899 -3.0899 -3.0899 -3.0899 -3.0568 -3.0568 -3.0568 -3.0568 -2.6301 -2.6301 -2.6300 -2.6300 -2.5946 -2.5946 -2.5946 -2.5946 -2.4763 -2.4763 -2.4762 -2.4762 -2.3480 -2.3480 -2.3480 -2.3480 -0.6191 -0.6191 -0.6190 -0.6190 -0.5025 -0.5025 -0.5024 -0.5024 -0.4499 -0.4499 -0.4498 -0.4498 -0.3097 -0.3097 -0.3097 -0.3097 -0.2543 -0.2543 -0.2542 -0.2542 -0.1656 -0.1656 -0.1655 -0.1655 2.5878 2.5878 2.5878 2.5878 5.4904 5.4904 5.4904 5.4904 8.8949 8.8949 8.8949 8.8949 9.2763 9.2763 9.2763 9.2763 10.6807 10.6807 10.6807 10.6807 11.7454 11.7454 11.7454 11.7454 12.1527 12.1527 12.1528 12.1528 13.0997 13.0998 k = 0.2857 0.1650 0.3094 ( 6860 PWs) bands (ev): -18.1607 -18.1607 -18.1607 -18.1607 -4.9006 -4.9006 -4.9006 -4.9006 -3.0897 -3.0897 -3.0897 -3.0897 -3.0564 -3.0564 -3.0564 -3.0564 -2.6292 -2.6292 -2.6291 -2.6291 -2.5960 -2.5960 -2.5960 -2.5960 -2.4796 -2.4796 -2.4796 -2.4796 -2.3498 -2.3498 -2.3497 -2.3497 -0.6172 -0.6172 -0.6172 -0.6172 -0.5056 -0.5056 -0.5056 -0.5056 -0.4515 -0.4515 -0.4515 -0.4515 -0.3095 -0.3095 -0.3095 -0.3095 -0.2518 -0.2518 -0.2518 -0.2518 -0.1650 -0.1650 -0.1649 -0.1649 2.6393 2.6393 2.6394 2.6394 5.3995 5.3995 5.3996 5.3996 8.8978 8.8978 8.8979 8.8979 9.2616 9.2616 9.2617 9.2617 10.6643 10.6643 10.6643 10.6643 11.7436 11.7436 11.7436 11.7436 12.2075 12.2075 12.2075 12.2075 13.1796 13.1796 k = 0.3000 0.1732 0.3094 ( 6868 PWs) bands (ev): -18.1605 -18.1605 -18.1605 -18.1605 -4.9016 -4.9016 -4.9016 -4.9016 -3.0893 -3.0893 -3.0893 -3.0893 -3.0562 -3.0562 -3.0562 -3.0562 -2.6283 -2.6283 -2.6282 -2.6282 -2.5972 -2.5972 -2.5972 -2.5972 -2.4829 -2.4829 -2.4829 -2.4829 -2.3515 -2.3515 -2.3515 -2.3515 -0.6154 -0.6154 -0.6154 -0.6154 -0.5087 -0.5087 -0.5086 -0.5086 -0.4531 -0.4531 -0.4531 -0.4531 -0.3094 -0.3094 -0.3093 -0.3093 -0.2492 -0.2492 -0.2491 -0.2491 -0.1647 -0.1647 -0.1646 -0.1646 2.6922 2.6922 2.6922 2.6922 5.3092 5.3092 5.3093 5.3093 8.9000 8.9000 8.9000 8.9000 9.2504 9.2504 9.2504 9.2504 10.6491 10.6491 10.6491 10.6491 11.7330 11.7330 11.7331 11.7331 12.2647 12.2647 12.2647 12.2647 13.2637 13.2637 k = 0.3143 0.1815 0.3094 ( 6860 PWs) bands (ev): -18.1603 -18.1603 -18.1603 -18.1603 -4.9025 -4.9025 -4.9025 -4.9025 -3.0888 -3.0888 -3.0888 -3.0888 -3.0562 -3.0562 -3.0562 -3.0562 -2.6274 -2.6274 -2.6273 -2.6273 -2.5982 -2.5982 -2.5981 -2.5981 -2.4862 -2.4862 -2.4861 -2.4861 -2.3532 -2.3532 -2.3532 -2.3532 -0.6137 -0.6137 -0.6137 -0.6137 -0.5115 -0.5115 -0.5114 -0.5114 -0.4546 -0.4546 -0.4546 -0.4546 -0.3092 -0.3092 -0.3092 -0.3092 -0.2464 -0.2464 -0.2463 -0.2463 -0.1646 -0.1646 -0.1646 -0.1646 2.7461 2.7461 2.7461 2.7461 5.2198 5.2198 5.2198 5.2198 8.9008 8.9008 8.9008 8.9008 9.2429 9.2429 9.2429 9.2429 10.6361 10.6361 10.6361 10.6361 11.7147 11.7147 11.7147 11.7147 12.3244 12.3244 12.3244 12.3244 13.3450 13.3450 k = 0.3286 0.1897 0.3094 ( 6860 PWs) bands (ev): -18.1602 -18.1602 -18.1602 -18.1602 -4.9035 -4.9035 -4.9035 -4.9035 -3.0882 -3.0882 -3.0882 -3.0882 -3.0563 -3.0563 -3.0563 -3.0563 -2.6267 -2.6267 -2.6266 -2.6266 -2.5988 -2.5988 -2.5988 -2.5988 -2.4894 -2.4894 -2.4893 -2.4893 -2.3549 -2.3549 -2.3548 -2.3548 -0.6121 -0.6121 -0.6120 -0.6120 -0.5141 -0.5141 -0.5141 -0.5141 -0.4561 -0.4561 -0.4560 -0.4560 -0.3091 -0.3091 -0.3090 -0.3090 -0.2434 -0.2434 -0.2433 -0.2433 -0.1649 -0.1649 -0.1649 -0.1649 2.8007 2.8007 2.8008 2.8008 5.1317 5.1317 5.1317 5.1317 8.8998 8.8998 8.8998 8.8998 9.2391 9.2391 9.2391 9.2391 10.6259 10.6259 10.6260 10.6260 11.6895 11.6895 11.6895 11.6895 12.3862 12.3862 12.3862 12.3862 13.4139 13.4139 k = 0.3429 0.1979 0.3094 ( 6856 PWs) bands (ev): -18.1600 -18.1600 -18.1600 -18.1600 -4.9044 -4.9044 -4.9044 -4.9044 -3.0875 -3.0875 -3.0875 -3.0875 -3.0567 -3.0567 -3.0567 -3.0567 -2.6262 -2.6262 -2.6261 -2.6261 -2.5990 -2.5990 -2.5990 -2.5990 -2.4925 -2.4925 -2.4925 -2.4925 -2.3565 -2.3565 -2.3565 -2.3565 -0.6105 -0.6105 -0.6105 -0.6105 -0.5165 -0.5165 -0.5164 -0.5164 -0.4575 -0.4575 -0.4574 -0.4574 -0.3089 -0.3089 -0.3089 -0.3089 -0.2403 -0.2403 -0.2402 -0.2402 -0.1655 -0.1655 -0.1655 -0.1655 2.8558 2.8558 2.8559 2.8559 5.0454 5.0454 5.0455 5.0455 8.8969 8.8969 8.8970 8.8970 9.2387 9.2387 9.2388 9.2388 10.6193 10.6193 10.6193 10.6193 11.6584 11.6584 11.6584 11.6584 12.4497 12.4497 12.4497 12.4497 13.4588 13.4588 k = 0.3571 0.2062 0.3094 ( 6848 PWs) bands (ev): -18.1598 -18.1598 -18.1598 -18.1598 -4.9052 -4.9052 -4.9052 -4.9052 -3.0867 -3.0867 -3.0867 -3.0867 -3.0572 -3.0572 -3.0572 -3.0572 -2.6259 -2.6259 -2.6259 -2.6259 -2.5987 -2.5987 -2.5987 -2.5987 -2.4956 -2.4956 -2.4955 -2.4955 -2.3580 -2.3580 -2.3580 -2.3580 -0.6091 -0.6091 -0.6090 -0.6090 -0.5186 -0.5186 -0.5185 -0.5185 -0.4588 -0.4588 -0.4588 -0.4588 -0.3088 -0.3088 -0.3088 -0.3088 -0.2371 -0.2371 -0.2370 -0.2370 -0.1664 -0.1664 -0.1664 -0.1664 2.9111 2.9111 2.9111 2.9111 4.9614 4.9614 4.9615 4.9615 8.8924 8.8924 8.8924 8.8924 9.2414 9.2414 9.2414 9.2414 10.6166 10.6166 10.6167 10.6167 11.6222 11.6222 11.6223 11.6223 12.5145 12.5145 12.5145 12.5145 13.4739 13.4739 k = 0.3714 0.2144 0.3094 ( 6846 PWs) bands (ev): -18.1597 -18.1597 -18.1597 -18.1597 -4.9060 -4.9060 -4.9060 -4.9060 -3.0858 -3.0858 -3.0858 -3.0858 -3.0579 -3.0579 -3.0579 -3.0579 -2.6260 -2.6260 -2.6260 -2.6260 -2.5979 -2.5979 -2.5979 -2.5979 -2.4986 -2.4986 -2.4985 -2.4985 -2.3595 -2.3595 -2.3595 -2.3595 -0.6078 -0.6078 -0.6077 -0.6077 -0.5204 -0.5204 -0.5204 -0.5204 -0.4601 -0.4601 -0.4600 -0.4600 -0.3088 -0.3088 -0.3088 -0.3088 -0.2338 -0.2338 -0.2337 -0.2337 -0.1675 -0.1675 -0.1675 -0.1675 2.9659 2.9659 2.9659 2.9659 4.8803 4.8803 4.8804 4.8804 8.8866 8.8866 8.8866 8.8866 9.2463 9.2463 9.2463 9.2463 10.6183 10.6183 10.6183 10.6183 11.5820 11.5820 11.5820 11.5820 12.5799 12.5799 12.5799 12.5799 13.4650 13.4651 k = 0.3857 0.2227 0.3094 ( 6850 PWs) bands (ev): -18.1595 -18.1595 -18.1595 -18.1595 -4.9067 -4.9067 -4.9067 -4.9067 -3.0849 -3.0849 -3.0849 -3.0849 -3.0588 -3.0588 -3.0588 -3.0588 -2.6264 -2.6264 -2.6264 -2.6264 -2.5967 -2.5967 -2.5967 -2.5967 -2.5014 -2.5014 -2.5014 -2.5014 -2.3609 -2.3609 -2.3609 -2.3609 -0.6066 -0.6066 -0.6066 -0.6066 -0.5220 -0.5220 -0.5220 -0.5220 -0.4612 -0.4612 -0.4612 -0.4612 -0.3088 -0.3088 -0.3087 -0.3087 -0.2305 -0.2305 -0.2304 -0.2304 -0.1689 -0.1689 -0.1688 -0.1688 3.0198 3.0198 3.0198 3.0198 4.8027 4.8027 4.8028 4.8028 8.8799 8.8799 8.8799 8.8799 9.2526 9.2526 9.2527 9.2527 10.6243 10.6243 10.6243 10.6243 11.5385 11.5385 11.5386 11.5386 12.6449 12.6449 12.6450 12.6450 13.4432 13.4432 k = 0.4000 0.2309 0.3094 ( 6850 PWs) bands (ev): -18.1594 -18.1594 -18.1594 -18.1594 -4.9074 -4.9074 -4.9074 -4.9074 -3.0838 -3.0838 -3.0838 -3.0838 -3.0597 -3.0597 -3.0597 -3.0597 -2.6269 -2.6269 -2.6269 -2.6269 -2.5952 -2.5952 -2.5952 -2.5952 -2.5042 -2.5042 -2.5041 -2.5041 -2.3622 -2.3622 -2.3621 -2.3621 -0.6056 -0.6056 -0.6056 -0.6056 -0.5233 -0.5233 -0.5233 -0.5233 -0.4623 -0.4623 -0.4622 -0.4622 -0.3088 -0.3088 -0.3087 -0.3087 -0.2271 -0.2271 -0.2271 -0.2271 -0.1704 -0.1704 -0.1704 -0.1704 3.0720 3.0720 3.0720 3.0720 4.7294 4.7294 4.7295 4.7295 8.8729 8.8729 8.8729 8.8729 9.2598 9.2598 9.2598 9.2598 10.6345 10.6345 10.6345 10.6345 11.4930 11.4930 11.4930 11.4930 12.7087 12.7087 12.7087 12.7087 13.4169 13.4169 k = 0.4143 0.2392 0.3094 ( 6842 PWs) bands (ev): -18.1593 -18.1593 -18.1593 -18.1593 -4.9080 -4.9080 -4.9080 -4.9080 -3.0828 -3.0828 -3.0828 -3.0828 -3.0607 -3.0607 -3.0607 -3.0607 -2.6276 -2.6276 -2.6276 -2.6276 -2.5936 -2.5936 -2.5935 -2.5935 -2.5067 -2.5067 -2.5067 -2.5067 -2.3633 -2.3633 -2.3633 -2.3633 -0.6048 -0.6048 -0.6047 -0.6047 -0.5244 -0.5244 -0.5244 -0.5244 -0.4633 -0.4633 -0.4632 -0.4632 -0.3088 -0.3088 -0.3088 -0.3088 -0.2239 -0.2239 -0.2238 -0.2238 -0.1721 -0.1721 -0.1720 -0.1720 3.1216 3.1216 3.1217 3.1217 4.6614 4.6614 4.6614 4.6614 8.8659 8.8659 8.8660 8.8660 9.2671 9.2671 9.2671 9.2671 10.6486 10.6486 10.6486 10.6486 11.4467 11.4467 11.4467 11.4467 12.7699 12.7699 12.7699 12.7699 13.3910 13.3910 k = 0.4286 0.2474 0.3094 ( 6834 PWs) bands (ev): -18.1592 -18.1592 -18.1592 -18.1592 -4.9085 -4.9085 -4.9085 -4.9085 -3.0817 -3.0817 -3.0817 -3.0817 -3.0618 -3.0618 -3.0618 -3.0618 -2.6283 -2.6283 -2.6282 -2.6282 -2.5918 -2.5918 -2.5918 -2.5918 -2.5091 -2.5091 -2.5090 -2.5090 -2.3643 -2.3643 -2.3642 -2.3642 -0.6041 -0.6041 -0.6040 -0.6040 -0.5253 -0.5253 -0.5252 -0.5252 -0.4641 -0.4641 -0.4640 -0.4640 -0.3088 -0.3088 -0.3088 -0.3088 -0.2208 -0.2208 -0.2207 -0.2207 -0.1738 -0.1738 -0.1738 -0.1738 3.1676 3.1676 3.1677 3.1677 4.5998 4.5998 4.5998 4.5998 8.8595 8.8595 8.8595 8.8595 9.2739 9.2739 9.2739 9.2739 10.6657 10.6657 10.6657 10.6657 11.4010 11.4010 11.4011 11.4011 12.8269 12.8269 12.8269 12.8269 13.3682 13.3682 k = 0.4429 0.2557 0.3094 ( 6838 PWs) bands (ev): -18.1591 -18.1591 -18.1591 -18.1591 -4.9089 -4.9089 -4.9089 -4.9089 -3.0807 -3.0807 -3.0807 -3.0807 -3.0628 -3.0628 -3.0628 -3.0628 -2.6289 -2.6289 -2.6289 -2.6289 -2.5902 -2.5902 -2.5901 -2.5901 -2.5111 -2.5111 -2.5111 -2.5111 -2.3651 -2.3651 -2.3651 -2.3651 -0.6035 -0.6035 -0.6035 -0.6035 -0.5259 -0.5259 -0.5259 -0.5259 -0.4648 -0.4648 -0.4648 -0.4648 -0.3088 -0.3088 -0.3088 -0.3088 -0.2179 -0.2179 -0.2179 -0.2179 -0.1756 -0.1756 -0.1755 -0.1755 3.2086 3.2086 3.2087 3.2087 4.5459 4.5459 4.5460 4.5460 8.8538 8.8538 8.8539 8.8539 9.2799 9.2799 9.2800 9.2800 10.6845 10.6845 10.6845 10.6845 11.3580 11.3580 11.3580 11.3580 12.8778 12.8778 12.8778 12.8778 13.3498 13.3498 k = 0.4571 0.2639 0.3094 ( 6828 PWs) bands (ev): -18.1591 -18.1591 -18.1591 -18.1591 -4.9092 -4.9092 -4.9092 -4.9092 -3.0797 -3.0797 -3.0797 -3.0797 -3.0638 -3.0638 -3.0638 -3.0638 -2.6294 -2.6294 -2.6294 -2.6294 -2.5887 -2.5887 -2.5887 -2.5887 -2.5128 -2.5128 -2.5127 -2.5127 -2.3658 -2.3658 -2.3657 -2.3657 -0.6031 -0.6031 -0.6030 -0.6030 -0.5264 -0.5264 -0.5263 -0.5263 -0.4654 -0.4654 -0.4653 -0.4653 -0.3089 -0.3089 -0.3088 -0.3088 -0.2154 -0.2154 -0.2154 -0.2154 -0.1772 -0.1772 -0.1771 -0.1771 3.2431 3.2431 3.2431 3.2431 4.5015 4.5015 4.5015 4.5015 8.8492 8.8492 8.8492 8.8492 9.2849 9.2849 9.2849 9.2849 10.7032 10.7032 10.7033 10.7033 11.3199 11.3199 11.3199 11.3199 12.9203 12.9203 12.9203 12.9203 13.3364 13.3365 k = 0.4714 0.2722 0.3094 ( 6832 PWs) bands (ev): -18.1590 -18.1590 -18.1590 -18.1590 -4.9094 -4.9094 -4.9094 -4.9094 -3.0789 -3.0789 -3.0789 -3.0789 -3.0646 -3.0646 -3.0646 -3.0646 -2.6298 -2.6298 -2.6298 -2.6298 -2.5876 -2.5876 -2.5876 -2.5876 -2.5140 -2.5140 -2.5140 -2.5140 -2.3662 -2.3662 -2.3662 -2.3662 -0.6028 -0.6028 -0.6028 -0.6028 -0.5267 -0.5267 -0.5267 -0.5267 -0.4658 -0.4658 -0.4657 -0.4657 -0.3089 -0.3089 -0.3089 -0.3089 -0.2134 -0.2134 -0.2134 -0.2134 -0.1785 -0.1785 -0.1785 -0.1785 3.2693 3.2693 3.2694 3.2694 4.4681 4.4681 4.4681 4.4681 8.8458 8.8458 8.8458 8.8458 9.2885 9.2885 9.2885 9.2885 10.7196 10.7196 10.7196 10.7196 11.2894 11.2894 11.2895 11.2895 12.9524 12.9524 12.9525 12.9525 13.3279 13.3279 k = 0.4857 0.2804 0.3094 ( 6844 PWs) bands (ev): -18.1590 -18.1590 -18.1590 -18.1590 -4.9096 -4.9096 -4.9096 -4.9096 -3.0784 -3.0784 -3.0784 -3.0784 -3.0651 -3.0651 -3.0651 -3.0651 -2.6301 -2.6301 -2.6301 -2.6301 -2.5869 -2.5869 -2.5869 -2.5869 -2.5148 -2.5148 -2.5148 -2.5148 -2.3665 -2.3665 -2.3665 -2.3665 -0.6026 -0.6026 -0.6026 -0.6026 -0.5269 -0.5269 -0.5269 -0.5269 -0.4660 -0.4660 -0.4660 -0.4660 -0.3089 -0.3089 -0.3089 -0.3089 -0.2121 -0.2121 -0.2121 -0.2121 -0.1794 -0.1794 -0.1794 -0.1794 3.2858 3.2858 3.2859 3.2859 4.4473 4.4473 4.4473 4.4473 8.8437 8.8437 8.8437 8.8437 9.2907 9.2907 9.2908 9.2908 10.7309 10.7309 10.7310 10.7310 11.2695 11.2695 11.2695 11.2695 12.9724 12.9724 12.9724 12.9724 13.3234 13.3234 k = 0.5000 0.2887 0.3094 ( 6836 PWs) bands (ev): -18.1590 -18.1590 -18.1590 -18.1590 -4.9096 -4.9096 -4.9096 -4.9096 -3.0782 -3.0782 -3.0782 -3.0782 -3.0653 -3.0653 -3.0653 -3.0653 -2.6302 -2.6302 -2.6302 -2.6302 -2.5867 -2.5867 -2.5866 -2.5866 -2.5151 -2.5151 -2.5151 -2.5151 -2.3666 -2.3666 -2.3666 -2.3666 -0.6026 -0.6026 -0.6025 -0.6025 -0.5269 -0.5269 -0.5269 -0.5269 -0.4661 -0.4661 -0.4661 -0.4661 -0.3089 -0.3089 -0.3089 -0.3089 -0.2117 -0.2117 -0.2116 -0.2116 -0.1798 -0.1798 -0.1797 -0.1797 3.2915 3.2915 3.2915 3.2915 4.4402 4.4402 4.4402 4.4402 8.8429 8.8429 8.8430 8.8430 9.2915 9.2915 9.2915 9.2915 10.7350 10.7350 10.7350 10.7350 11.2625 11.2625 11.2626 11.2626 12.9791 12.9791 12.9792 12.9792 13.3221 13.3221 k = 0.5000 0.2887 0.3094 ( 6836 PWs) bands (ev): -18.1590 -18.1590 -18.1590 -18.1590 -4.9096 -4.9096 -4.9096 -4.9096 -3.0782 -3.0782 -3.0782 -3.0782 -3.0653 -3.0653 -3.0653 -3.0653 -2.6302 -2.6302 -2.6302 -2.6302 -2.5867 -2.5867 -2.5866 -2.5866 -2.5151 -2.5151 -2.5151 -2.5151 -2.3666 -2.3666 -2.3666 -2.3666 -0.6026 -0.6026 -0.6025 -0.6025 -0.5269 -0.5269 -0.5269 -0.5269 -0.4661 -0.4661 -0.4661 -0.4661 -0.3089 -0.3089 -0.3089 -0.3089 -0.2117 -0.2117 -0.2116 -0.2116 -0.1798 -0.1798 -0.1797 -0.1797 3.2915 3.2915 3.2915 3.2915 4.4402 4.4402 4.4402 4.4402 8.8429 8.8429 8.8430 8.8430 9.2915 9.2915 9.2915 9.2915 10.7350 10.7350 10.7350 10.7350 11.2625 11.2625 11.2626 11.2626 12.9791 12.9791 12.9792 12.9792 13.3221 13.3221 k = 0.4921 0.3024 0.3094 ( 6832 PWs) bands (ev): -18.1590 -18.1590 -18.1590 -18.1590 -4.9099 -4.9099 -4.9093 -4.9093 -3.0802 -3.0802 -3.0772 -3.0772 -3.0667 -3.0667 -3.0627 -3.0627 -2.6316 -2.6316 -2.6288 -2.6288 -2.5877 -2.5877 -2.5856 -2.5856 -2.5163 -2.5163 -2.5136 -2.5136 -2.3681 -2.3681 -2.3654 -2.3654 -0.6040 -0.6040 -0.6010 -0.6010 -0.5273 -0.5273 -0.5268 -0.5268 -0.4680 -0.4680 -0.4638 -0.4638 -0.3100 -0.3100 -0.3085 -0.3085 -0.2143 -0.2143 -0.2097 -0.2097 -0.1833 -0.1833 -0.1751 -0.1751 3.2910 3.2910 3.2940 3.2940 4.4386 4.4386 4.4406 4.4406 8.8369 8.8369 8.8389 8.8389 9.2679 9.2679 9.3148 9.3148 10.7221 10.7221 10.7584 10.7584 11.2622 11.2622 11.2696 11.2696 12.9713 12.9713 12.9858 12.9858 13.3115 13.3115 k = 0.4841 0.3162 0.3094 ( 6832 PWs) bands (ev): -18.1590 -18.1590 -18.1590 -18.1590 -4.9102 -4.9102 -4.9091 -4.9091 -3.0827 -3.0827 -3.0782 -3.0782 -3.0661 -3.0661 -3.0597 -3.0597 -2.6331 -2.6331 -2.6277 -2.6277 -2.5887 -2.5887 -2.5846 -2.5846 -2.5173 -2.5173 -2.5121 -2.5121 -2.3699 -2.3699 -2.3644 -2.3644 -0.6053 -0.6053 -0.5993 -0.5993 -0.5278 -0.5278 -0.5269 -0.5269 -0.4696 -0.4696 -0.4613 -0.4613 -0.3117 -0.3117 -0.3086 -0.3086 -0.2171 -0.2171 -0.2093 -0.2093 -0.1848 -0.1848 -0.1698 -0.1698 3.2924 3.2924 3.2985 3.2985 4.4358 4.4358 4.4397 4.4397 8.8218 8.8218 8.8242 8.8242 9.2458 9.2458 9.3360 9.3360 10.7208 10.7208 10.7899 10.7899 11.2680 11.2680 11.2846 11.2846 12.9615 12.9615 12.9919 12.9919 13.2919 13.2919 k = 0.4762 0.3299 0.3094 ( 6828 PWs) bands (ev): -18.1590 -18.1590 -18.1590 -18.1590 -4.9106 -4.9106 -4.9088 -4.9088 -3.0851 -3.0851 -3.0807 -3.0807 -3.0640 -3.0640 -3.0567 -3.0567 -2.6346 -2.6346 -2.6267 -2.6267 -2.5896 -2.5896 -2.5837 -2.5837 -2.5180 -2.5180 -2.5105 -2.5105 -2.3718 -2.3718 -2.3639 -2.3639 -0.6064 -0.6064 -0.5975 -0.5975 -0.5284 -0.5284 -0.5273 -0.5273 -0.4709 -0.4709 -0.4585 -0.4585 -0.3141 -0.3141 -0.3094 -0.3094 -0.2197 -0.2197 -0.2112 -0.2112 -0.1838 -0.1838 -0.1644 -0.1644 3.2958 3.2958 3.3049 3.3049 4.4317 4.4317 4.4375 4.4375 8.7990 8.7990 8.7992 8.7992 9.2264 9.2264 9.3538 9.3538 10.7307 10.7307 10.8259 10.8259 11.2803 11.2803 11.3095 11.3095 12.9488 12.9488 12.9976 12.9976 13.2644 13.2644 k = 0.4683 0.3437 0.3094 ( 6824 PWs) bands (ev): -18.1590 -18.1590 -18.1589 -18.1589 -4.9110 -4.9110 -4.9086 -4.9086 -3.0875 -3.0875 -3.0837 -3.0837 -3.0612 -3.0612 -3.0536 -3.0536 -2.6362 -2.6362 -2.6259 -2.6259 -2.5902 -2.5902 -2.5828 -2.5828 -2.5183 -2.5183 -2.5090 -2.5090 -2.3739 -2.3739 -2.3637 -2.3637 -0.6075 -0.6075 -0.5957 -0.5957 -0.5290 -0.5290 -0.5279 -0.5279 -0.4718 -0.4718 -0.4555 -0.4555 -0.3171 -0.3171 -0.3107 -0.3107 -0.2218 -0.2218 -0.2148 -0.2148 -0.1808 -0.1808 -0.1588 -0.1588 3.3012 3.3012 3.3133 3.3133 4.4264 4.4264 4.4339 4.4339 8.7652 8.7652 8.7700 8.7700 9.2103 9.2103 9.3675 9.3675 10.7498 10.7498 10.8621 10.8621 11.3000 11.3000 11.3468 11.3468 12.9323 12.9323 13.0027 13.0027 13.2312 13.2312 k = 0.4603 0.3574 0.3094 ( 6828 PWs) bands (ev): -18.1590 -18.1590 -18.1589 -18.1589 -4.9113 -4.9113 -4.9084 -4.9084 -3.0898 -3.0898 -3.0868 -3.0868 -3.0582 -3.0582 -3.0508 -3.0508 -2.6377 -2.6377 -2.6254 -2.6254 -2.5907 -2.5907 -2.5820 -2.5820 -2.5184 -2.5184 -2.5076 -2.5076 -2.3759 -2.3759 -2.3639 -2.3639 -0.6084 -0.6084 -0.5937 -0.5937 -0.5297 -0.5297 -0.5288 -0.5288 -0.4724 -0.4724 -0.4524 -0.4524 -0.3207 -0.3207 -0.3124 -0.3124 -0.2236 -0.2236 -0.2191 -0.2191 -0.1768 -0.1768 -0.1534 -0.1534 3.3084 3.3084 3.3236 3.3236 4.4198 4.4198 4.4289 4.4289 8.7243 8.7243 8.7362 8.7362 9.1969 9.1969 9.3773 9.3773 10.7754 10.7754 10.8947 10.8947 11.3283 11.3283 11.3986 11.3986 12.9115 12.9115 13.0063 13.0063 13.1955 13.1955 k = 0.4524 0.3712 0.3094 ( 6824 PWs) bands (ev): -18.1589 -18.1589 -18.1589 -18.1589 -4.9117 -4.9117 -4.9083 -4.9083 -3.0919 -3.0919 -3.0900 -3.0900 -3.0550 -3.0550 -3.0481 -3.0481 -2.6391 -2.6391 -2.6251 -2.6251 -2.5908 -2.5908 -2.5813 -2.5813 -2.5181 -2.5181 -2.5066 -2.5066 -2.3779 -2.3779 -2.3644 -2.3644 -0.6092 -0.6092 -0.5918 -0.5918 -0.5304 -0.5304 -0.5298 -0.5298 -0.4727 -0.4727 -0.4492 -0.4492 -0.3246 -0.3246 -0.3146 -0.3146 -0.2249 -0.2249 -0.2237 -0.2237 -0.1723 -0.1723 -0.1481 -0.1481 3.3176 3.3176 3.3357 3.3357 4.4118 4.4118 4.4222 4.4222 8.6789 8.6789 8.6988 8.6988 9.1857 9.1857 9.3834 9.3834 10.8038 10.8038 10.9211 10.9211 11.3667 11.3667 11.4658 11.4658 12.8863 12.8863 13.0059 13.0059 13.1622 13.1622 k = 0.4444 0.3849 0.3094 ( 6832 PWs) bands (ev): -18.1589 -18.1589 -18.1588 -18.1588 -4.9121 -4.9121 -4.9081 -4.9081 -3.0938 -3.0938 -3.0931 -3.0931 -3.0519 -3.0519 -3.0458 -3.0458 -2.6404 -2.6404 -2.6251 -2.6251 -2.5905 -2.5905 -2.5805 -2.5805 -2.5176 -2.5176 -2.5060 -2.5060 -2.3798 -2.3798 -2.3654 -2.3654 -0.6098 -0.6098 -0.5898 -0.5898 -0.5310 -0.5310 -0.5310 -0.5310 -0.4729 -0.4729 -0.4459 -0.4459 -0.3288 -0.3288 -0.3172 -0.3172 -0.2283 -0.2283 -0.2258 -0.2258 -0.1677 -0.1677 -0.1429 -0.1429 3.3286 3.3286 3.3498 3.3498 4.4024 4.4024 4.4140 4.4140 8.6312 8.6312 8.6594 8.6594 9.1759 9.1759 9.3866 9.3866 10.8317 10.8317 10.9407 10.9407 11.4162 11.4162 11.5475 11.5475 12.8575 12.8575 12.9968 12.9968 13.1377 13.1377 k = 0.4365 0.3986 0.3094 ( 6826 PWs) bands (ev): -18.1589 -18.1589 -18.1588 -18.1588 -4.9125 -4.9125 -4.9080 -4.9080 -3.0960 -3.0960 -3.0955 -3.0955 -3.0487 -3.0487 -3.0437 -3.0437 -2.6416 -2.6416 -2.6254 -2.6254 -2.5898 -2.5898 -2.5798 -2.5798 -2.5170 -2.5170 -2.5060 -2.5060 -2.3815 -2.3815 -2.3667 -2.3667 -0.6104 -0.6104 -0.5878 -0.5878 -0.5323 -0.5323 -0.5316 -0.5316 -0.4729 -0.4729 -0.4426 -0.4426 -0.3332 -0.3332 -0.3201 -0.3201 -0.2327 -0.2327 -0.2264 -0.2264 -0.1630 -0.1630 -0.1380 -0.1380 3.3413 3.3413 3.3656 3.3656 4.3914 4.3914 4.4039 4.4039 8.5830 8.5830 8.6189 8.6189 9.1668 9.1668 9.3875 9.3875 10.8565 10.8565 10.9540 10.9540 11.4771 11.4771 11.6414 11.6414 12.8262 12.8262 12.9751 12.9751 13.1277 13.1277 k = 0.4286 0.4124 0.3094 ( 6822 PWs) bands (ev): -18.1589 -18.1589 -18.1588 -18.1588 -4.9129 -4.9129 -4.9079 -4.9079 -3.0989 -3.0989 -3.0970 -3.0970 -3.0457 -3.0457 -3.0419 -3.0419 -2.6427 -2.6427 -2.6258 -2.6258 -2.5887 -2.5887 -2.5790 -2.5790 -2.5162 -2.5162 -2.5065 -2.5065 -2.3828 -2.3828 -2.3683 -2.3683 -0.6109 -0.6109 -0.5859 -0.5859 -0.5335 -0.5335 -0.5321 -0.5321 -0.4730 -0.4730 -0.4392 -0.4392 -0.3376 -0.3376 -0.3232 -0.3232 -0.2368 -0.2368 -0.2267 -0.2267 -0.1585 -0.1585 -0.1334 -0.1334 3.3558 3.3558 3.3831 3.3831 4.3789 4.3789 4.3920 4.3920 8.5357 8.5357 8.5786 8.5786 9.1582 9.1582 9.3866 9.3866 10.8769 10.8769 10.9624 10.9624 11.5484 11.5484 11.7449 11.7449 12.7937 12.7937 12.9431 12.9431 13.1314 13.1314 k = 0.4206 0.4261 0.3094 ( 6824 PWs) bands (ev): -18.1588 -18.1588 -18.1587 -18.1587 -4.9133 -4.9133 -4.9079 -4.9079 -3.1015 -3.1015 -3.0983 -3.0983 -3.0427 -3.0427 -3.0404 -3.0404 -2.6435 -2.6435 -2.6265 -2.6265 -2.5873 -2.5873 -2.5781 -2.5781 -2.5153 -2.5153 -2.5076 -2.5076 -2.3839 -2.3839 -2.3701 -2.3701 -0.6112 -0.6112 -0.5841 -0.5841 -0.5345 -0.5345 -0.5325 -0.5325 -0.4730 -0.4730 -0.4359 -0.4359 -0.3419 -0.3419 -0.3267 -0.3267 -0.2406 -0.2406 -0.2268 -0.2268 -0.1542 -0.1542 -0.1290 -0.1290 3.3719 3.3719 3.4023 3.4023 4.3648 4.3648 4.3783 4.3783 8.4905 8.4905 8.5393 8.5393 9.1497 9.1497 9.3845 9.3845 10.8927 10.8927 10.9671 10.9671 11.6281 11.6281 11.8553 11.8553 12.7613 12.7613 12.9063 12.9063 13.1445 13.1445 k = 0.4127 0.4399 0.3094 ( 6820 PWs) bands (ev): -18.1588 -18.1588 -18.1587 -18.1587 -4.9136 -4.9136 -4.9078 -4.9078 -3.1040 -3.1040 -3.0993 -3.0993 -3.0399 -3.0399 -3.0393 -3.0393 -2.6442 -2.6442 -2.6272 -2.6272 -2.5854 -2.5854 -2.5771 -2.5771 -2.5144 -2.5144 -2.5094 -2.5094 -2.3847 -2.3847 -2.3722 -2.3722 -0.6115 -0.6115 -0.5825 -0.5825 -0.5354 -0.5354 -0.5328 -0.5328 -0.4732 -0.4732 -0.4326 -0.4326 -0.3461 -0.3461 -0.3303 -0.3303 -0.2441 -0.2441 -0.2267 -0.2267 -0.1501 -0.1501 -0.1250 -0.1250 3.3894 3.3894 3.4229 3.4229 4.3492 4.3492 4.3626 4.3626 8.4484 8.4484 8.5019 8.5019 9.1414 9.1414 9.3815 9.3815 10.9043 10.9043 10.9691 10.9691 11.7135 11.7135 11.9701 11.9701 12.7302 12.7302 12.8685 12.8685 13.1642 13.1642 k = 0.4048 0.4536 0.3094 ( 6820 PWs) bands (ev): -18.1588 -18.1588 -18.1586 -18.1586 -4.9140 -4.9140 -4.9078 -4.9078 -3.1062 -3.1062 -3.1001 -3.1001 -3.0384 -3.0384 -3.0373 -3.0373 -2.6447 -2.6447 -2.6281 -2.6281 -2.5832 -2.5832 -2.5760 -2.5760 -2.5136 -2.5136 -2.5118 -2.5118 -2.3851 -2.3851 -2.3745 -2.3745 -0.6117 -0.6117 -0.5811 -0.5811 -0.5359 -0.5359 -0.5331 -0.5331 -0.4735 -0.4735 -0.4294 -0.4294 -0.3499 -0.3499 -0.3340 -0.3340 -0.2472 -0.2472 -0.2264 -0.2264 -0.1463 -0.1463 -0.1213 -0.1213 3.4081 3.4081 3.4449 3.4449 4.3322 4.3322 4.3452 4.3452 8.4098 8.4098 8.4671 8.4671 9.1332 9.1332 9.3781 9.3781 10.9123 10.9123 10.9692 10.9692 11.8016 11.8016 12.0867 12.0867 12.7016 12.7016 12.8318 12.8318 13.1892 13.1892 k = 0.3968 0.4674 0.3094 ( 6828 PWs) bands (ev): -18.1587 -18.1587 -18.1586 -18.1586 -4.9143 -4.9143 -4.9078 -4.9078 -3.1083 -3.1083 -3.1007 -3.1007 -3.0379 -3.0379 -3.0348 -3.0348 -2.6450 -2.6450 -2.6289 -2.6289 -2.5807 -2.5807 -2.5748 -2.5748 -2.5148 -2.5148 -2.5129 -2.5129 -2.3852 -2.3852 -2.3768 -2.3768 -0.6119 -0.6119 -0.5801 -0.5801 -0.5361 -0.5361 -0.5333 -0.5333 -0.4740 -0.4740 -0.4263 -0.4263 -0.3534 -0.3534 -0.3377 -0.3377 -0.2500 -0.2500 -0.2261 -0.2261 -0.1429 -0.1429 -0.1180 -0.1180 3.4279 3.4279 3.4678 3.4678 4.3139 4.3139 4.3261 4.3261 8.3752 8.3752 8.4353 8.4353 9.1251 9.1251 9.3743 9.3743 10.9175 10.9175 10.9679 10.9679 11.8896 11.8896 12.2023 12.2023 12.6766 12.6766 12.7972 12.7972 