Program PWSCF v.5.3.0 (svn rev. 11974) starts on 5Jan2017 at 16:54: 6 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: ./CdSO4.save/ file Cd.rel-pbe-n-rrkjus_psl.1.0.0.UPF: wavefunction(s) 4D 4D 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 109 32 9 8485 1351 206 Max 110 33 11 8492 1362 211 Sum 3943 1159 337 305607 48861 7497 bravais-lattice index = 14 lattice parameter (alat) = 9.4713 a.u. unit-cell volume = 1121.1715 (a.u.)^3 number of atoms/cell = 12 number of atomic types = 3 number of electrons = 84.00 number of Kohn-Sham states= 100 kinetic-energy cutoff = 47.0000 Ry charge density cutoff = 639.0000 Ry Exchange-correlation = PBE ( 1 4 3 4 0 0) Non magnetic calculation with spin-orbit celldm(1)= 9.471307 celldm(2)= 1.000000 celldm(3)= 1.523743 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 1.523743 ) 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 0.656279 ) PseudoPot. # 1 for S read from file: /users/gautes/Pseudo/S.rel-pbe-n-rrkjus_psl.1.0.0.UPF MD5 check sum: 95f1324244b600346090892298cb4451 Pseudo is Ultrasoft + core correction, Zval = 6.0 Generated using "atomic" code by A. Dal Corso v.5.0.2 svn rev. 9656 Using radial grid of 1151 points, 10 beta functions with: l(1) = 0 l(2) = 0 l(3) = 1 l(4) = 1 l(5) = 1 l(6) = 1 l(7) = 2 l(8) = 2 l(9) = 2 l(10) = 2 Q(r) pseudized with 0 coefficients PseudoPot. # 2 for O read from file: /users/gautes/Pseudo/O.rel-pbe-n-rrkjus_psl.1.0.0.UPF MD5 check sum: e551570ea340e0688630c94d366e26e3 Pseudo is Ultrasoft + core correction, Zval = 6.0 Generated using "atomic" code by A. Dal Corso v.5.0.2 svn rev. 9656 Using radial grid of 1095 points, 6 beta functions with: l(1) = 0 l(2) = 0 l(3) = 1 l(4) = 1 l(5) = 1 l(6) = 1 Q(r) pseudized with 0 coefficients PseudoPot. # 3 for Cd read from file: /users/gautes/Pseudo/Cd.rel-pbe-n-rrkjus_psl.1.0.0.UPF MD5 check sum: 1d41bce1441572f114805845d9d822b0 Pseudo is Ultrasoft + core correction, Zval = 12.0 Generated using "atomic" code by A. Dal Corso v.5.0.2 svn rev. 9656 Using radial grid of 1239 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 S 6.00 32.06500 S( 1.00) O 6.00 15.99940 O( 1.00) Cd 12.00 112.41100 Cd( 1.00) 12 Sym. Ops., with inversion, found s frac. trans. isym = 1 identity cryst. s( 1) = ( 1 0 0 ) ( 0 1 0 ) ( 0 0 1 ) cart. s( 1) = ( 1.0000000 0.0000000 0.0000000 ) ( 0.0000000 1.0000000 0.0000000 ) ( 0.0000000 0.0000000 1.0000000 ) isym = 2 180 deg rotation - cart. axis [1,0,0] cryst. s( 2) = ( 1 0 0 ) ( -1 -1 0 ) ( 0 0 -1 ) cart. s( 2) = ( 1.0000000 0.0000000 -0.0000000 ) ( 0.0000000 -1.0000000 -0.0000000 ) ( 0.0000000 0.0000000 -1.0000000 ) isym = 3 120 deg rotation - cryst. axis [0,0,1] cryst. s( 3) = ( 0 1 0 ) ( -1 -1 0 ) ( 0 0 1 ) cart. s( 3) = ( -0.5000000 -0.8660254 0.0000000 ) ( 0.8660254 -0.5000000 0.0000000 ) ( 0.0000000 0.0000000 1.0000000 ) isym = 4 120 deg rotation - cryst. axis [0,0,-1] cryst. s( 4) = ( -1 -1 0 ) ( 1 0 0 ) ( 0 0 1 ) cart. s( 4) = ( -0.5000000 0.8660254 -0.0000000 ) ( -0.8660254 -0.5000000 0.0000000 ) ( 0.0000000 0.0000000 1.0000000 ) isym = 5 180 deg rotation - cryst. axis [0,1,0] cryst. s( 5) = ( -1 -1 0 ) ( 0 1 0 ) ( 0 0 -1 ) cart. s( 5) = ( -0.5000000 -0.8660254 0.0000000 ) ( -0.8660254 