13.2193 13.2193 k = 0.3889 0.4811 0.3094 ( 6832 PWs) bands (ev): -18.1587 -18.1587 -18.1585 -18.1585 -4.9147 -4.9147 -4.9079 -4.9079 -3.1101 -3.1101 -3.1012 -3.1012 -3.0377 -3.0377 -3.0325 -3.0325 -2.6452 -2.6452 -2.6298 -2.6298 -2.5779 -2.5779 -2.5735 -2.5735 -2.5183 -2.5183 -2.5123 -2.5123 -2.3852 -2.3852 -2.3792 -2.3792 -0.6120 -0.6120 -0.5793 -0.5793 -0.5359 -0.5359 -0.5334 -0.5334 -0.4747 -0.4747 -0.4233 -0.4233 -0.3565 -0.3565 -0.3414 -0.3414 -0.2524 -0.2524 -0.2257 -0.2257 -0.1399 -0.1399 -0.1151 -0.1151 3.4483 3.4483 3.4915 3.4915 4.2946 4.2946 4.3056 4.3056 8.3450 8.3450 8.4070 8.4070 9.1173 9.1173 9.3705 9.3705 10.9206 10.9206 10.9659 10.9659 11.9744 11.9744 12.3132 12.3132 12.6569 12.6569 12.7653 12.7653 13.2545 13.2545 k = 0.3810 0.4949 0.3094 ( 6840 PWs) bands (ev): -18.1587 -18.1587 -18.1585 -18.1585 -4.9149 -4.9149 -4.9079 -4.9079 -3.1117 -3.1117 -3.1014 -3.1014 -3.0377 -3.0377 -3.0305 -3.0305 -2.6452 -2.6452 -2.6306 -2.6306 -2.5748 -2.5748 -2.5721 -2.5721 -2.5222 -2.5222 -2.5118 -2.5118 -2.3849 -2.3849 -2.3815 -2.3815 -0.6120 -0.6120 -0.5788 -0.5788 -0.5354 -0.5354 -0.5334 -0.5334 -0.4756 -0.4756 -0.4205 -0.4205 -0.3591 -0.3591 -0.3449 -0.3449 -0.2544 -0.2544 -0.2253 -0.2253 -0.1372 -0.1372 -0.1125 -0.1125 3.4690 3.4690 3.5155 3.5155 4.2747 4.2747 4.2842 4.2842 8.3193 8.3193 8.3824 8.3824 9.1099 9.1099 9.3668 9.3668 10.9222 10.9222 10.9634 10.9634 12.0533 12.0533 12.4132 12.4132 12.6462 12.6462 12.7362 12.7362 13.2945 13.2945 k = 0.3730 0.5086 0.3094 ( 6856 PWs) bands (ev): -18.1586 -18.1586 -18.1585 -18.1585 -4.9152 -4.9152 -4.9079 -4.9079 -3.1130 -3.1130 -3.1015 -3.1015 -3.0379 -3.0379 -3.0288 -3.0288 -2.6452 -2.6452 -2.6314 -2.6314 -2.5715 -2.5715 -2.5708 -2.5708 -2.5264 -2.5264 -2.5115 -2.5115 -2.3845 -2.3845 -2.3837 -2.3837 -0.6120 -0.6120 -0.5786 -0.5786 -0.5346 -0.5346 -0.5334 -0.5334 -0.4766 -0.4766 -0.4180 -0.4180 -0.3613 -0.3613 -0.3482 -0.3482 -0.2561 -0.2561 -0.2250 -0.2250 -0.1349 -0.1349 -0.1104 -0.1104 3.4894 3.4894 3.5391 3.5391 4.2548 4.2548 4.2624 4.2624 8.2980 8.2980 8.3617 8.3617 9.1032 9.1032 9.3634 9.3634 10.9227 10.9227 10.9608 10.9608 12.1240 12.1240 12.4901 12.4901 12.6536 12.6536 12.7098 12.7098 13.3384 13.3384 k = 0.3651 0.5224 0.3094 ( 6866 PWs) bands (ev): -18.1586 -18.1586 -18.1584 -18.1584 -4.9154 -4.9154 -4.9080 -4.9080 -3.1141 -3.1141 -3.1015 -3.1015 -3.0381 -3.0381 -3.0273 -3.0273 -2.6451 -2.6451 -2.6320 -2.6320 -2.5694 -2.5694 -2.5679 -2.5679 -2.5309 -2.5309 -2.5114 -2.5114 -2.3856 -2.3856 -2.3842 -2.3842 -0.6120 -0.6120 -0.5786 -0.5786 -0.5336 -0.5336 -0.5334 -0.5334 -0.4776 -0.4776 -0.4157 -0.4157 -0.3631 -0.3631 -0.3512 -0.3512 -0.2574 -0.2574 -0.2246 -0.2246 -0.1331 -0.1331 -0.1087 -0.1087 3.5086 3.5086 3.5616 3.5616 4.2357 4.2357 4.2413 4.2413 8.2811 8.2811 8.3450 8.3450 9.0972 9.0972 9.3603 9.3603 10.9225 10.9225 10.9583 10.9583 12.1846 12.1846 12.5287 12.5287 12.6864 12.6864 12.6906 12.6906 13.3822 13.3822 k = 0.3571 0.5361 0.3094 ( 6878 PWs) bands (ev): -18.1586 -18.1586 -18.1584 -18.1584 -4.9156 -4.9156 -4.9080 -4.9080 -3.1150 -3.1150 -3.1015 -3.1015 -3.0385 -3.0385 -3.0262 -3.0262 -2.6450 -2.6450 -2.6326 -2.6326 -2.5682 -2.5682 -2.5640 -2.5640 -2.5355 -2.5355 -2.5114 -2.5114 -2.3872 -2.3872 -2.3838 -2.3838 -0.6120 -0.6120 -0.5787 -0.5787 -0.5334 -0.5334 -0.5326 -0.5326 -0.4787 -0.4787 -0.4138 -0.4138 -0.3644 -0.3644 -0.3537 -0.3537 -0.2584 -0.2584 -0.2243 -0.2243 -0.1316 -0.1316 -0.1073 -0.1073 3.5258 3.5258 3.5817 3.5817 4.2184 4.2184 4.2219 4.2219 8.2684 8.2684 8.3322 8.3322 9.0921 9.0921 9.3578 9.3578 10.9220 10.9220 10.9561 10.9561 12.2337 12.2337 12.5392 12.5392 12.6660 12.6660 12.7426 12.7426 13.3912 13.3912 k = 0.3492 0.5499 0.3094 ( 6878 PWs) bands (ev): -18.1586 -18.1586 -18.1584 -18.1584 -4.9157 -4.9157 -4.9080 -4.9080 -3.1156 -3.1156 -3.1014 -3.1014 -3.0388 -3.0388 -3.0253 -3.0253 -2.6449 -2.6449 -2.6330 -2.6330 -2.5672 -2.5672 -2.5600 -2.5600 -2.5401 -2.5401 -2.5115 -2.5115 -2.3885 -2.3885 -2.3835 -2.3835 -0.6119 -0.6119 -0.5789 -0.5789 -0.5334 -0.5334 -0.5317 -0.5317 -0.4796 -0.4796 -0.4123 -0.4123 -0.3653 -0.3653 -0.3555 -0.3555 -0.2591 -0.2591 -0.2240 -0.2240 -0.1306 -0.1306 -0.1064 -0.1064 3.5398 3.5398 3.5982 3.5982 4.2042 4.2042 4.2058 4.2058 8.2598 8.2598 8.3232 8.3232 9.0883 9.0883 9.3559 9.3559 10.9214 10.9214 10.9544 10.9544 12.2701 12.2701 12.5407 12.5407 12.6495 12.6495 12.7869 12.7869 13.3999 13.3999 k = 0.3413 0.5636 0.3094 ( 6878 PWs) bands (ev): -18.1585 -18.1585 -18.1584 -18.1584 -4.9158 -4.9158 -4.9081 -4.9081 -3.1160 -3.1160 -3.1013 -3.1013 -3.0390 -3.0390 -3.0248 -3.0248 -2.6448 -2.6448 -2.6332 -2.6332 -2.5665 -2.5665 -2.5561 -2.5561 -2.5444 -2.5444 -2.5116 -2.5116 -2.3892 -2.3892 -2.3832 -2.3832 -0.6119 -0.6119 -0.5790 -0.5790 -0.5334 -0.5334 -0.5311 -0.5311 -0.4802 -0.4802 -0.4114 -0.4114 -0.3658 -0.3658 -0.3567 -0.3567 -0.2596 -0.2596 -0.2238 -0.2238 -0.1300 -0.1300 -0.1058 -0.1058 3.5491 3.5491 3.6093 3.6093 4.1946 4.1946 4.1948 4.1948 8.2548 8.2548 8.3180 8.3180 9.0859 9.0859 9.3547 9.3547 10.9209 10.9209 10.9534 10.9534 12.2925 12.2925 12.5405 12.5405 12.6382 12.6382 12.8139 12.8139 13.4072 13.4072 k = 0.3333 0.5774 0.3094 ( 6882 PWs) bands (ev): -18.1585 -18.1585 -18.1584 -18.1584 -4.9158 -4.9158 -4.9081 -4.9081 -3.1161 -3.1161 -3.1012 -3.1012 -3.0391 -3.0391 -3.0246 -3.0246 -2.6448 -2.6448 -2.6333 -2.6333 -2.5663 -2.5663 -2.5538 -2.5538 -2.5469 -2.5469 -2.5117 -2.5117 -2.3895 -2.3895 -2.3832 -2.3832 -0.6119 -0.6119 -0.5791 -0.5791 -0.5334 -0.5334 -0.5308 -0.5308 -0.4804 -0.4804 -0.4111 -0.4111 -0.3659 -0.3659 -0.3571 -0.3571 -0.2597 -0.2597 -0.2238 -0.2238 -0.1298 -0.1298 -0.1057 -0.1057 3.5525 3.5525 3.6133 3.6133 4.1907 4.1907 4.1911 4.1911 8.2532 8.2532 8.3163 8.3163 9.0850 9.0850 9.3543 9.3543 10.9208 10.9208 10.9530 10.9530 12.3002 12.3002 12.5405 12.5405 12.6341 12.6341 12.8224 12.8224 13.4104 13.4104 k = 0.3333 0.5774 0.3094 ( 6882 PWs) bands (ev): -18.1585 -18.1585 -18.1584 -18.1584 -4.9158 -4.9158 -4.9081 -4.9081 -3.1161 -3.1161 -3.1012 -3.1012 -3.0391 -3.0391 -3.0246 -3.0246 -2.6448 -2.6448 -2.6333 -2.6333 -2.5663 -2.5663 -2.5538 -2.5538 -2.5469 -2.5469 -2.5117 -2.5117 -2.3895 -2.3895 -2.3832 -2.3832 -0.6119 -0.6119 -0.5791 -0.5791 -0.5334 -0.5334 -0.5308 -0.5308 -0.4804 -0.4804 -0.4111 -0.4111 -0.3659 -0.3659 -0.3571 -0.3571 -0.2597 -0.2597 -0.2238 -0.2238 -0.1298 -0.1298 -0.1057 -0.1057 3.5525 3.5525 3.6133 3.6133 4.1907 4.1907 4.1911 4.1911 8.2532 8.2532 8.3163 8.3163 9.0850 9.0850 9.3543 9.3543 10.9208 10.9208 10.9530 10.9530 12.3002 12.3002 12.5405 12.5405 12.6341 12.6341 12.8224 12.8224 13.4104 13.4104 k = 0.3252 0.5633 0.3094 ( 6874 PWs) bands (ev): -18.1585 -18.1585 -18.1584 -18.1584 -4.9158 -4.9158 -4.9080 -4.9080 -3.1160 -3.1160 -3.1013 -3.1013 -3.0390 -3.0390 -3.0248 -3.0248 -2.6448 -2.6448 -2.6332 -2.6332 -2.5665 -2.5665 -2.5563 -2.5563 -2.5443 -2.5443 -2.5116 -2.5116 -2.3892 -2.3892 -2.3832 -2.3832 -0.6119 -0.6119 -0.5790 -0.5790 -0.5334 -0.5334 -0.5311 -0.5311 -0.4802 -0.4802 -0.4114 -0.4114 -0.3658 -0.3658 -0.3567 -0.3567 -0.2596 -0.2596 -0.2238 -0.2238 -0.1300 -0.1300 -0.1058 -0.1058 3.5486 3.5486 3.6087 3.6087 4.1952 4.1952 4.1954 4.1954 8.2548 8.2548 8.3180 8.3180 9.0860 9.0860 9.3547 9.3547 10.9210 10.9210 10.9534 10.9534 12.2923 12.2923 12.5401 12.5401 12.6387 12.6387 12.8152 12.8152 13.4058 13.4058 k = 0.3171 0.5492 0.3094 ( 6874 PWs) bands (ev): -18.1586 -18.1586 -18.1584 -18.1584 -4.9157 -4.9157 -4.9080 -4.9080 -3.1156 -3.1156 -3.1014 -3.1014 -3.0387 -3.0387 -3.0253 -3.0253 -2.6449 -2.6449 -2.6329 -2.6329 -2.5674 -2.5674 -2.5605 -2.5605 -2.5396 -2.5396 -2.5113 -2.5113 -2.3884 -2.3884 -2.3835 -2.3835 -0.6120 -0.6120 -0.5787 -0.5787 -0.5334 -0.5334 -0.5320 -0.5320 -0.4794 -0.4794 -0.4123 -0.4123 -0.3653 -0.3653 -0.3555 -0.3555 -0.2591 -0.2591 -0.2241 -0.2241 -0.1306 -0.1306 -0.1063 -0.1063 3.5366 3.5366 3.5946 3.5946 4.2079 4.2079 4.2099 4.2099 8.2591 8.2591 8.3229 8.3229 9.0889 9.0889 9.3561 9.3561 10.9218 10.9218 10.9546 10.9546 12.2701 12.2701 12.5371 12.5371 12.6521 12.6521 12.7979 12.7979 13.3900 13.3900 k = 0.3089 0.5351 0.3094 ( 6874 PWs) bands (ev): -18.1586 -18.1586 -18.1584 -18.1584 -4.9155 -4.9155 -4.9079 -4.9079 -3.1150 -3.1150 -3.1017 -3.1017 -3.0381 -3.0381 -3.0262 -3.0262 -2.6451 -2.6451 -2.6324 -2.6324 -2.5689 -2.5689 -2.5648 -2.5648 -2.5344 -2.5344 -2.5108 -2.5108 -2.3870 -2.3870 -2.3840 -2.3840 -0.6121 -0.6121 -0.5783 -0.5783 -0.5334 -0.5334 -0.5334 -0.5334 -0.4780 -0.4780 -0.4136 -0.4136 -0.3646 -0.3646 -0.3537 -0.3537 -0.2584 -0.2584 -0.2245 -0.2245 -0.1316 -0.1316 -0.1072 -0.1072 3.5165 3.5165 3.5713 3.5713 4.2293 4.2293 4.2340 4.2340 8.2658 8.2658 8.3308 8.3308 9.0940 9.0940 9.3583 9.3583 10.9231 10.9231 10.9566 10.9566 12.2359 12.2359 12.5277 12.5277 12.6732 12.6732 12.7783 12.7783 13.3623 13.3623 k = 0.3008 0.5210 0.3094 ( 6858 PWs) bands (ev): -18.1586 -18.1586 -18.1585 -18.1585 -4.9153 -4.9153 -4.9079 -4.9079 -3.1141 -3.1141 -3.1021 -3.1021 -3.0372 -3.0372 -3.0275 -3.0275 -2.6454 -2.6454 -2.6317 -2.6317 -2.5708 -2.5708 -2.5691 -2.5691 -2.5290 -2.5290 -2.5101 -2.5101 -2.3851 -2.3851 -2.3846 -2.3846 -0.6122 -0.6122 -0.5776 -0.5776 -0.5353 -0.5353 -0.5334 -0.5334 -0.4762 -0.4762 -0.4153 -0.4153 -0.3637 -0.3637 -0.3514 -0.3514 -0.2575 -0.2575 -0.2251 -0.2251 -0.1330 -0.1330 -0.1083 -0.1083 3.4888 3.4888 3.5399 3.5399 4.2591 4.2591 4.2670 4.2670 8.2746 8.2746 8.3415 8.3415 9.1013 9.1013 9.3613 9.3613 10.9252 10.9252 10.9593 10.9593 12.1925 12.1925 12.5069 12.5069 12.7001 12.7001 12.7641 12.7641 13.3240 13.3240 k = 0.2927 0.5069 0.3094 ( 6856 PWs) bands (ev): -18.1587 -18.1587 -18.1585 -18.1585 -4.9150 -4.9150 -4.9077 -4.9077 -3.1131 -3.1131 -3.1026 -3.1026 -3.0362 -3.0362 -3.0290 -3.0290 -2.6458 -2.6458 -2.6307 -2.6307 -2.5733 -2.5733 -2.5732 -2.5732 -2.5233 -2.5233 -2.5092 -2.5092 -2.3854 -2.3854 -2.3827 -2.3827 -0.6125 -0.6125 -0.5768 -0.5768 -0.5376 -0.5376 -0.5333 -0.5333 -0.4741 -0.4741 -0.4172 -0.4172 -0.3625 -0.3625 -0.3487 -0.3487 -0.2563 -0.2563 -0.2260 -0.2260 -0.1348 -0.1348 -0.1096 -0.1096 3.4546 3.4546 3.5016 3.5016 4.2965 4.2965 4.3077 4.3077 8.2851 8.2851 8.3546 8.3546 9.1108 9.1108 9.3650 9.3650 10.9279 10.9279 10.9627 10.9627 12.1422 12.1422 12.4718 12.4718 12.7310 12.7310 12.7598 12.7598 13.2781 13.2781 k = 0.2846 0.4929 0.3094 ( 6852 PWs) bands (ev): -18.1587 -18.1587 -18.1586 -18.1586 -4.9146 -4.9146 -4.9075 -4.9075 -3.1118 -3.1118 -3.1032 -3.1032 -3.0349 -3.0349 -3.0308 -3.0308 -2.6463 -2.6463 -2.6295 -2.6295 -2.5773 -2.5773 -2.5759 -2.5759 -2.5176 -2.5176 -2.5082 -2.5082 -2.3864 -2.3864 -2.3799 -2.3799 -0.6128 -0.6128 -0.5758 -0.5758 -0.5402 -0.5402 -0.5332 -0.5332 -0.4717 -0.4717 -0.4192 -0.4192 -0.3612 -0.3612 -0.3458 -0.3458 -0.2548 -0.2548 -0.2272 -0.2272 -0.1369 -0.1369 -0.1111 -0.1111 3.4150 3.4150 3.4580 3.4580 4.3405 4.3405 4.3550 4.3550 8.2971 8.2971 8.3700 8.3700 9.1226 9.1226 9.3693 9.3693 10.9314 10.9314 10.9667 10.9667 12.0868 12.0868 12.4237 12.4237 12.7638 12.7638 12.7641 12.7641 13.2289 13.2289 k = 0.2764 0.4788 0.3094 ( 6856 PWs) bands (ev): -18.1588 -18.1588 -18.1586 -18.1586 -4.9142 -4.9142 -4.9073 -4.9073 -3.1103 -3.1103 -3.1038 -3.1038 -3.0336 -3.0336 -3.0329 -3.0329 -2.6468 -2.6468 -2.6281 -2.6281 -2.5812 -2.5812 -2.5788 -2.5788 -2.5117 -2.5117 -2.5071 -2.5071 -2.3875 -2.3875 -2.3768 -2.3768 -0.6132 -0.6132 -0.5746 -0.5746 -0.5428 -0.5428 -0.5330 -0.5330 -0.4692 -0.4692 -0.4213 -0.4213 -0.3597 -0.3597 -0.3428 -0.3428 -0.2531 -0.2531 -0.2286 -0.2286 -0.1394 -0.1394 -0.1128 -0.1128 3.3709 3.3709 3.4101 3.4101 4.3904 4.3904 4.4077 4.4077 8.3103 8.3103 8.3876 8.3876 9.1364 9.1364 9.3740 9.3740 10.9357 10.9357 10.9711 10.9711 12.0279 12.0279 12.3661 12.3661 12.7717 12.7717 12.7948 12.7948 13.1822 13.1822 k = 0.2683 0.4647 0.3094 ( 6850 PWs) bands (ev): -18.1589 -18.1589 -18.1587 -18.1587 -4.9137 -4.9137 -4.9071 -4.9071 -3.1087 -3.1087 -3.1043 -3.1043 -3.0352 -3.0352 -3.0323 -3.0323 -2.6474 -2.6474 -2.6265 -2.6265 -2.5849 -2.5849 -2.5818 -2.5818 -2.5059 -2.5059 -2.5058 -2.5058 -2.3887 -2.3887 -2.3734 -2.3734 -0.6138 -0.6138 -0.5736 -0.5736 -0.5453 -0.5453 -0.5327 -0.5327 -0.4666 -0.4666 -0.4233 -0.4233 -0.3580 -0.3580 -0.3398 -0.3398 -0.2511 -0.2511 -0.2303 -0.2303 -0.1421 -0.1421 -0.1145 -0.1145 3.3234 3.3234 3.3590 3.3590 4.4453 4.4453 4.4652 4.4652 8.3246 8.3246 8.4070 8.4070 9.1522 9.1522 9.3788 9.3788 10.9408 10.9408 10.9760 10.9760 11.9666 11.9666 12.3024 12.3024 12.7746 12.7746 12.8170 12.8170 13.1456 13.1456 k = 0.2602 0.4506 0.3094 ( 6840 PWs) bands (ev): -18.1589 -18.1589 -18.1588 -18.1588 -4.9131 -4.9131 -4.9067 -4.9067 -3.1070 -3.1070 -3.1049 -3.1049 -3.0376 -3.0376 -3.0310 -3.0310 -2.6479 -2.6479 -2.6246 -2.6246 -2.5885 -2.5885 -2.5847 -2.5847 -2.5047 -2.5047 -2.4999 -2.4999 -2.3899 -2.3899 -2.3698 -2.3698 -0.6144 -0.6144 -0.5727 -0.5727 -0.5474 -0.5474 -0.5322 -0.5322 -0.4639 -0.4639 -0.4254 -0.4254 -0.3562 -0.3562 -0.3367 -0.3367 -0.2490 -0.2490 -0.2324 -0.2324 -0.1452 -0.1452 -0.1164 -0.1164 3.2731 3.2731 3.3054 3.3054 4.5046 4.5046 4.5268 4.5268 8.3398 8.3398 8.4282 8.4282 9.1697 9.1697 9.3835 9.3835 10.9468 10.9468 10.9812 10.9812 11.9038 11.9038 12.2350 12.2350 12.7641 12.7641 12.8202 12.8202 13.1281 13.1281 k = 0.2520 0.4365 0.3094 ( 6840 PWs) bands (ev): -18.1590 -18.1590 -18.1589 -18.1589 -4.9124 -4.9124 -4.9064 -4.9064 -3.1053 -3.1053 -3.1051 -3.1051 -3.0402 -3.0402 -3.0298 -3.0298 -2.6484 -2.6484 -2.6226 -2.6226 -2.5919 -2.5919 -2.5874 -2.5874 -2.5035 -2.5035 -2.4940 -2.4940 -2.3910 -2.3910 -2.3661 -2.3661 -0.6151 -0.6151 -0.5724 -0.5724 -0.5488 -0.5488 -0.5316 -0.5316 -0.4613 -0.4613 -0.4273 -0.4273 -0.3542 -0.3542 -0.3338 -0.3338 -0.2466 -0.2466 -0.2347 -0.2347 -0.1485 -0.1485 -0.1182 -0.1182 3.2208 3.2208 3.2501 3.2501 4.5679 4.5679 4.5919 4.5919 8.3559 8.3559 8.4511 8.4511 9.1887 9.1887 9.3877 9.3877 10.9539 10.9539 10.9866 10.9866 11.8405 11.8405 12.1656 12.1656 12.7352 12.7352 12.7975 12.7975 13.1347 13.1347 k = 0.2439 0.4225 0.3094 ( 6838 PWs) bands (ev): -18.1592 -18.1592 -18.1590 -18.1590 -4.9117 -4.9117 -4.9059 -4.9059 -3.1057 -3.1057 -3.1032 -3.1032 -3.0429 -3.0429 -3.0288 -3.0288 -2.6488 -2.6488 -2.6205 -2.6205 -2.5952 -2.5952 -2.5900 -2.5900 -2.5024 -2.5024 -2.4883 -2.4883 -2.3921 -2.3921 -2.3623 -2.3623 -0.6159 -0.6159 -0.5730 -0.5730 -0.5491 -0.5491 -0.5308 -0.5308 -0.4588 -0.4588 -0.4291 -0.4291 -0.3521 -0.3521 -0.3311 -0.3311 -0.2440 -0.2440 -0.2373 -0.2373 -0.1519 -0.1519 -0.1201 -0.1201 3.1670 3.1670 3.1934 3.1934 4.6346 4.6346 4.6602 4.6602 8.3727 8.3727 8.4755 8.4755 9.2089 9.2089 9.3912 9.3912 10.9620 10.9620 10.9924 10.9924 11.7775 11.7775 12.0953 12.0953 12.6906 12.6906 12.7538 12.7538 13.1632 13.1632 k = 0.2358 0.4084 0.3094 ( 6840 PWs) bands (ev): -18.1593 -18.1593 -18.1592 -18.1592 -4.9109 -4.9109 -4.9055 -4.9055 -3.1059 -3.1059 -3.1012 -3.1012 -3.0455 -3.0455 -3.0281 -3.0281 -2.6491 -2.6491 -2.6182 -2.6182 -2.5983 -2.5983 -2.5922 -2.5922 -2.5012 -2.5012 -2.4827 -2.4827 -2.3930 -2.3930 -2.3585 -2.3585 -0.6167 -0.6167 -0.5746 -0.5746 -0.5481 -0.5481 -0.5298 -0.5298 -0.4564 -0.4564 -0.4308 -0.4308 -0.3499 -0.3499 -0.3286 -0.3286 -0.2414 -0.2414 -0.2402 -0.2402 -0.1556 -0.1556 -0.1220 -0.1220 3.1121 3.1121 3.1360 3.1360 4.7045 4.7045 4.7314 4.7314 8.3904 8.3904 8.5014 8.5014 9.2299 9.2299 9.3935 9.3935 10.9714 10.9714 10.9983 10.9983 11.7153 11.7153 12.0250 12.0250 12.6360 12.6360 12.6987 12.6987 13.2076 13.2076 k = 0.2276 0.3943 0.3094 ( 6836 PWs) bands (ev): -18.1594 -18.1594 -18.1593 -18.1593 -4.9101 -4.9101 -4.9049 -4.9049 -3.1059 -3.1059 -3.0993 -3.0993 -3.0481 -3.0481 -3.0277 -3.0277 -2.6492 -2.6492 -2.6158 -2.6158 -2.6013 -2.6013 -2.5942 -2.5942 -2.5000 -2.5000 -2.4773 -2.4773 -2.3937 -2.3937 -2.3548 -2.3548 -0.6177 -0.6177 -0.5770 -0.5770 -0.5461 -0.5461 -0.5286 -0.5286 -0.4542 -0.4542 -0.4324 -0.4324 -0.3476 -0.3476 -0.3262 -0.3262 -0.2433 -0.2433 -0.2386 -0.2386 -0.1594 -0.1594 -0.1239 -0.1239 3.0566 3.0566 3.0780 3.0780 4.7772 4.7772 4.8052 4.8052 8.4088 8.4088 8.5288 8.5288 9.2515 9.2515 9.3945 9.3945 10.9820 10.9820 11.0046 11.0046 11.6546 11.6546 11.9553 11.9553 12.5767 12.5767 12.6386 12.6386 13.2626 13.2626 k = 0.2195 0.3802 0.3094 ( 6828 PWs) bands (ev): -18.1596 -18.1596 -18.1595 -18.1595 -4.9091 -4.9091 -4.9044 -4.9044 -3.1058 -3.1058 -3.0974 -3.0974 -3.0507 -3.0507 -3.0277 -3.0277 -2.6491 -2.6491 -2.6134 -2.6134 -2.6041 -2.6041 -2.5958 -2.5958 -2.4987 -2.4987 -2.4723 -2.4723 -2.3940 -2.3940 -2.3512 -2.3512 -0.6187 -0.6187 -0.5800 -0.5800 -0.5432 -0.5432 -0.5272 -0.5272 -0.4521 -0.4521 -0.4338 -0.4338 -0.3452 -0.3452 -0.3241 -0.3241 -0.2466 -0.2466 -0.2359 -0.2359 -0.1634 -0.1634 -0.1258 -0.1258 3.0007 3.0007 3.0200 3.0200 4.8524 4.8524 4.8813 4.8813 8.4280 8.4280 8.5575 8.5575 9.2733 9.2733 9.3938 9.3938 10.9940 10.9940 11.0111 11.0111 11.5961 11.5961 11.8869 11.8869 12.5157 12.5157 12.5770 12.5770 13.3242 13.3242 k = 0.2114 0.3661 0.3094 ( 6840 PWs) bands (ev): -18.1597 -18.1597 -18.1596 -18.1596 -4.9082 -4.9082 -4.9037 -4.9037 -3.1055 -3.1055 -3.0956 -3.0956 -3.0530 -3.0530 -3.0280 -3.0280 -2.6489 -2.6489 -2.6113 -2.6113 -2.6066 -2.6066 -2.5971 -2.5971 -2.4974 -2.4974 -2.4677 -2.4677 -2.3938 -2.3938 -2.3479 -2.3479 -0.6198 -0.6198 -0.5833 -0.5833 -0.5398 -0.5398 -0.5255 -0.5255 -0.4502 -0.4502 -0.4350 -0.4350 -0.3428 -0.3428 -0.3222 -0.3222 -0.2501 -0.2501 -0.2333 -0.2333 -0.1673 -0.1673 -0.1277 -0.1277 2.9448 2.9448 2.9620 2.9620 4.9300 4.9300 4.9594 4.9594 8.4479 8.4479 8.5874 8.5874 9.2949 9.2949 9.3912 9.3912 11.0071 11.0071 11.0180 11.0180 11.5403 11.5403 11.8201 11.8201 12.4551 12.4551 12.5157 12.5157 13.3887 13.3887 k = 0.2033 0.3520 0.3094 ( 6844 PWs) bands (ev): -18.1599 -18.1599 -18.1598 -18.1598 -4.9072 -4.9072 -4.9030 -4.9030 -3.1050 -3.1050 -3.0941 -3.0941 -3.0552 -3.0552 -3.0288 -3.0288 -2.6484 -2.6484 -2.6110 -2.6110 -2.6070 -2.6070 -2.5980 -2.5980 -2.4960 -2.4960 -2.4636 -2.4636 -2.3931 -2.3931 -2.3447 -2.3447 -0.6209 -0.6209 -0.5868 -0.5868 -0.5359 -0.5359 -0.5236 -0.5236 -0.4485 -0.4485 -0.4361 -0.4361 -0.3403 -0.3403 -0.3205 -0.3205 -0.2536 -0.2536 -0.2308 -0.2308 -0.1712 -0.1712 -0.1297 -0.1297 2.8891 2.8891 2.9044 2.9044 5.0097 5.0097 5.0395 5.0395 8.4686 8.4686 8.6185 8.6185 9.3162 9.3162 9.3867 9.3867 11.0211 11.0211 11.0252 11.0252 11.4880 11.4880 11.7552 11.7552 12.3960 12.3960 12.4555 12.4555 13.4514 13.4514 k = 0.1951 0.3380 0.3094 ( 6848 PWs) bands (ev): -18.1600 -18.1600 -18.1600 -18.1600 -4.9061 -4.9061 -4.9023 -4.9023 -3.1044 -3.1044 -3.0927 -3.0927 -3.0571 -3.0571 -3.0299 -3.0299 -2.6477 -2.6477 -2.6130 -2.6130 -2.6051 -2.6051 -2.5985 -2.5985 -2.4945 -2.4945 -2.4600 -2.4600 -2.3918 -2.3918 -2.3417 -2.3417 -0.6220 -0.6220 -0.5905 -0.5905 -0.5316 -0.5316 -0.5215 -0.5215 -0.4469 -0.4469 -0.4371 -0.4371 -0.3377 -0.3377 -0.3189 -0.3189 -0.2571 -0.2571 -0.2286 -0.2286 -0.1750 -0.1750 -0.1317 -0.1317 2.8338 2.8338 2.8474 2.8474 5.0912 5.0912 5.1212 5.1212 8.4900 8.4900 8.6506 8.6506 9.3368 9.3368 9.3802 9.3802 11.0328 11.0328 11.0351 11.0351 11.4402 11.4402 11.6926 11.6926 12.3393 12.3393 12.3969 12.3969 13.4765 13.4765 k = 0.1870 0.3239 0.3094 ( 6852 PWs) bands (ev): -18.1602 -18.1602 -18.1601 -18.1601 -4.9050 -4.9050 -4.9016 -4.9016 -3.1036 -3.1036 -3.0916 -3.0916 -3.0586 -3.0586 -3.0315 -3.0315 -2.6468 -2.6468 -2.6153 -2.6153 -2.6028 -2.6028 -2.5987 -2.5987 -2.4928 -2.4928 -2.4570 -2.4570 -2.3898 -2.3898 -2.3391 -2.3391 -0.6232 -0.6232 -0.5941 -0.5941 -0.5271 -0.5271 -0.5190 -0.5190 -0.4456 -0.4456 -0.4379 -0.4379 -0.3352 -0.3352 -0.3176 -0.3176 -0.2606 -0.2606 -0.2269 -0.2269 -0.1786 -0.1786 -0.1338 -0.1338 2.7792 2.7792 2.7912 2.7912 5.1744 5.1744 5.2043 5.2043 8.5121 8.5121 8.6836 8.6836 9.3566 9.3566 9.3721 9.3721 11.0405 11.0405 11.0479 11.0479 11.3983 11.3983 11.6326 11.6326 12.2852 12.2852 12.3403 12.3403 13.4567 13.4567 k = 0.1789 0.3098 0.3094 ( 6844 PWs) bands (ev): -18.1604 -18.1604 -18.1603 -18.1603 -4.9039 -4.9039 -4.9008 -4.9008 -3.1026 -3.1026 -3.0907 -3.0907 -3.0599 -3.0599 -3.0334 -3.0334 -2.6458 -2.6458 -2.6176 -2.6176 -2.6004 -2.6004 -2.5985 -2.5985 -2.4909 -2.4909 -2.4546 -2.4546 -2.3872 -2.3872 -2.3367 -2.3367 -0.6243 -0.6243 -0.5978 -0.5978 -0.5224 -0.5224 -0.5164 -0.5164 -0.4443 -0.4443 -0.4385 -0.4385 -0.3327 -0.3327 -0.3164 -0.3164 -0.2639 -0.2639 -0.2257 -0.2257 -0.1818 -0.1818 -0.1361 -0.1361 2.7255 2.7255 2.7360 2.7360 5.2589 5.2589 5.2886 5.2886 8.5348 8.5348 8.7171 8.7171 9.3626 9.3626 9.3755 9.3755 11.0481 11.0481 11.0570 11.0570 11.3645 11.3645 11.5754 11.5754 12.2342 12.2342 12.2855 12.2855 13.4193 13.4193 k = 0.1707 0.2957 0.3094 ( 6850 PWs) bands (ev): -18.1606 -18.1606 -18.1605 -18.1605 -4.9027 -4.9027 -4.8999 -4.8999 -3.1015 -3.1015 -3.0902 -3.0902 -3.0608 -3.0608 -3.0356 -3.0356 -2.6447 -2.6447 -2.6197 -2.6197 -2.5981 -2.5981 -2.5980 -2.5980 -2.4888 -2.4888 -2.4526 -2.4526 -2.3841 -2.3841 -2.3346 -2.3346 -0.6255 -0.6255 -0.6014 -0.6014 -0.5176 -0.5176 -0.5135 -0.5135 -0.4432 -0.4432 -0.4390 -0.4390 -0.3302 -0.3302 -0.3154 -0.3154 -0.2670 -0.2670 -0.2253 -0.2253 -0.1845 -0.1845 -0.1384 -0.1384 2.6728 2.6728 2.6819 2.6819 5.3446 5.3446 5.3738 5.3738 8.5582 8.5582 8.7509 8.7509 9.3523 9.3523 9.3934 9.3934 11.0549 11.0549 11.0595 11.0595 11.3415 11.3415 11.5214 11.5214 12.1862 12.1862 12.2325 12.2325 13.3734 13.3734 k = 0.1626 0.2816 0.3094 ( 6854 PWs) bands (ev): -18.1608 -18.1608 -18.1607 -18.1607 -4.9015 -4.9015 -4.8991 -4.8991 -3.1004 -3.1004 -3.0899 -3.0899 -3.0615 -3.0615 -3.0381 -3.0381 -2.6436 -2.6436 -2.6217 -2.6217 -2.5972 -2.5972 -2.5960 -2.5960 -2.4865 -2.4865 -2.4510 -2.4510 -2.3805 -2.3805 -2.3328 -2.3328 -0.6266 -0.6266 -0.6049 -0.6049 -0.5127 -0.5127 -0.5104 -0.5104 -0.4422 -0.4422 -0.4393 -0.4393 -0.3278 -0.3278 -0.3144 -0.3144 -0.2699 -0.2699 -0.2258 -0.2258 -0.1866 -0.1866 -0.1410 -0.1410 2.6213 2.6213 2.6292 2.6292 5.4312 5.4312 5.4597 5.4597 8.5822 8.5822 8.7845 8.7845 9.3418 9.3418 9.4104 9.4104 11.0523 11.0523 11.0601 11.0601 11.3319 11.3319 11.4713 11.4713 12.1414 12.1414 12.1810 12.1810 13.3235 13.3235 k = 0.1545 0.2676 0.3094 ( 6854 PWs) bands (ev): -18.1610 -18.1610 -18.1609 -18.1609 -4.9004 -4.9004 -4.8982 -4.8982 -3.0991 -3.0991 -3.0899 -3.0899 -3.0620 -3.0620 -3.0408 -3.0408 -2.6424 -2.6424 -2.6234 -2.6234 -2.5961 -2.5961 -2.5940 -2.5940 -2.4839 -2.4839 -2.4497 -2.4497 -2.3766 -2.3766 -2.3313 -2.3313 -0.6277 -0.6277 -0.6083 -0.6083 -0.5078 -0.5078 -0.5071 -0.5071 -0.4413 -0.4413 -0.4394 -0.4394 -0.3255 -0.3255 -0.3136 -0.3136 -0.2724 -0.2724 -0.2271 -0.2271 -0.1881 -0.1881 -0.1437 -0.1437 2.5711 2.5711 2.5780 2.5780 5.5182 5.5182 5.5459 5.5459 8.6067 8.6067 8.8175 8.8175 9.3322 9.3322 9.4266 9.4266 11.0345 11.0345 11.0619 11.0619 11.3356 11.3356 11.4262 11.4262 12.0996 12.0996 12.1306 12.1306 13.2724 13.2724 k = 0.1463 0.2535 0.3094 ( 6860 PWs) bands (ev): -18.1612 -18.1612 -18.1611 -18.1611 -4.8992 -4.8992 -4.8973 -4.8973 -3.0978 -3.0978 -3.0900 -3.0900 -3.0623 -3.0623 -3.0437 -3.0437 -2.6413 -2.6413 -2.6250 -2.6250 -2.5949 -2.5949 -2.5922 -2.5922 -2.4811 -2.4811 -2.4486 -2.4486 -2.3724 -2.3724 -2.3301 -2.3301 -0.6288 -0.6288 -0.6116 -0.6116 -0.5037 -0.5037 -0.5029 -0.5029 -0.4404 -0.4404 -0.4394 -0.4394 -0.3233 -0.3233 -0.3128 -0.3128 -0.2746 -0.2746 -0.2293 -0.2293 -0.1890 -0.1890 -0.1466 -0.1466 2.5225 2.5225 2.5283 2.5283 5.6055 5.6055 5.6321 5.6321 8.6318 8.6318 8.8492 8.8492 9.3244 9.3244 9.4421 9.4421 11.0080 11.0080 11.0581 11.0581 11.3500 11.3500 11.3877 11.3877 12.0605 12.0605 12.0809 12.0809 13.2217 13.2217 k = 0.1382 0.2394 0.3094 ( 6862 PWs) bands (ev): -18.1613 -18.1613 -18.1613 -18.1613 -4.8980 -4.8980 -4.8964 -4.8964 -3.0964 -3.0964 -3.0901 -3.0901 -3.0626 -3.0626 -3.0467 -3.0467 -2.6402 -2.6402 -2.6264 -2.6264 -2.5935 -2.5935 -2.5905 -2.5905 -2.4779 -2.4779 -2.4476 -2.4476 -2.3682 -2.3682 -2.3292 -2.3292 -0.6298 -0.6298 -0.6148 -0.6148 -0.5001 -0.5001 -0.4982 -0.4982 -0.4395 -0.4395 -0.4391 -0.4391 -0.3212 -0.3212 -0.3120 -0.3120 -0.2765 -0.2765 -0.2322 -0.2322 -0.1894 -0.1894 -0.1497 -0.1497 2.4756 2.4756 2.4805 2.4805 5.6927 5.6927 5.7179 5.7179 8.6575 8.6575 8.8788 8.8788 9.3197 9.3197 9.4571 9.4571 10.9752 10.9752 11.0458 11.0458 11.3578 11.3578 11.3716 11.3716 12.0238 12.0238 12.0314 12.0314 13.1732 13.1732 k = 0.1301 0.2253 0.3094 ( 6860 PWs) bands (ev): -18.1615 -18.1615 -18.1615 -18.1615 -4.8969 -4.8969 -4.8955 -4.8955 -3.0950 -3.0950 -3.0903 -3.0903 -3.0629 -3.0629 -3.0498 -3.0498 -2.6391 -2.6391 -2.6276 -2.6276 -2.5921 -2.5921 -2.5891 -2.5891 -2.4745 -2.4745 -2.4465 -2.4465 -2.3639 -2.3639 -2.3286 -2.3286 -0.6308 -0.6308 -0.6178 -0.6178 -0.4964 -0.4964 -0.4937 -0.4937 -0.4387 -0.4387 -0.4385 -0.4385 -0.3192 -0.3192 -0.3113 -0.3113 -0.2779 -0.2779 -0.2357 -0.2357 -0.1897 -0.1897 -0.1531 -0.1531 2.4305 2.4305 2.4346 2.4346 5.7792 5.7792 5.8030 5.8030 8.6840 8.6840 8.9055 8.9055 9.3192 9.3192 9.4718 9.4718 10.9379 10.9379 11.0225 11.0225 11.3382 11.3382 11.3972 11.3972 11.9817 11.9817 11.9891 11.9891 13.1283 13.1283 k = 0.1220 0.2112 0.3094 ( 6868 PWs) bands (ev): -18.1617 -18.1617 -18.1617 -18.1617 -4.8958 -4.8958 -4.8946 -4.8946 -3.0937 -3.0937 -3.0904 -3.0904 -3.0633 -3.0633 -3.0529 -3.0529 -2.6380 -2.6380 -2.6286 -2.6286 -2.5907 -2.5907 -2.5878 -2.5878 -2.4708 -2.4708 -2.4455 -2.4455 -2.3597 -2.3597 -2.3282 -2.3282 -0.6318 -0.6318 -0.6206 -0.6206 -0.4928 -0.4928 -0.4894 -0.4894 -0.4380 -0.4380 -0.4375 -0.4375 -0.3173 -0.3173 -0.3106 -0.3106 -0.2790 -0.2790 -0.2394 -0.2394 -0.1898 -0.1898 -0.1567 -0.1567 2.3873 2.3873 2.3907 2.3907 5.8648 5.8648 5.8868 5.8868 8.7113 8.7113 8.9289 8.9289 9.3239 9.3239 9.4863 9.4863 10.8970 10.8970 10.9873 10.9873 11.3290 11.3290 11.4245 11.4245 11.9315 11.9315 11.9560 11.9560 13.0881 13.0881 k = 0.1138 0.1971 0.3094 ( 6886 PWs) bands (ev): -18.1619 -18.1619 -18.1619 -18.1619 -4.8947 -4.8947 -4.8937 -4.8937 -3.0924 -3.0924 -3.0905 -3.0905 -3.0638 -3.0638 -3.0559 -3.0559 -2.6370 -2.6370 -2.6294 -2.6294 -2.5894 -2.5894 -2.5868 -2.5868 -2.4669 -2.4669 -2.4444 -2.4444 -2.3556 -2.3556 -2.3279 -2.3279 -0.6327 -0.6327 -0.6233 -0.6233 -0.4891 -0.4891 -0.4854 -0.4854 -0.4372 -0.4372 -0.4363 -0.4363 -0.3155 -0.3155 -0.3099 -0.3099 -0.2797 -0.2797 -0.2434 -0.2434 -0.1900 -0.1900 -0.1604 -0.1604 2.3462 2.3462 2.3489 2.3489 5.9488 5.9488 5.9689 5.9689 8.7396 8.7396 8.9487 8.9487 9.3347 9.3347 9.5009 9.5009 10.8527 10.8527 10.9409 10.9409 11.3283 11.3283 11.4517 11.4517 11.8812 11.8812 11.9240 11.9240 13.0535 13.0535 k = 0.1057 0.1831 0.3094 ( 6894 PWs) bands (ev): -18.1621 -18.1621 -18.1621 -18.1621 -4.8936 -4.8936 -4.8928 -4.8928 -3.0912 -3.0912 -3.0904 -3.0904 -3.0645 -3.0645 -3.0588 -3.0588 -2.6359 -2.6359 -2.6299 -2.6299 -2.5883 -2.5883 -2.5860 -2.5860 -2.4628 -2.4628 -2.4432 -2.4432 -2.3517 -2.3517 -2.3279 -2.3279 -0.6336 -0.6336 -0.6258 -0.6258 -0.4856 -0.4856 -0.4818 -0.4818 -0.4360 -0.4360 -0.4349 -0.4349 -0.3137 -0.3137 -0.3091 -0.3091 -0.2801 -0.2801 -0.2474 -0.2474 -0.1903 -0.1903 -0.1644 -0.1644 2.3073 2.3073 2.3095 2.3095 6.0308 6.0308 6.0489 6.0489 8.7693 8.7693 8.9653 8.9653 9.3514 9.3514 9.5157 9.5157 10.8049 10.8049 10.8852 10.8852 11.3339 11.3339 11.4772 11.4772 11.8314 11.8314 11.8931 11.8931 13.0242 13.0242 k = 0.0976 0.1690 0.3094 ( 6906 PWs) bands (ev): -18.1623 -18.1623 -18.1622 -18.1622 -4.8926 -4.8926 -4.8920 -4.8920 -3.0903 -3.0903 -3.0900 -3.0900 -3.0653 -3.0653 -3.0616 -3.0616 -2.6349 -2.6349 -2.6302 -2.6302 -2.5872 -2.5872 -2.5853 -2.5853 -2.4586 -2.4586 -2.4418 -2.4418 -2.3481 -2.3481 -2.3280 -2.3280 -0.6344 -0.6344 -0.6281 -0.6281 -0.4822 -0.4822 -0.4786 -0.4786 -0.4346 -0.4346 -0.4333 -0.4333 -0.3120 -0.3120 -0.3083 -0.3083 -0.2803 -0.2803 -0.2515 -0.2515 -0.1908 -0.1908 -0.1684 -0.1684 2.2708 2.2708 2.2725 2.2725 6.1101 6.1101 6.1260 6.1260 8.8005 8.8005 8.9795 8.9795 9.3735 9.3735 9.5306 9.5306 10.7529 10.7529 10.8215 10.8215 11.3435 11.3435 11.4996 11.4996 11.7838 11.7838 11.8631 11.8631 12.9987 12.9987 k = 0.0894 0.1549 0.3094 ( 6910 PWs) bands (ev): -18.1624 -18.1624 -18.1624 -18.1624 -4.8917 -4.8917 -4.8912 -4.8912 -3.0900 -3.0900 -3.0889 -3.0889 -3.0663 -3.0663 -3.0642 -3.0642 -2.6340 -2.6340 -2.6304 -2.6304 -2.5864 -2.5864 -2.5848 -2.5848 -2.4544 -2.4544 -2.4405 -2.4405 -2.3447 -2.3447 -2.3282 -2.3282 -0.6352 -0.6352 -0.6302 -0.6302 -0.4791 -0.4791 -0.4758 -0.4758 -0.4329 -0.4329 -0.4316 -0.4316 -0.3102 -0.3102 -0.3074 -0.3074 -0.2802 -0.2802 -0.2555 -0.2555 -0.1914 -0.1914 -0.1726 -0.1726 2.2367 2.2367 2.2380 2.2380 6.1862 6.1862 6.1999 6.1999 8.8334 8.8334 8.9925 8.9925 9.4001 9.4001 9.5457 9.5457 10.6963 10.6963 10.7512 10.7512 11.3558 11.3558 11.5171 11.5171 11.7409 11.7409 11.8345 11.8345 12.9737 12.9737 k = 0.0813 0.1408 0.3094 ( 6902 PWs) bands (ev): -18.1626 -18.1626 -18.1626 -18.1626 -4.8908 -4.8908 -4.8904 -4.8904 -3.0895 -3.0895 -3.0880 -3.0880 -3.0674 -3.0674 -3.0666 -3.0666 -2.6330 -2.6330 -2.6303 -2.6303 -2.5857 -2.5857 -2.5845 -2.5845 -2.4503 -2.4503 -2.4390 -2.4390 -2.3417 -2.3417 -2.3285 -2.3285 -0.6359 -0.6359 -0.6321 -0.6321 -0.4762 -0.4762 -0.4735 -0.4735 -0.4310 -0.4310 -0.4296 -0.4296 -0.3084 -0.3084 -0.3064 -0.3064 -0.2801 -0.2801 -0.2594 -0.2594 -0.1923 -0.1923 -0.1768 -0.1768 2.2051 2.2051 2.2061 2.2061 6.2584 6.2584 6.2698 6.2698 8.8684 8.8684 9.0058 9.0058 9.4301 9.4301 9.5611 9.5611 10.6344 10.6344 10.6754 10.6754 11.3696 11.3696 11.5272 11.5272 11.7066 11.7066 11.8077 11.8077 12.9458 12.9458 k = 0.0732 0.1267 0.3094 ( 6908 PWs) bands (ev): -18.1627 -18.1627 -18.1627 -18.1627 -4.8900 -4.8900 -4.8897 -4.8897 -3.0890 -3.0890 -3.0872 -3.0872 -3.0687 -3.0687 -3.0687 -3.0687 -2.6321 -2.6321 -2.6301 -2.6301 -2.5852 -2.5852 -2.5843 -2.5843 -2.4462 -2.4462 -2.4374 -2.4374 -2.3389 -2.3389 -2.3288 -2.3288 -0.6367 -0.6367 -0.6338 -0.6338 -0.4737 -0.4737 -0.4715 -0.4715 -0.4289 -0.4289 -0.4276 -0.4276 -0.3066 -0.3066 -0.3052 -0.3052 -0.2800 -0.2800 -0.2631 -0.2631 -0.1933 -0.1933 -0.1811 -0.1811 2.1762 2.1762 2.1769 2.1769 6.3261 6.3261 6.3352 6.3352 8.9055 8.9055 9.0204 9.0204 9.4626 9.4626 9.5767 9.5767 10.5673 10.5673 10.5949 10.5949 11.3840 11.3840 11.5269 11.5269 11.6852 11.6852 11.7835 11.7835 12.9118 12.9118 k = 0.0650 0.1127 0.3094 ( 6904 PWs) bands (ev): -18.1629 -18.1629 -18.1628 -18.1628 -4.8892 -4.8892 -4.8890 -4.8890 -3.0883 -3.0883 -3.0864 -3.0864 -3.0707 -3.0707 -3.0700 -3.0700 -2.6312 -2.6312 -2.6298 -2.6298 -2.5849 -2.5849 -2.5842 -2.5842 -2.4425 -2.4425 -2.4359 -2.4359 -2.3366 -2.3366 -2.3290 -2.3290 -0.6373 -0.6373 -0.6352 -0.6352 -0.4715 -0.4715 -0.4699 -0.4699 -0.4267 -0.4267 -0.4255 -0.4255 -0.3046 -0.3046 -0.3039 -0.3039 -0.2799 -0.2799 -0.2666 -0.2666 -0.1945 -0.1945 -0.1851 -0.1851 2.1501 2.1501 2.1506 2.1506 6.3885 6.3885 6.3955 6.3955 8.9445 8.9445 9.0371 9.0371 9.4966 9.4966 9.5927 9.5927 10.4950 10.4950 10.5111 10.5111 11.3982 11.3982 11.5161 11.5161 11.6780 11.6780 11.7627 11.7627 12.8717 12.8717 k = 0.0569 0.0986 0.3094 ( 6904 PWs) bands (ev): -18.1630 -18.1630 -18.1630 -18.1630 -4.8885 -4.8885 -4.8884 -4.8884 -3.0876 -3.0876 -3.0858 -3.0858 -3.0724 -3.0724 -3.0715 -3.0715 -2.6303 -2.6303 -2.6294 -2.6294 -2.5847 -2.5847 -2.5842 -2.5842 -2.4390 -2.4390 -2.4343 -2.4343 -2.3346 -2.3346 -2.3292 -2.3292 -0.6379 -0.6379 -0.6365 -0.6365 -0.4697 -0.4697 -0.4685 -0.4685 -0.4244 -0.4244 -0.4234 -0.4234 -0.3026 -0.3026 -0.3024 -0.3024 -0.2800 -0.2800 -0.2700 -0.2700 -0.1958 -0.1958 -0.1890 -0.1890 2.1268 2.1268 2.1271 2.1271 6.4451 6.4451 6.4502 6.4502 8.9851 8.9851 9.0563 9.0563 9.5318 9.5318 9.6094 9.6094 10.4182 10.4182 10.4252 10.4252 11.4113 11.4113 11.4995 11.4995 11.6810 11.6810 11.7461 11.7461 12.8271 12.8271 k = 0.0488 0.0845 0.3094 ( 6900 PWs) bands (ev): -18.1631 -18.1631 -18.1631 -18.1631 -4.8880 -4.8880 -4.8879 -4.8879 -3.0868 -3.0868 -3.0852 -3.0852 -3.0740 -3.0740 -3.0730 -3.0730 -2.6296 -2.6296 -2.6290 -2.6290 -2.5846 -2.5846 -2.5843 -2.5843 -2.4359 -2.4359 -2.4328 -2.4328 -2.3329 -2.3329 -2.3294 -2.3294 -0.6385 -0.6385 -0.6376 -0.6376 -0.4683 -0.4683 -0.4675 -0.4675 -0.4222 -0.4222 -0.4214 -0.4214 -0.3008 -0.3008 -0.3006 -0.3006 -0.2802 -0.2802 -0.2731 -0.2731 -0.1973 -0.1973 -0.1926 -0.1926 2.1064 2.1064 2.1067 2.1067 6.4952 6.4952 6.4987 6.4987 9.0265 9.0265 9.0779 9.0779 9.5678 9.5678 9.6272 9.6272 10.3381 10.3381 10.3387 10.3387 11.4225 11.4225 11.4824 11.4824 11.6894 11.6894 11.7343 11.7343 12.7809 12.7809 k = 0.0407 0.0704 0.3094 ( 6896 PWs) bands (ev): -18.1632 -18.1632 -18.1632 -18.1632 -4.8874 -4.8874 -4.8874 -4.8874 -3.0859 -3.0859 -3.0847 -3.0847 -3.0754 -3.0754 -3.0744 -3.0744 -2.6289 -2.6289 -2.6286 -2.6286 -2.5846 -2.5846 -2.5844 -2.5844 -2.4333 -2.4333 -2.4314 -2.4314 -2.3316 -2.3316 -2.3295 -2.3295 -0.6390 -0.6390 -0.6385 -0.6385 -0.4671 -0.4671 -0.4666 -0.4666 -0.4201 -0.4201 -0.4196 -0.4196 -0.2990 -0.2990 -0.2985 -0.2985 -0.2807 -0.2807 -0.2760 -0.2760 -0.1987 -0.1987 -0.1958 -0.1958 2.0891 2.0891 2.0892 2.0892 6.5384 6.5384 6.5406 6.5406 9.0673 9.0673 9.1014 9.1014 9.6047 9.6047 9.6468 9.6468 10.2533 10.2533 10.2564 10.2564 11.4312 11.4312 11.4675 11.4675 11.6999 11.6999 11.7275 11.7275 12.7361 12.7361 k = 0.0325 0.0563 0.3094 ( 6888 PWs) bands (ev): -18.1632 -18.1632 -18.1632 -18.1632 -4.8870 -4.8870 -4.8870 -4.8870 -3.0849 -3.0849 -3.0841 -3.0841 -3.0766 -3.0766 -3.0759 -3.0759 -2.6283 -2.6283 -2.6281 -2.6281 -2.5846 -2.5846 -2.5845 -2.5845 -2.4311 -2.4311 -2.4301 -2.4301 -2.3306 -2.3306 -2.3295 -2.3295 -0.6395 -0.6395 -0.6392 -0.6392 -0.4662 -0.4662 -0.4659 -0.4659 -0.4183 -0.4183 -0.4180 -0.4180 -0.2969 -0.2969 -0.2964 -0.2964 -0.2815 -0.2815 -0.2787 -0.2787 -0.2001 -0.2001 -0.1985 -0.1985 2.0748 2.0748 2.0749 2.0749 6.5743 6.5743 6.5754 6.5754 9.1056 9.1056 9.1254 9.1254 9.6425 9.6425 9.6693 9.6693 10.1707 10.1707 10.1752 10.1752 11.4369 11.4369 11.4561 11.4561 11.7106 11.7106 11.7252 11.7252 12.6951 12.6951 k = 0.0244 0.0422 0.3094 ( 6876 PWs) bands (ev): -18.1633 -18.1633 -18.1633 -18.1633 -4.8867 -4.8867 -4.8867 -4.8867 -3.0839 -3.0839 -3.0834 -3.0834 -3.0777 -3.0777 -3.0773 -3.0773 -2.6278 -2.6278 -2.6277 -2.6277 -2.5847 -2.5847 -2.5846 -2.5846 -2.4295 -2.4295 -2.4290 -2.4290 -2.3299 -2.3299 -2.3294 -2.3294 -0.6398 -0.6398 -0.6397 -0.6397 -0.4655 -0.4655 -0.4654 -0.4654 -0.4169 -0.4169 -0.4167 -0.4167 -0.2948 -0.2948 -0.2943 -0.2943 -0.2826 -0.2826 -0.2812 -0.2812 -0.2013 -0.2013 -0.2007 -0.2007 2.0636 2.0636 2.0637 2.0637 6.6025 6.6025 6.6030 6.6030 9.1390 9.1390 9.1483 9.1483 9.6815 9.6815 9.6958 9.6958 10.0932 10.0932 10.0971 10.0971 11.4400 11.4400 11.4482 11.4482 11.7201 11.7201 11.7264 11.7264 12.6603 12.6603 k = 0.0163 0.0282 0.3094 ( 6870 PWs) bands (ev): -18.1633 -18.1633 -18.1633 -18.1633 -4.8865 -4.8865 -4.8865 -4.8865 -3.0829 -3.0829 -3.0827 -3.0827 -3.0788 -3.0788 -3.0786 -3.0786 -2.6275 -2.6275 -2.6274 -2.6274 -2.5847 -2.5847 -2.5847 -2.5847 -2.4283 -2.4283 -2.4282 -2.4282 -2.3294 -2.3294 -2.3293 -2.3293 -0.6401 -0.6401 -0.6400 -0.6400 -0.4651 -0.4651 -0.4650 -0.4650 -0.4158 -0.4158 -0.4157 -0.4157 -0.2925 -0.2925 -0.2922 -0.2922 -0.2841 -0.2841 -0.2836 -0.2836 -0.2024 -0.2024 -0.2022 -0.2022 2.0556 2.0556 2.0556 2.0556 6.6227 6.6227 6.6228 6.6228 9.1647 9.1647 9.1678 9.1678 9.7206 9.7206 9.7261 9.7261 10.0241 10.0241 10.0263 10.0263 11.4409 11.4409 11.4434 11.4434 11.7274 11.7274 11.7293 11.7293 12.6338 12.6338 k = 0.0081 0.0141 0.3094 ( 6878 PWs) bands (ev): -18.1634 -18.1634 -18.1634 -18.1634 -4.8863 -4.8863 -4.8863 -4.8863 -3.0819 -3.0819 -3.0819 -3.0819 -3.0799 -3.0799 -3.0798 -3.0798 -2.6273 -2.6273 -2.6272 -2.6272 -2.5848 -2.5848 -2.5848 -2.5848 -2.4276 -2.4276 -2.4276 -2.4276 -2.3292 -2.3292 -2.3292 -2.3292 -0.6403 -0.6403 -0.6402 -0.6402 -0.4649 -0.4649 -0.4648 -0.4648 -0.4151 -0.4151 -0.4151 -0.4151 -0.2902 -0.2902 -0.2902 -0.2902 -0.2859 -0.2859 -0.2858 -0.2858 -0.2031 -0.2031 -0.2030 -0.2030 2.0508 2.0508 2.0508 2.0508 6.6348 6.6348 6.6349 6.6349 9.1808 9.1808 9.1812 9.1812 9.7554 9.7554 9.7563 9.7563 9.9699 9.9699 9.9704 9.9704 11.4408 11.4408 11.4411 11.4411 11.7320 11.7320 11.7322 11.7322 12.6171 12.6171 k = 0.0000 0.0000 0.3094 ( 6886 PWs) bands (ev): -18.1634 -18.1634 -18.1634 -18.1634 -4.8863 -4.8863 -4.8863 -4.8863 -3.0810 -3.0810 -3.0810 -3.0810 -3.0808 -3.0808 -3.0808 -3.0808 -2.6272 -2.6272 -2.6272 -2.6272 -2.5848 -2.5848 -2.5848 -2.5848 -2.4274 -2.4274 -2.4274 -2.4274 -2.3292 -2.3292 -2.3291 -2.3291 -0.6404 -0.6404 -0.6403 -0.6403 -0.4648 -0.4648 -0.4647 -0.4647 -0.4149 -0.4149 -0.4149 -0.4149 -0.2883 -0.2883 -0.2883 -0.2883 -0.2878 -0.2878 -0.2877 -0.2877 -0.2033 -0.2033 -0.2033 -0.2033 2.0491 2.0491 2.0492 2.0492 6.6389 6.6389 6.6389 6.6389 9.1860 9.1860 9.1861 9.1861 9.7714 9.7714 9.7714 9.7714 9.9468 9.9468 9.9469 9.9469 11.4405 11.4405 11.4406 11.4406 11.7334 11.7334 11.7335 11.7335 12.6114 12.6114 k = 0.5000 0.2887 0.3094 ( 6836 PWs) bands (ev): -18.1590 -18.1590 -18.1590 -18.1590 -4.9096 -4.9096 -4.9096 -4.9096 -3.0782 -3.0782 -3.0782 -3.0782 -3.0653 -3.0653 -3.0653 -3.0653 -2.6302 -2.6302 -2.6302 -2.6302 -2.5867 -2.5867 -2.5866 -2.5866 -2.5151 -2.5151 -2.5151 -2.5151 -2.3666 -2.3666 -2.3666 -2.3666 -0.6026 -0.6026 -0.6025 -0.6025 -0.5269 -0.5269 -0.5269 -0.5269 -0.4661 -0.4661 -0.4661 -0.4661 -0.3089 -0.3089 -0.3089 -0.3089 -0.2117 -0.2117 -0.2116 -0.2116 -0.1798 -0.1798 -0.1797 -0.1797 3.2915 3.2915 3.2915 3.2915 4.4402 4.4402 4.4402 4.4402 8.8429 8.8429 8.8430 8.8430 9.2915 9.2915 9.2915 9.2915 10.7350 10.7350 10.7350 10.7350 11.2625 11.2625 11.2626 11.2626 12.9791 12.9791 12.9792 12.9792 13.3221 13.3221 k = 0.5000 0.2887 0.2931 ( 6836 PWs) bands (ev): -18.1602 -18.1602 -18.1578 -18.1578 -4.9129 -4.9129 -4.9064 -4.9064 -3.0869 -3.0869 -3.0741 -3.0741 -3.0700 -3.0700 -3.0559 -3.0559 -2.6320 -2.6320 -2.6282 -2.6282 -2.5896 -2.5896 -2.5836 -2.5836 -2.5171 -2.5171 -2.5131 -2.5131 -2.3729 -2.3729 -2.3605 -2.3605 -0.6029 -0.6029 -0.6020 -0.6020 -0.5282 -0.5282 -0.5258 -0.5258 -0.4689 -0.4689 -0.4632 -0.4632 -0.3144 -0.3144 -0.3036 -0.3036 -0.2123 -0.2123 -0.2110 -0.2110 -0.1826 -0.1826 -0.1768 -0.1768 3.2822 3.2822 3.3013 3.3013 4.3863 4.3863 4.4948 4.4948 8.8184 8.8184 8.8637 8.8637 9.2379 9.2379 9.3445 9.3445 10.6199 10.6199 10.8578 10.8578 11.1850 11.1850 11.3440 11.3440 12.9444 12.9444 13.0147 13.0147 13.2733 13.2733 k = 0.5000 0.2887 0.2768 ( 6832 PWs) bands (ev): -18.1614 -18.1614 -18.1566 -18.1566 -4.9162 -4.9162 -4.9032 -4.9032 -3.0979 -3.0979 -3.0746 -3.0746 -3.0697 -3.0697 -3.0442 -3.0442 -2.6336 -2.6336 -2.6262 -2.6262 -2.5925 -2.5925 -2.5805 -2.5805 -2.5190 -2.5190 -2.5112 -2.5112 -2.3792 -2.3792 -2.3545 -2.3545 -0.6032 -0.6032 -0.6014 -0.6014 -0.5296 -0.5296 -0.5247 -0.5247 -0.4717 -0.4717 -0.4603 -0.4603 -0.3200 -0.3200 -0.2985 -0.2985 -0.2129 -0.2129 -0.2102 -0.2102 -0.1854 -0.1854 -0.1737 -0.1737 3.2735 3.2735 3.3117 3.3117 4.3334 4.3334 4.5499 4.5499 8.7914 8.7914 8.8782 8.8782 9.1879 9.1879 9.3929 9.3929 10.5159 10.5159 10.9803 10.9803 11.1174 11.1174 11.4281 11.4281 12.9109 12.9109 13.0506 13.0506 13.2275 13.2275 k = 0.5000 0.2887 0.2605 ( 6830 PWs) bands (ev): -18.1626 -18.1626 -18.1554 -18.1554 -4.9196 -4.9196 -4.9002 -4.9002 -3.1094 -3.1094 -3.0764 -3.0764 -3.0680 -3.0680 -3.0320 -3.0320 -2.6352 -2.6352 -2.6241 -2.6241 -2.5952 -2.5952 -2.5774 -2.5774 -2.5209 -2.5209 -2.5093 -2.5093 -2.3856 -2.3856 -2.3487 -2.3487 -0.6033 -0.6033 -0.6006 -0.6006 -0.5311 -0.5311 -0.5237 -0.5237 -0.4743 -0.4743 -0.4573 -0.4573 -0.3257 -0.3257 -0.2937 -0.2937 -0.2135 -0.2135 -0.2094 -0.2094 -0.1880 -0.1880 -0.1706 -0.1706 3.2653 3.2653 3.3226 3.3226 4.2816 4.2816 4.6054 4.6054 8.7629 8.7629 8.8824 8.8824 9.1467 9.1467 9.4326 9.4326 10.4268 10.4268 11.0148 11.0148 11.1464 11.1464 11.5142 11.5142 12.8789 12.8789 13.0862 13.0862 13.1857 13.1857 k = 0.5000 0.2887 0.2442 ( 6822 PWs) bands (ev): -18.1638 -18.1638 -18.1542 -18.1542 -4.9229 -4.9229 -4.8973 -4.8973 -3.1208 -3.1208 -3.0783 -3.0783 -3.0663 -3.0663 -3.0197 -3.0197 -2.6366 -2.6366 -2.6218 -2.6218 -2.5977 -2.5977 -2.5743 -2.5743 -2.5228 -2.5228 -2.5074 -2.5074 -2.3920 -2.3920 -2.3431 -2.3431 -0.6033 -0.6033 -0.5997 -0.5997 -0.5328 -0.5328 -0.5229 -0.5229 -0.4768 -0.4768 -0.4543 -0.4543 -0.3315 -0.3315 -0.2892 -0.2892 -0.2141 -0.2141 -0.2085 -0.2085 -0.1905 -0.1905 -0.1675 -0.1675 3.2576 3.2576 3.3341 3.3341 4.2311 4.2311 4.6609 4.6609 8.7333 8.7333 8.8717 8.8717 9.1196 9.1196 9.4592 9.4592 10.3568 10.3568 10.9557 10.9557 11.2764 11.2764 11.6016 11.6016 12.8490 12.8490 13.1161 13.1161 13.1538 13.1538 k = 0.5000 0.2887 0.2279 ( 6836 PWs) bands (ev): -18.1650 -18.1650 -18.1530 -18.1530 -4.9263 -4.9263 -4.8946 -4.8946 -3.1318 -3.1318 -3.0800 -3.0800 -3.0647 -3.0647 -3.0075 -3.0075 -2.6379 -2.6379 -2.6197 -2.6197 -2.6000 -2.6000 -2.5713 -2.5713 -2.5247 -2.5247 -2.5056 -2.5056 -2.3985 -2.3985 -2.3378 -2.3378 -0.6032 -0.6032 -0.5986 -0.5986 -0.5345 -0.5345 -0.5221 -0.5221 -0.4792 -0.4792 -0.4513 -0.4513 -0.3373 -0.3373 -0.2850 -0.2850 -0.2147 -0.2147 -0.2075 -0.2075 -0.1927 -0.1927 -0.1645 -0.1645 3.2505 3.2505 3.3461 3.3461 4.1819 4.1819 4.7161 4.7161 8.7030 8.7030 8.8449 8.8449 9.1084 9.1084 9.4686 9.4686 10.3095 10.3095 10.8942 10.8942 11.4154 11.4154 11.6898 11.6898 12.8218 12.8218 13.1042 13.1042 13.1680 13.1680 k = 0.5000 0.2887 0.2117 ( 6828 PWs) bands (ev): -18.1660 -18.1660 -18.1519 -18.1519 -4.9295 -4.9295 -4.8920 -4.8920 -3.1423 -3.1423 -3.0816 -3.0816 -3.0632 -3.0632 -2.9956 -2.9956 -2.6391 -2.6391 -2.6176 -2.6176 -2.6019 -2.6019 -2.5683 -2.5683 -2.5264 -2.5264 -2.5040 -2.5040 -2.4048 -2.4048 -2.3327 -2.3327 -0.6030 -0.6030 -0.5974 -0.5974 -0.5365 -0.5365 -0.5214 -0.5214 -0.4815 -0.4815 -0.4483 -0.4483 -0.3431 -0.3431 -0.2811 -0.2811 -0.2154 -0.2154 -0.2064 -0.2064 -0.1948 -0.1948 -0.1614 -0.1614 3.2439 3.2439 3.3586 3.3586 4.1343 4.1343 4.7707 4.7707 8.6722 8.6722 8.8064 8.8064 9.1086 9.1086 9.4595 9.4595 10.2860 10.2860 10.8371 10.8371 11.5555 11.5555 11.7785 11.7785 12.7980 12.7980 13.0769 13.0769 13.2026 13.2026 k = 0.5000 0.2887 0.1954 ( 6846 PWs) bands (ev): -18.1671 -18.1671 -18.1509 -18.1509 -4.9327 -4.9327 -4.8895 -4.8895 -3.1523 -3.1523 -3.0832 -3.0832 -3.0618 -3.0618 -2.9841 -2.9841 -2.6401 -2.6401 -2.6161 -2.6161 -2.6030 -2.6030 -2.5654 -2.5654 -2.5281 -2.5281 -2.5024 -2.5024 -2.4111 -2.4111 -2.3278 -2.3278 -0.6027 -0.6027 -0.5961 -0.5961 -0.5385 -0.5385 -0.5208 -0.5208 -0.4836 -0.4836 -0.4452 -0.4452 -0.3488 -0.3488 -0.2777 -0.2777 -0.2161 -0.2161 -0.2052 -0.2052 -0.1965 -0.1965 -0.1585 -0.1585 3.2378 3.2378 3.3717 3.3717 4.0884 4.0884 4.8244 4.8244 8.6411 8.6411 8.7618 8.7618 9.1141 9.1141 9.4346 9.4346 10.2835 10.2835 10.7865 10.7865 11.6933 11.6933 11.8672 11.8672 12.7784 12.7784 13.0539 13.0539 13.2386 13.2386 k = 0.5000 0.2887 0.1791 ( 6840 PWs) bands (ev): -18.1681 -18.1681 -18.1499 -18.1499 -4.9358 -4.9358 -4.8873 -4.8873 -3.1617 -3.1617 -3.0847 -3.0847 -3.0605 -3.0605 -2.9731 -2.9731 -2.6411 -2.6411 -2.6154 -2.6154 -2.6029 -2.6029 -2.5627 -2.5627 -2.5296 -2.5296 -2.5011 -2.5011 -2.4172 -2.4172 -2.3233 -2.3233 -0.6023 -0.6023 -0.5946 -0.5946 -0.5407 -0.5407 -0.5202 -0.5202 -0.4855 -0.4855 -0.4422 -0.4422 -0.3544 -0.3544 -0.2747 -0.2747 -0.2168 -0.2168 -0.2040 -0.2040 -0.1980 -0.1980 -0.1557 -0.1557 3.2323 3.2323 3.3853 3.3853 4.0442 4.0442 4.8766 4.8766 8.6099 8.6099 8.7154 8.7154 9.1197 9.1197 9.4001 9.4001 10.2953 10.2953 10.7444 10.7444 11.8250 11.8250 11.9562 11.9562 12.7638 12.7638 13.0379 13.0379 13.2745 13.2745 k = 0.5000 0.2887 0.1628 ( 6816 PWs) bands (ev): -18.1690 -18.1690 -18.1489 -18.1489 -4.9387 -4.9387 -4.8852 -4.8852 -3.1704 -3.1704 -3.0861 -3.0861 -3.0593 -3.0593 -2.9627 -2.9627 -2.6419 -2.6419 -2.6157 -2.6157 -2.6016 -2.6016 -2.5603 -2.5603 -2.5308 -2.5308 -2.4999 -2.4999 -2.4231 -2.4231 -2.3191 -2.3191 -0.6018 -0.6018 -0.5930 -0.5930 -0.5430 -0.5430 -0.5197 -0.5197 -0.4873 -0.4873 -0.4392 -0.4392 -0.3600 -0.3600 -0.2720 -0.2720 -0.2176 -0.2176 -0.2029 -0.2029 -0.1991 -0.1991 -0.1530 -0.1530 3.2273 3.2273 3.3994 3.3994 4.0018 4.0018 4.9271 4.9271 8.5787 8.5787 8.6696 8.6696 9.1209 9.1209 9.3640 9.3640 10.3134 10.3134 10.7130 10.7130 11.9448 11.9448 12.0469 12.0469 12.7552 12.7552 13.0316 13.0316 13.3098 13.3098 k = 0.5000 0.2887 0.1465 ( 6828 PWs) bands (ev): -18.1699 -18.1699 -18.1481 -18.1481 -4.9414 -4.9414 -4.8833 -4.8833 -3.1784 -3.1784 -3.0874 -3.0874 -3.0582 -3.0582 -2.9531 -2.9531 -2.6426 -2.6426 -2.6167 -2.6167 -2.5992 -2.5992 -2.5582 -2.5582 -2.5316 -2.5316 -2.4991 -2.4991 -2.4287 -2.4287 -2.3153 -2.3153 -0.6014 -0.6014 -0.5913 -0.5913 -0.5455 -0.5455 -0.5193 -0.5193 -0.4889 -0.4889 -0.4361 -0.4361 -0.3654 -0.3654 -0.2697 -0.2697 -0.2184 -0.2184 -0.2023 -0.2023 -0.1995 -0.1995 -0.1505 -0.1505 3.2227 3.2227 3.4140 3.4140 3.9615 3.9615 4.9752 4.9752 8.5479 8.5479 8.6257 8.6257 9.1137 9.1137 9.3339 9.3339 10.3302 10.3302 10.6951 10.6951 12.0456 12.0456 12.1411 12.1411 12.7527 12.7527 13.0387 13.0387 13.3443 13.3443 k = 0.5000 0.2887 0.1303 ( 6840 PWs) bands (ev): -18.1707 -18.1707 -18.1473 -18.1473 -4.9439 -4.9439 -4.8816 -4.8816 -3.1857 -3.1857 -3.0885 -3.0885 -3.0572 -3.0572 -2.9442 -2.9442 -2.6432 -2.6432 -2.6180 -2.6180 -2.5963 -2.5963 -2.5568 -2.5568 -2.5319 -2.5319 -2.4987 -2.4987 -2.4339 -2.4339 -2.3118 -2.3118 -0.6009 -0.6009 -0.5894 -0.5894 -0.5480 -0.5480 -0.5190 -0.5190 -0.4903 -0.4903 -0.4330 -0.4330 -0.3706 -0.3706 -0.2677 -0.2677 -0.2192 -0.2192 -0.2025 -0.2025 -0.1987 -0.1987 -0.1482 -0.1482 3.2187 3.2187 3.4290 3.4290 3.9233 3.9233 5.0205 5.0205 8.5178 8.5178 8.5847 8.5847 9.0960 9.0960 9.3148 9.3148 10.3398 10.3398 10.6924 10.6924 12.1251 12.1251 12.2353 12.2353 12.7553 12.7553 13.0643 13.0643 13.3776 13.3776 k = 0.5000 0.2887 0.1140 ( 6848 PWs) bands (ev): -18.1714 -18.1714 -18.1466 -18.1466 -4.9462 -4.9462 -4.8801 -4.8801 -3.1922 -3.1922 -3.0896 -3.0896 -3.0563 -3.0563 -2.9362 -2.9362 -2.6438 -2.6438 -2.6193 -2.6193 -2.5931 -2.5931 -2.5562 -2.5562 -2.5314 -2.5314 -2.4987 -2.4987 -2.4387 -2.4387 -2.3087 -2.3087 -0.6004 -0.6004 -0.5874 -0.5874 -0.5507 -0.5507 -0.5187 -0.5187 -0.4915 -0.4915 -0.4299 -0.4299 -0.3757 -0.3757 -0.2661 -0.2661 -0.2200 -0.2200 -0.2031 -0.2031 -0.1975 -0.1975 -0.1461 -0.1461 3.2152 3.2152 3.4442 3.4442 3.8873 3.8873 5.0623 5.0623 8.4890 8.4890 8.5471 8.5471 9.0699 9.0699 9.3066 9.3066 10.3404 10.3404 10.7037 10.7037 12.1865 12.1865 12.3221 12.3221 12.7608 12.7608 13.1127 13.1127 13.4094 13.4094 k = 0.5000 0.2887 0.0977 ( 6844 PWs) bands (ev): -18.1720 -18.1720 -18.1459 -18.1459 -4.9483 -4.9483 -4.8788 -4.8788 -3.1978 -3.1978 -3.0906 -3.0906 -3.0555 -3.0555 -2.9291 -2.9291 -2.6442 -2.6442 -2.6206 -2.6206 -2.5897 -2.5897 -2.5563 -2.5563 -2.5302 -2.5302 -2.4992 -2.4992 -2.4429 -2.4429 -2.3059 -2.3059 -0.5999 -0.5999 -0.5853 -0.5853 -0.5534 -0.5534 -0.5184 -0.5184 -0.4926 -0.4926 -0.4268 -0.4268 -0.3806 -0.3806 -0.2648 -0.2648 -0.2207 -0.2207 -0.2037 -0.2037 -0.1963 -0.1963 -0.1442 -0.1442 3.2121 3.2121 3.4596 3.4596 3.8539 3.8539 5.1002 5.1002 8.4620 8.4620 8.5134 8.5134 9.0402 9.0402 9.3058 9.3058 10.3338 10.3338 10.7251 10.7251 12.2323 12.2323 12.3974 12.3974 12.7672 12.7672 13.1848 13.1848 13.4394 13.4394 k = 0.5000 0.2887 0.0814 ( 6844 PWs) bands (ev): -18.1725 -18.1725 -18.1454 -18.1454 -4.9501 -4.9501 -4.8777 -4.8777 -3.2027 -3.2027 -3.0914 -3.0914 -3.0548 -3.0548 -2.9230 -2.9230 -2.6445 -2.6445 -2.6217 -2.6217 -2.5862 -2.5862 -2.5573 -2.5573 -2.5283 -2.5283 -2.5002 -2.5002 -2.4464 -2.4464 -2.3036 -2.3036 -0.5995 -0.5995 -0.5831 -0.5831 -0.5561 -0.5561 -0.5182 -0.5182 -0.4934 -0.4934 -0.4236 -0.4236 -0.3853 -0.3853 -0.2637 -0.2637 -0.2214 -0.2214 -0.2041 -0.2041 -0.1951 -0.1951 -0.1426 -0.1426 3.2096 3.2096 3.4749 3.4749 3.8233 3.8233 5.1335 5.1335 8.4374 8.4374 8.4841 8.4841 9.0113 9.0113 9.3087 9.3087 10.3232 10.3232 10.7511 10.7511 12.2648 12.2648 12.4606 12.4606 12.7736 12.7736 13.2756 13.2756 13.4671 13.4671 k = 0.5000 0.2887 0.0651 ( 6844 PWs) bands (ev): -18.1730 -18.1730 -18.1449 -18.1449 -4.9515 -4.9515 -4.8768 -4.8768 -3.2067 -3.2067 -3.0920 -3.0920 -3.0543 -3.0543 -2.9179 -2.9179 -2.6448 -2.6448 -2.6227 -2.6227 -2.5826 -2.5826 -2.5588 -2.5588 -2.5258 -2.5258 -2.5019 -2.5019 -2.4493 -2.4493 -2.3017 -2.3017 -0.5991 -0.5991 -0.5807 -0.5807 -0.5589 -0.5589 -0.5180 -0.5180 -0.4942 -0.4942 -0.4203 -0.4203 -0.3899 -0.3899 -0.2629 -0.2629 -0.2219 -0.2219 -0.2045 -0.2045 -0.1940 -0.1940 -0.1412 -0.1412 3.2075 3.2075 3.4895 3.4895 3.7961 3.7961 5.1616 5.1616 8.4159 8.4159 8.4595 8.4595 8.9859 8.9859 9.3130 9.3130 10.3116 10.3116 10.7775 10.7775 12.2865 12.2865 12.5117 12.5117 12.7808 12.7808 13.3756 13.3756 13.4920 13.4920 k = 0.5000 0.2887 0.0488 ( 6840 PWs) bands (ev): -18.1733 -18.1733 -18.1446 -18.1446 -4.9527 -4.9527 -4.8760 -4.8760 -3.2098 -3.2098 -3.0926 -3.0926 -3.0539 -3.0539 -2.9139 -2.9139 -2.6450 -2.6450 -2.6235 -2.6235 -2.5791 -2.5791 -2.5609 -2.5609 -2.5229 -2.5229 -2.5041 -2.5041 -2.4514 -2.4514 -2.3002 -2.3002 -0.5988 -0.5988 -0.5782 -0.5782 -0.5618 -0.5618 -0.5179 -0.5179 -0.4947 -0.4947 -0.4170 -0.4170 -0.3942 -0.3942 -0.2622 -0.2622 -0.2224 -0.2224 -0.2048 -0.2048 -0.1932 -0.1932 -0.1402 -0.1402 3.2059 3.2059 3.5029 3.5029 3.7728 3.7728 5.1842 5.1842 8.3982 8.3982 8.4401 8.4401 8.9653 8.9653 9.3173 9.3173 10.3010 10.3010 10.8009 10.8009 12.3005 12.3005 12.5503 12.5503 12.7889 12.7889 13.4699 13.4699 13.5135 13.5135 k = 0.5000 0.2887 0.0326 ( 6828 PWs) bands (ev): -18.1736 -18.1736 -18.1443 -18.1443 -4.9536 -4.9536 -4.8755 -4.8755 -3.2120 -3.2120 -3.0929 -3.0929 -3.0535 -3.0535 -2.9111 -2.9111 -2.6451 -2.6451 -2.6241 -2.6241 -2.5756 -2.5756 -2.5633 -2.5633 -2.5197 -2.5197 -2.5068 -2.5068 -2.4529 -2.4529 -2.2991 -2.2991 -0.5986 -0.5986 -0.5757 -0.5757 -0.5646 -0.5646 -0.5178 -0.5178 -0.4951 -0.4951 -0.4135 -0.4135 -0.3984 -0.3984 -0.2618 -0.2618 -0.2227 -0.2227 -0.2050 -0.2050 -0.1925 -0.1925 -0.1394 -0.1394 3.2047 3.2047 3.5140 3.5140 3.7547 3.7547 5.2006 5.2006 8.3849 8.3849 8.4261 8.4261 8.9504 8.9504 9.3208 9.3208 10.2928 10.2928 10.8191 10.8191 12.3089 12.3089 12.5767 12.5767 12.7972 12.7972 13.5289 13.5289 13.5390 13.5390 k = 0.5000 0.2887 0.0163 ( 6840 PWs) bands (ev): -18.1737 -18.1737 -18.1442 -18.1442 -4.9541 -4.9541 -4.8752 -4.8752 -3.2133 -3.2133 -3.0932 -3.0932 -3.0534 -3.0534 -2.9094 -2.9094 -2.6452 -2.6452 -2.6244 -2.6244 -2.5723 -2.5723 -2.5661 -2.5661 -2.5164 -2.5164 -2.5098 -2.5098 -2.4538 -2.4538 -2.2985 -2.2985 -0.5984 -0.5984 -0.5731 -0.5731 -0.5673 -0.5673 -0.5178 -0.5178 -0.4954 -0.4954 -0.4100 -0.4100 -0.4024 -0.4024 -0.2616 -0.2616 -0.2229 -0.2229 -0.2051 -0.2051 -0.1922 -0.1922 -0.1390 -0.1390 3.2040 3.2040 3.5216 3.5216 3.7429 3.7429 5.2106 5.2106 8.3767 8.3767 8.4177 8.4177 8.9413 8.9413 9.3230 9.3230 10.2876 10.2876 10.8305 10.8305 12.3133 12.3133 12.5917 12.5917 12.8038 12.8038 13.5412 13.5412 13.5677 13.5677 k = 0.5000 0.2887-0.0000 ( 6836 PWs) bands (ev): -18.1738 -18.1738 -18.1441 -18.1441 -4.9542 -4.9542 -4.8751 -4.8751 -3.2138 -3.2138 -3.0933 -3.0933 -3.0533 -3.0533 -2.9088 -2.9088 -2.6452 -2.6452 -2.6245 -2.6245 -2.5694 -2.5694 -2.5687 -2.5687 -2.5136 -2.5136 -2.5125 -2.5125 -2.4541 -2.4541 -2.2982 -2.2982 -0.5984 -0.5984 -0.5710 -0.5710 -0.5695 -0.5695 -0.5178 -0.5178 -0.4954 -0.4954 -0.4064 -0.4064 -0.4061 -0.4061 -0.2615 -0.2615 -0.2230 -0.2230 -0.2051 -0.2051 -0.1920 -0.1920 -0.1388 -0.1388 3.2038 3.2038 3.5243 3.5243 3.7388 3.7388 5.2139 5.2139 8.3739 8.3739 8.4149 8.4149 8.9383 8.9383 9.3238 9.3238 10.2858 10.2858 10.8344 10.8344 12.3147 12.3147 12.5965 12.5965 12.8063 12.8063 13.5454 13.5454 13.5742 13.5742 k = 0.3333 0.5774-0.0000 ( 6846 PWs) bands (ev): -18.1731 -18.1731 -18.1437 -18.1437 -4.9569 -4.9569 -4.8766 -4.8766 -3.2320 -3.2320 -3.1046 -3.1046 -3.0182 -3.0182 -2.8794 -2.8794 -2.6425 -2.6425 -2.6358 -2.6358 -2.6196 -2.6196 -2.5954 -2.5954 -2.5173 -2.5173 -2.5046 -2.5046 -2.3876 -2.3876 -2.3475 -2.3475 -0.5935 -0.5935 -0.5914 -0.5914 -0.5537 -0.5537 -0.5095 -0.5095 -0.4770 -0.4770 -0.4392 -0.4392 -0.3818 -0.3818 -0.3295 -0.3295 -0.2888 -0.2888 -0.2007 -0.2007 -0.1120 -0.1120 -0.1071 -0.1071 3.5767 3.5767 3.6771 3.6771 4.1183 4.1183 4.1810 4.1810 7.4958 7.4958 8.8685 8.8685 8.9522 8.9522 9.5351 9.5351 11.2310 11.2310 11.5122 11.5122 11.7715 11.7715 12.1371 12.1371 12.5448 12.5448 12.6608 12.6608 13.0101 13.0101 k = 0.3333 0.5774 0.0163 ( 6843 PWs) bands (ev): -18.1731 -18.1731 -18.1437 -18.1437 -4.9567 -4.9567 -4.8767 -4.8767 -3.2316 -3.2316 -3.1046 -3.1046 -3.0182 -3.0182 -2.8802 -2.8802 -2.6424 -2.6424 -2.6359 -2.6359 -2.6192 -2.6192 -2.5952 -2.5952 -2.5175 -2.5175 -2.5046 -2.5046 -2.3875 -2.3875 -2.3478 -2.3478 -0.5942 -0.5942 -0.5908 -0.5908 -0.5536 -0.5536 -0.5096 -0.5096 -0.4770 -0.4770 -0.4390 -0.4390 -0.3817 -0.3817 -0.3298 -0.3298 -0.2884 -0.2884 -0.2008 -0.2008 -0.1123 -0.1123 -0.1070 -0.1070 3.5765 3.5765 3.6766 3.6766 4.1189 4.1189 4.1811 4.1811 7.4983 7.4983 8.8690 8.8690 8.9530 8.9530 9.5314 9.5314 11.2293 11.2293 11.5099 11.5099 11.7726 11.7726 12.1369 12.1369 12.5432 12.5432 12.6646 12.6646 13.0165 13.0165 k = 0.3333 0.5774 0.0326 ( 6831 PWs) bands (ev): -18.1730 -18.1730 -18.1439 -18.1439 -4.9562 -4.9562 -4.8770 -4.8770 -3.2302 -3.2302 -3.1045 -3.1045 -3.0184 -3.0184 -2.8826 -2.8826 -2.6421 -2.6421 -2.6363 -2.6363 -2.6181 -2.6181 -2.5944 -2.5944 -2.5178 -2.5178 -2.5048 -2.5048 -2.3874 -2.3874 -2.3485 -2.3485 -0.5954 -0.5954 -0.5897 -0.5897 -0.5534 -0.5534 -0.5099 -0.5099 -0.4771 -0.4771 -0.4384 -0.4384 -0.3812 -0.3812 -0.3308 -0.3308 -0.2875 -0.2875 -0.2012 -0.2012 -0.1131 -0.1131 -0.1065 -0.1065 3.5760 3.5760 3.6751 3.6751 4.1206 4.1206 4.1813 4.1813 7.5060 7.5060 8.8706 8.8706 8.9553 8.9553 9.5206 9.5206 11.2241 11.2241 11.5026 11.5026 11.7762 11.7762 12.1366 12.1366 12.5393 12.5393 12.6759 12.6759 13.0348 13.0348 k = 0.3333 0.5774 0.0488 ( 6843 PWs) bands (ev): -18.1727 -18.1727 -18.1441 -18.1441 -4.9553 -4.9553 -4.8775 -4.8775 -3.2280 -3.2280 -3.1044 -3.1044 -3.0186 -3.0186 -2.8865 -2.8865 -2.6417 -2.6417 -2.6369 -2.6369 -2.6163 -2.6163 -2.5933 -2.5933 -2.5184 -2.5184 -2.5050 -2.5050 -2.3873 -2.3873 -2.3497 -2.3497 -0.5968 -0.5968 -0.5885 -0.5885 -0.5530 -0.5530 -0.5103 -0.5103 -0.4773 -0.4773 -0.4376 -0.4376 -0.3805 -0.3805 -0.3324 -0.3324 -0.2860 -0.2860 -0.2019 -0.2019 -0.1141 -0.1141 -0.1061 -0.1061 3.5752 3.5752 3.6727 3.6727 4.1233 4.1233 4.1816 4.1816 7.5186 7.5186 8.8729 8.8729 8.9593 8.9593 9.5033 9.5033 11.2155 11.2155 11.4894 11.4894 11.7835 11.7835 12.1364 12.1364 12.5349 12.5349 12.6939 12.6939 13.0632 13.0632 k = 0.3333 0.5774 0.0651 ( 6837 PWs) bands (ev): -18.1724 -18.1724 -18.1445 -18.1445 -4.9542 -4.9542 -4.8783 -4.8783 -3.2249 -3.2249 -3.1043 -3.1043 -3.0188 -3.0188 -2.8918 -2.8918 -2.6412 -2.6412 -2.6375 -2.6375 -2.6141 -2.6141 -2.5916 -2.5916 -2.5192 -2.5192 -2.5053 -2.5053 -2.3871 -2.3871 -2.3513 -2.3513 -0.5982 -0.5982 -0.5874 -0.5874 -0.5525 -0.5525 -0.5109 -0.5109 -0.4775 -0.4775 -0.4364 -0.4364 -0.3795 -0.3795 -0.3344 -0.3344 -0.2842 -0.2842 -0.2028 -0.2028 -0.1153 -0.1153 -0.1056 -0.1056 3.5741 3.5741 3.6694 3.6694 4.1270 4.1270 4.1821 4.1821 7.5363 7.5363 8.8752 8.8752 8.9646 8.9646 9.4803 9.4803 11.2034 11.2034 11.4697 11.4697 11.7956 11.7956 12.1370 12.1370 12.5321 12.5321 12.7176 12.7176 13.0917 13.0917 k = 0.3333 0.5774 0.0814 ( 6855 PWs) bands (ev): -18.1719 -18.1719 -18.1449 -18.1449 -4.9527 -4.9527 -4.8792 -4.8792 -3.2209 -3.2209 -3.1041 -3.1041 -3.0192 -3.0192 -2.8985 -2.8985 -2.6408 -2.6408 -2.6381 -2.6381 -2.6114 -2.6114 -2.5896 -2.5896 -2.5202 -2.5202 -2.5058 -2.5058 -2.3868 -2.3868 -2.3533 -2.3533 -0.5996 -0.5996 -0.5863 -0.5863 -0.5519 -0.5519 -0.5116 -0.5116 -0.4778 -0.4778 -0.4350 -0.4350 -0.3782 -0.3782 -0.3367 -0.3367 -0.2821 -0.2821 -0.2040 -0.2040 -0.1166 -0.1166 -0.1052 -0.1052 3.5727 3.5727 3.6655 3.6655 4.1314 4.1314 4.1827 4.1827 7.5588 7.5588 8.8768 8.8768 8.9714 8.9714 9.4532 9.4532 11.1881 11.1881 11.4429 11.4429 11.8136 11.8136 12.1391 12.1391 12.5324 12.5324 12.7459 12.7459 13.1128 13.1128 k = 0.3333 0.5774 0.0977 ( 6834 PWs) bands (ev): -18.1714 -18.1714 -18.1455 -18.1455 -4.9510 -4.9510 -4.8803 -4.8803 -3.2161 -3.2161 -3.1039 -3.1039 -3.0196 -3.0196 -2.9065 -2.9065 -2.6406 -2.6406 -2.6383 -2.6383 -2.6083 -2.6083 -2.5872 -2.5872 -2.5214 -2.5214 -2.5062 -2.5062 -2.3865 -2.3865 -2.3557 -2.3557 -0.6010 -0.6010 -0.5853 -0.5853 -0.5510 -0.5510 -0.5125 -0.5125 -0.4781 -0.4781 -0.4333 -0.4333 -0.3767 -0.3767 -0.3393 -0.3393 -0.2798 -0.2798 -0.2054 -0.2054 -0.1179 -0.1179 -0.1048 -0.1048 3.5711 3.5711 3.6609 3.6609 4.1365 4.1365 4.1833 4.1833 7.5862 7.5862 8.8763 8.8763 8.9794 8.9794 9.4238 9.4238 11.1697 11.1697 11.4094 11.4094 11.8378 11.8378 12.1431 12.1431 12.5371 12.5371 12.7770 12.7770 13.1368 13.1368 k = 0.3333 0.5774 0.1140 ( 6831 PWs) bands (ev): -18.1708 -18.1708 -18.1461 -18.1461 -4.9489 -4.9489 -4.8817 -4.8817 -3.2104 -3.2104 -3.1036 -3.1036 -3.0201 -3.0201 -2.9155 -2.9155 -2.6408 -2.6408 -2.6381 -2.6381 -2.6049 -2.6049 -2.5845 -2.5845 -2.5228 -2.5228 -2.5068 -2.5068 -2.3861 -2.3861 -2.3585 -2.3585 -0.6024 -0.6024 -0.5844 -0.5844 -0.5501 -0.5501 -0.5135 -0.5135 -0.4784 -0.4784 -0.4314 -0.4314 -0.3750 -0.3750 -0.3420 -0.3420 -0.2774 -0.2774 -0.2069 -0.2069 -0.1193 -0.1193 -0.1046 -0.1046 3.5693 3.5693 3.6560 3.6560 4.1421 4.1421 4.1841 4.1841 7.6181 7.6181 8.8720 8.8720 8.9884 8.9884 9.3942 9.3942 11.1485 11.1485 11.3702 11.3702 11.8683 11.8683 12.1495 12.1495 12.5466 12.5466 12.8091 12.8091 13.1631 13.1631 k = 0.3333 0.5774 0.1303 ( 6831 PWs) bands (ev): -18.1701 -18.1701 -18.1468 -18.1468 -4.9467 -4.9467 -4.8832 -4.8832 -3.2040 -3.2040 -3.1034 -3.1034 -3.0206 -3.0206 -2.9255 -2.9255 -2.6412 -2.6412 -2.6376 -2.6376 -2.6014 -2.6014 -2.5815 -2.5815 -2.5245 -2.5245 -2.5073 -2.5073 -2.3858 -2.3858 -2.3615 -2.3615 -0.6037 -0.6037 -0.5835 -0.5835 -0.5491 -0.5491 -0.5146 -0.5146 -0.4787 -0.4787 -0.4293 -0.4293 -0.3732 -0.3732 -0.3448 -0.3448 -0.2750 -0.2750 -0.2086 -0.2086 -0.1207 -0.1207 -0.1045 -0.1045 3.5674 3.5674 3.6508 3.6508 4.1480 4.1480 4.1848 4.1848 7.6546 7.6546 8.8619 8.8619 8.9983 8.9983 9.3669 9.3669 11.1251 11.1251 11.3265 11.3265 11.9049 11.9049 12.1585 12.1585 12.5611 12.5611 12.8400 12.8400 13.1908 13.1908 k = 0.3333 0.5774 0.1465 ( 6840 PWs) bands (ev): -18.1693 -18.1693 -18.1476 -18.1476 -4.9441 -4.9441 -4.8849 -4.8849 -3.1968 -3.1968 -3.1031 -3.1031 -3.0211 -3.0211 -2.9363 -2.9363 -2.6418 -2.6418 -2.6369 -2.6369 -2.5977 -2.5977 -2.5783 -2.5783 -2.5263 -2.5263 -2.5079 -2.5079 -2.3854 -2.3854 -2.3648 -2.3648 -0.6050 -0.6050 -0.5828 -0.5828 -0.5479 -0.5479 -0.5158 -0.5158 -0.4790 -0.4790 -0.4272 -0.4272 -0.3713 -0.3713 -0.3475 -0.3475 -0.2727 -0.2727 -0.2104 -0.2104 -0.1221 -0.1221 -0.1045 -0.1045 3.5654 3.5654 3.6456 3.6456 4.1540 4.1540 4.1856 4.1856 7.6953 7.6953 8.8442 8.8442 9.0088 9.0088 9.3443 9.3443 11.1000 11.1000 11.2799 11.2799 11.9474 11.9474 12.1701 12.1701 12.5801 12.5801 12.8673 12.8673 13.2193 13.2193 k = 0.3333 0.5774 0.1628 ( 6831 PWs) bands (ev): -18.1684 -18.1684 -18.1485 -18.1485 -4.9414 -4.9414 -4.8869 -4.8869 -3.1889 -3.1889 -3.1028 -3.1028 -3.0216 -3.0216 -2.9477 -2.9477 -2.6423 -2.6423 -2.6363 -2.6363 -2.5938 -2.5938 -2.5749 -2.5749 -2.5283 -2.5283 -2.5085 -2.5085 -2.3850 -2.3850 -2.3682 -2.3682 -0.6062 -0.6062 -0.5820 -0.5820 -0.5466 -0.5466 -0.5172 -0.5172 -0.4792 -0.4792 -0.4250 -0.4250 -0.3692 -0.3692 -0.3503 -0.3503 -0.2705 -0.2705 -0.2123 -0.2123 -0.1234 -0.1234 -0.1045 -0.1045 3.5634 3.5634 3.6403 3.6403 4.1600 4.1600 4.1864 4.1864 7.7402 7.7402 8.8172 8.8172 9.0197 9.0197 9.3283 9.3283 11.0739 11.0739 11.2318 11.2318 11.9952 11.9952 12.1840 12.1840 12.6032 12.6032 12.8886 12.8886 13.2480 13.2480 k = 0.3333 0.5774 0.1791 ( 6843 PWs) bands (ev): -18.1675 -18.1675 -18.1494 -18.1494 -4.9385 -4.9385 -4.8890 -4.8890 -3.1804 -3.1804 -3.1026 -3.1026 -3.0222 -3.0222 -2.9597 -2.9597 -2.6428 -2.6428 -2.6357 -2.6357 -2.5899 -2.5899 -2.5714 -2.5714 -2.5304 -2.5304 -2.5091 -2.5091 -2.3847 -2.3847 -2.3716 -2.3716 -0.6073 -0.6073 -0.5814 -0.5814 -0.5453 -0.5453 -0.5186 -0.5186 -0.4795 -0.4795 -0.4227 -0.4227 -0.3672 -0.3672 -0.3530 -0.3530 -0.2684 -0.2684 -0.2142 -0.2142 -0.1246 -0.1246 -0.1046 -0.1046 3.5615 3.5615 3.6353 3.6353 4.1658 4.1658 4.1872 4.1872 7.7889 7.7889 8.7805 8.7805 9.0307 9.0307 9.3195 9.3195 11.0477 11.0477 11.1837 11.1837 12.0480 12.0480 12.1999 12.1999 12.6295 12.6295 12.9014 12.9014 13.2762 13.2762 k = 0.3333 0.5774 0.1954 ( 6849 PWs) bands (ev): -18.1665 -18.1665 -18.1504 -18.1504 -4.9355 -4.9355 -4.8912 -4.8912 -3.1713 -3.1713 -3.1023 -3.1023 -3.0227 -3.0227 -2.9721 -2.9721 -2.6432 -2.6432 -2.6352 -2.6352 -2.5861 -2.5861 -2.5680 -2.5680 -2.5327 -2.5327 -2.5096 -2.5096 -2.3844 -2.3844 -2.3751 -2.3751 -0.6083 -0.6083 -0.5809 -0.5809 -0.5438 -0.5438 -0.5201 -0.5201 -0.4797 -0.4797 -0.4205 -0.4205 -0.3652 -0.3652 -0.3555 -0.3555 -0.2665 -0.2665 -0.2161 -0.2161 -0.1257 -0.1257 -0.1047 -0.1047 3.5596 3.5596 3.6306 3.6306 4.1712 4.1712 4.1879 4.1879 7.8412 7.8412 8.7349 8.7349 9.0415 9.0415 9.3173 9.3173 11.0221 11.0221 11.1371 11.1371 12.1054 12.1054 12.2170 12.2170 12.6581 12.6581 12.9037 12.9037 13.3033 13.3033 k = 0.3333 0.5774 0.2117 ( 6855 PWs) bands (ev): -18.1655 -18.1655 -18.1514 -18.1514 -4.9324 -4.9324 -4.8937 -4.8937 -3.1617 -3.1617 -3.1020 -3.1020 -3.0231 -3.0231 -2.9846 -2.9846 -2.6436 -2.6436 -2.6347 -2.6347 -2.5822 -2.5822 -2.5648 -2.5648 -2.5351 -2.5351 -2.5101 -2.5101 -2.3841 -2.3841 -2.3784 -2.3784 -0.6092 -0.6092 -0.5804 -0.5804 -0.5423 -0.5423 -0.5217 -0.5217 -0.4799 -0.4799 -0.4184 -0.4184 -0.3633 -0.3633 -0.3580 -0.3580 -0.2647 -0.2647 -0.2179 -0.2179 -0.1268 -0.1268 -0.1049 -0.1049 3.5579 3.5579 3.6263 3.6263 4.1761 4.1761 4.1886 4.1886 7.8968 7.8968 8.6817 8.6817 9.0517 9.0517 9.3202 9.3202 10.9980 10.9980 11.0933 11.0933 12.1669 12.1669 12.2346 12.2346 12.6877 12.6877 12.8942 12.8942 13.3287 13.3287 k = 0.3333 0.5774 0.2279 ( 6861 PWs) bands (ev): -18.1644 -18.1644 -18.1525 -18.1525 -4.9292 -4.9292 -4.8963 -4.8963 -3.1519 -3.1519 -3.1018 -3.1018 -3.0236 -3.0236 -2.9970 -2.9970 -2.6440 -2.6440 -2.6343 -2.6343 -2.5785 -2.5785 -2.5618 -2.5618 -2.5376 -2.5376 -2.5106 -2.5106 -2.3838 -2.3838 -2.3814 -2.3814 -0.6100 -0.6100 -0.5800 -0.5800 -0.5408 -0.5408 -0.5233 -0.5233 -0.4801 -0.4801 -0.4165 -0.4165 -0.3616 -0.3616 -0.3602 -0.3602 -0.2632 -0.2632 -0.2195 -0.2195 -0.1276 -0.1276 -0.1051 -0.1051 3.5563 3.5563 3.6225 3.6225 4.1805 4.1805 4.1892 4.1892 7.9554 7.9554 8.6227 8.6227 9.0610 9.0610 9.3265 9.3265 10.9761 10.9761 11.0535 11.0535 12.2317 12.2317 12.2517 12.2517 12.7165 12.7165 12.8729 12.8729 13.3517 13.3517 k = 0.3333 0.5774 0.2442 ( 6861 PWs) bands (ev): -18.1632 -18.1632 -18.1537 -18.1537 -4.9260 -4.9260 -4.8989 -4.8989 -3.1421 -3.1421 -3.1016 -3.1016 -3.0239 -3.0239 -3.0090 -3.0090 -2.6443 -2.6443 -2.6339 -2.6339 -2.5749 -2.5749 -2.5591 -2.5591 -2.5401 -2.5401 -2.5110 -2.5110 -2.3841 -2.3841 -2.3836 -2.3836 -0.6107 -0.6107 -0.5797 -0.5797 -0.5391 -0.5391 -0.5250 -0.5250 -0.4802 -0.4802 -0.4147 -0.4147 -0.3621 -0.3621 -0.3600 -0.3600 -0.2620 -0.2620 -0.2209 -0.2209 -0.1284 -0.1284 -0.1053 -0.1053 3.5550 3.5550 3.6193 3.6193 4.1842 4.1842 4.1898 4.1898 8.0167 8.0167 8.5596 8.5596 9.0692 9.0692 9.3342 9.3342 10.9570 10.9570 11.0191 11.0191 12.2675 12.2675 12.2993 12.2993 12.7411 12.7411 12.8421 12.8421 13.3717 13.3717 k = 0.3333 0.5774 0.2605 ( 6861 PWs) bands (ev): -18.1621 -18.1621 -18.1548 -18.1548 -4.9228 -4.9228 -4.9017 -4.9017 -3.1326 -3.1326 -3.1014 -3.1014 -3.0242 -3.0242 -3.0202 -3.0202 -2.6445 -2.6445 -2.6337 -2.6337 -2.5717 -2.5717 -2.5568 -2.5568 -2.5425 -2.5425 -2.5113 -2.5113 -2.3864 -2.3864 -2.3834 -2.3834 -0.6112 -0.6112 -0.5794 -0.5794 -0.5375 -0.5375 -0.5267 -0.5267 -0.4803 -0.4803 -0.4132 -0.4132 -0.3637 -0.3637 -0.3588 -0.3588 -0.2610 -0.2610 -0.2221 -0.2221 -0.1290 -0.1290 -0.1054 -0.1054 3.5540 3.5540 3.6167 3.6167 4.1872 4.1872 4.1902 4.1902 8.0801 8.0801 8.4937 8.4937 9.0759 9.0759 9.3420 9.3420 10.9416 10.9416 10.9909 10.9909 12.2810 12.2810 12.3686 12.3686 12.7496 12.7496 12.8134 12.8134 13.3881 13.3881 k = 0.3333 0.5774 0.2768 ( 6891 PWs) bands (ev): -18.1609 -18.1609 -18.1560 -18.1560 -4.9197 -4.9197 -4.9045 -4.9045 -3.1244 -3.1244 -3.1013 -3.1013 -3.0298 -3.0298 -3.0244 -3.0244 -2.6446 -2.6446 -2.6335 -2.6335 -2.5689 -2.5689 -2.5552 -2.5552 -2.5447 -2.5447 -2.5115 -2.5115 -2.3881 -2.3881 -2.3833 -2.3833 -0.6116 -0.6116 -0.5792 -0.5792 -0.5359 -0.5359 -0.5283 -0.5283 -0.4804 -0.4804 -0.4121 -0.4121 -0.3649 -0.3649 -0.3579 -0.3579 -0.2603 -0.2603 -0.2230 -0.2230 -0.1294 -0.1294 -0.1056 -0.1056 3.5532 3.5532 3.6149 3.6149 4.1894 4.1894 4.1905 4.1905 8.1449 8.1449 8.4266 8.4266 9.0809 9.0809 9.3485 9.3485 10.9301 10.9301 10.9701 10.9701 12.2914 12.2914 12.4378 12.4378 12.7187 12.7187 12.8111 12.8111 13.4003 13.4003 k = 0.3333 0.5774 0.2931 ( 6894 PWs) bands (ev): -18.1597 -18.1597 -18.1572 -18.1572 -4.9171 -4.9171 -4.9069 -4.9069 -3.1184 -3.1184 -3.1013 -3.1013 -3.0366 -3.0366 -3.0246 -3.0246 -2.6447 -2.6447 -2.6334 -2.6334 -2.5670 -2.5670 -2.5541 -2.5541 -2.5463 -2.5463 -2.5117 -2.5117 -2.3891 -2.3891 -2.3832 -2.3832 -0.6118 -0.6118 -0.5791 -0.5791 -0.5343 -0.5343 -0.5299 -0.5299 -0.4804 -0.4804 -0.4114 -0.4114 -0.3657 -0.3657 -0.3573 -0.3573 -0.2598 -0.2598 -0.2236 -0.2236 -0.1297 -0.1297 -0.1056 -0.1056 3.5527 3.5527 3.6137 3.6137 4.1907 4.1907 4.1907 4.1907 8.2092 8.2092 8.3608 8.3608 9.0840 9.0840 9.3528 9.3528 10.9231 10.9231 10.9573 10.9573 12.2979 12.2979 12.5028 12.5028 12.6678 12.6678 12.8190 12.8190 13.4079 13.4079 k = 0.3333 0.5774 0.3094 ( 6882 PWs) bands (ev): -18.1585 -18.1585 -18.1584 -18.1584 -4.9158 -4.9158 -4.9081 -4.9081 -3.1161 -3.1161 -3.1012 -3.1012 -3.0391 -3.0391 -3.0246 -3.0246 -2.6448 -2.6448 -2.6333 -2.6333 -2.5663 -2.5663 -2.5538 -2.5538 -2.5469 -2.5469 -2.5117 -2.5117 -2.3895 -2.3895 -2.3832 -2.3832 -0.6119 -0.6119 -0.5791 -0.5791 -0.5334 -0.5334 -0.5308 -0.5308 -0.4804 -0.4804 -0.4111 -0.4111 -0.3659 -0.3659 -0.3571 -0.3571 -0.2597 -0.2597 -0.2238 -0.2238 -0.1298 -0.1298 -0.1057 -0.1057 3.5525 3.5525 3.6133 3.6133 4.1907 4.1907 4.1911 4.1911 8.2532 8.2532 8.3163 8.3163 9.0850 9.0850 9.3543 9.3543 10.9208 10.9208 10.9530 10.9530 12.3002 12.3002 12.5405 12.5405 12.6341 12.6341 12.8224 12.8224 13.4104 13.4104 Writing output data file BaTl2.save init_run : 0.30s CPU 0.43s WALL ( 1 calls) electrons : 310.03s CPU 313.88s 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 : 310.02s CPU 313.87s WALL ( 1 calls) v_of_rho : 0.00s CPU 0.01s WALL ( 1 calls) v_h : 0.00s CPU 0.00s WALL ( 1 calls) v_xc : 0.00s CPU 0.00s WALL ( 1 calls) newd : 0.09s CPU 0.12s WALL ( 1 calls) Called by c_bands: init_us_2 : 0.06s CPU 0.09s WALL ( 260 calls) cegterg : 289.50s CPU 292.57s WALL ( 274 calls) Called by sum_band: Called by *egterg: h_psi : 136.39s CPU 138.38s WALL ( 5302 calls) s_psi : 12.55s CPU 12.39s WALL ( 5302 calls) g_psi : 0.47s CPU 0.48s WALL ( 4768 calls) cdiaghg : 112.34s CPU 113.73s WALL ( 5028 calls) cegterg:over : 16.96s CPU 16.95s WALL ( 4768 calls) cegterg:upda : 15.30s CPU 15.20s WALL ( 4768 calls) cegterg:last : 6.91s CPU 6.91s WALL ( 802 calls) cdiaghg:chol : 6.92s CPU 6.93s WALL ( 5028 calls) cdiaghg:inve : 5.16s CPU 5.12s WALL ( 5028 calls) cdiaghg:para : 9.22s CPU 9.45s WALL ( 10056 calls) Called by h_psi: h_psi:vloc : 111.22s CPU 112.94s WALL ( 5302 calls) h_psi:vnl : 24.71s CPU 24.94s WALL ( 5302 calls) add_vuspsi : 13.65s CPU 13.64s WALL ( 5302 calls) General routines calbec : 11.05s CPU 11.28s WALL ( 5302 calls) fft : 0.01s CPU 0.01s WALL ( 19 calls) ffts : 0.00s CPU 0.00s WALL ( 4 calls) fftw : 104.90s CPU 106.53s WALL ( 984860 calls) interpolate : 0.00s CPU 0.00s WALL ( 4 calls) davcio : 0.24s CPU 0.36s WALL ( 520 calls) Parallel routines fft_scatter : 35.23s CPU 36.18s WALL ( 984883 calls) PWSCF : 5m37.32s CPU 5m54.00s WALL This run was terminated on: 14:18:38 3Jan2017 =------------------------------------------------------------------------------= JOB DONE. =------------------------------------------------------------------------------=