0.5000000 -0.0000000 ) ( 0.0000000 0.0000000 -1.0000000 ) isym = 6 180 deg rotation - cryst. axis [1,1,0] cryst. s( 6) = ( 0 1 0 ) ( 1 0 0 ) ( 0 0 -1 ) cart. s( 6) = ( -0.5000000 0.8660254 -0.0000000 ) ( 0.8660254 0.5000000 -0.0000000 ) ( 0.0000000 0.0000000 -1.0000000 ) isym = 7 inversion cryst. s( 7) = ( -1 0 0 ) ( 0 -1 0 ) ( 0 0 -1 ) cart. s( 7) = ( -1.0000000 0.0000000 0.0000000 ) ( 0.0000000 -1.0000000 -0.0000000 ) ( 0.0000000 0.0000000 -1.0000000 ) isym = 8 inv. 180 deg rotation - cart. axis [1,0,0] cryst. s( 8) = ( -1 0 0 ) ( 1 1 0 ) ( 0 0 1 ) cart. s( 8) = ( -1.0000000 -0.0000000 0.0000000 ) ( 0.0000000 1.0000000 0.0000000 ) ( 0.0000000 0.0000000 1.0000000 ) isym = 9 inv. 120 deg rotation - cryst. axis [0,0,1] cryst. s( 9) = ( 0 -1 0 ) ( 1 1 0 ) ( 0 0 -1 ) cart. s( 9) = ( 0.5000000 0.8660254 -0.0000000 ) ( -0.8660254 0.5000000 -0.0000000 ) ( 0.0000000 0.0000000 -1.0000000 ) isym = 10 inv. 120 deg rotation - cryst. axis [0,0,-1] cryst. s(10) = ( 1 1 0 ) ( -1 0 0 ) ( 0 0 -1 ) cart. s(10) = ( 0.5000000 -0.8660254 0.0000000 ) ( 0.8660254 0.5000000 -0.0000000 ) ( 0.0000000 0.0000000 -1.0000000 ) isym = 11 inv. 180 deg rotation - cryst. axis [0,1,0] cryst. s(11) = ( 1 1 0 ) ( 0 -1 0 ) ( 0 0 1 ) cart. s(11) = ( 0.5000000 0.8660254 -0.0000000 ) ( 0.8660254 -0.5000000 0.0000000 ) ( 0.0000000 0.0000000 1.0000000 ) isym = 12 inv. 180 deg rotation - cryst. axis [1,1,0] cryst. s(12) = ( 0 -1 0 ) ( -1 0 0 ) ( 0 0 1 ) cart. s(12) = ( 0.5000000 -0.8660254 0.0000000 ) ( -0.8660254 -0.5000000 0.0000000 ) ( 0.0000000 0.0000000 1.0000000 ) double point group D_3d (-3m) there are 12 classes and 6 irreducible representations the character table: E -E 2C3 -2C3 3C2' -3C2' i -i 2S6 -2S6 3s_v -3s_v G_4+ 2.00 -2.00 1.00 -1.00 0.00 0.00 2.00 -2.00 1.00 -1.00 0.00 0.00 G_5+ 1.00 -1.00 -1.00 1.00 0.00 0.00 1.00 -1.00 -1.00 1.00 0.00 0.00 G_6+ 1.00 -1.00 -1.00 1.00 0.00 0.00 1.00 -1.00 -1.00 1.00 0.00 0.00 G_4- 2.00 -2.00 1.00 -1.00 0.00 0.00 -2.00 2.00 -1.00 1.00 0.00 0.00 G_5- 1.00 -1.00 -1.00 1.00 0.00 0.00 -1.00 1.00 1.00 -1.00 0.00 0.00 G_6- 1.00 -1.00 -1.00 1.00 0.00 0.00 -1.00 1.00 1.00 -1.00 0.00 0.00 imaginary part E -E 2C3 -2C3 3C2' -3C2' i -i 2S6 -2S6 3s_v -3s_v G_4+ 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 G_5+ 0.00 0.00 0.00 0.00 1.00 -1.00 0.00 0.00 0.00 0.00 1.00 -1.00 G_6+ 0.00 0.00 0.00 0.00 -1.00 1.00 0.00 0.00 0.00 0.00 -1.00 1.00 G_4- 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 G_5- 0.00 0.00 0.00 0.00 1.00 -1.00 0.00 0.00 0.00 0.00 -1.00 1.00 G_6- 0.00 0.00 0.00 0.00 -1.00 1.00 0.00 0.00 0.00 0.00 1.00 -1.00 the symmetry operations in each class and the name of the first element: E 1 identity -E -1 identity E 2C3 3 4 120 deg rotation - cryst. axis [0,0,1] -2C3 -3 -4 120 deg rotation - cryst. axis [0,0,1] E 3C2' 2 5 -6 180 deg rotation - cart. axis [1,0,0] 3C2' 6 -5 -2 180 deg rotation - cryst. axis [1,1,0] i 7 inversion -i -7 inversion E 2S6 9 10 inv. 120 deg rotation - cryst. axis [0,0,1] -2S6 -9 -10 inv. 120 deg rotation - cryst. axis [0,0,1] E 3s_v 8 11 -12 inv. 180 deg rotation - cart. axis [1,0,0] 3s_v 12 -11 -8 inv. 180 deg rotation - cryst. axis [1,1,0] Cartesian axes number of k points= 272 Fermi-Dirac smearing, width (Ry)= 0.0010 cart. coord. in units 2pi/alat k( 1) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0036765 k( 2) = ( 0.0135135 0.0078020 -0.0000000), wk = 0.0036765 k( 3) = ( 0.0270270 0.0156041 -0.0000000), wk = 0.0036765 k( 4) = ( 0.0405405 0.0234061 -0.0000000), wk = 0.0036765 k( 5) = ( 0.0540540 0.0312081 -0.0000000), wk = 0.0036765 k( 6) = ( 0.0675676 0.0390102 -0.0000000), wk = 0.0036765 k( 7) = ( 0.0810811 0.0468122 -0.0000000), wk = 0.0036765 k( 8) = ( 0.0945946 0.0546142 -0.0000000), wk = 0.0036765 k( 9) = ( 0.1081081 0.0624162 -0.0000000), wk = 0.0036765 k( 10) = ( 0.1216216 0.0702183 -0.0000000), wk = 0.0036765 k( 11) = ( 0.1351351 0.0780203 -0.0000000), wk = 0.0036765 k( 12) = ( 0.1486486 0.0858223 -0.0000000), wk = 0.0036765 k( 13) = ( 0.1621622 0.0936244 -0.0000000), wk = 0.0036765 k( 14) = ( 0.1756757 0.1014264 -0.0000000), wk = 0.0036765 k( 15) = ( 0.1891892 0.1092284 -0.0000000), wk = 0.0036765 k( 16) = ( 0.2027027 0.1170305 -0.0000000), wk = 0.0036765 k( 17) = ( 0.2162162 0.1248325 -0.0000000), wk = 0.0036765 k( 18) = ( 0.2297297 0.1326345 -0.0000000), wk = 0.0036765 k( 19) = ( 0.2432432 0.1404366 -0.0000000), wk = 0.0036765 k( 20) = ( 0.2567568 0.1482386 -0.0000000), wk = 0.0036765 k( 21) = ( 0.2702703 0.1560406 -0.0000000), wk = 0.0036765 k( 22) = ( 0.2837838 0.1638426 -0.0000000), wk = 0.0036765 k( 23) = ( 0.2972973 0.1716447 -0.0000000), wk = 0.0036765 k( 24) = ( 0.3108108 0.1794467 -0.0000000), wk = 0.0036765 k( 25) = ( 0.3243243 0.1872487 -0.0000000), wk = 0.0036765 k( 26) = ( 0.3378378 0.1950508 -0.0000000), wk = 0.0036765 k( 27) = ( 0.3513514 0.2028528 -0.0000000), wk = 0.0036765 k( 28) = ( 0.3648649 0.2106548 -0.0000000), wk = 0.0036765 k( 29) = ( 0.3783784 0.2184569 -0.0000000), wk = 0.0036765 k( 30) = ( 0.3918919 0.2262589 -0.0000000), wk = 0.0036765 k( 31) = ( 0.4054054 0.2340609 -0.0000000), wk = 0.0036765 k( 32) = ( 0.4189189 0.2418630 -0.0000000), wk = 0.0036765 k( 33) = ( 0.4324324 0.2496650 -0.0000000), wk = 0.0036765 k( 34) = ( 0.4459459 0.2574670 -0.0000000), wk = 0.0036765 k( 35) = ( 0.4594595 0.2652690 -0.0000000), wk = 0.0036765 k( 36) = ( 0.4729730 0.2730711 -0.0000000), wk = 0.0036765 k( 37) = ( 0.4864865 0.2808731 -0.0000000), wk = 0.0036765 k( 38) = ( 0.5000000 0.2886751 -0.0000000), wk = 0.0036765 k( 39) = ( 0.5000000 0.2886751 -0.0000000), wk = 0.0036765 k( 40) = ( 0.4920635 0.3024216 -0.0000000), wk = 0.0036765 k( 41) = ( 0.4841270 0.3161680 -0.0000000), wk = 0.0036765 k( 42) = ( 0.4761905 0.3299144 -0.0000000), wk = 0.0036765 k( 43) = ( 0.4682540 0.3436609 -0.0000000), wk = 0.0036765 k( 44) = ( 0.4603175 0.3574073 -0.0000000), wk = 0.0036765 k( 45) = ( 0.4523810 0.3711537 -0.0000000), wk = 0.0036765 k( 46) = ( 0.4444444 0.3849002 -0.0000000), wk = 0.0036765 k( 47) = ( 0.4365079 0.3986466 -0.0000000), wk = 0.0036765 k( 48) = ( 0.4285714 0.4123930 -0.0000000), wk = 0.0036765 k( 49) = ( 0.4206349 0.4261395 -0.0000000), wk = 0.0036765 k( 50) = ( 0.4126984 0.4398859 -0.0000000), wk = 0.0036765 k( 51) = ( 0.4047619 0.4536324 -0.0000000), wk = 0.0036765 k( 52) = ( 0.3968254 0.4673788 -0.0000000), wk = 0.0036765 k( 53) = ( 0.3888889 0.4811252 -0.0000000), wk = 0.0036765 k( 54) = ( 0.3809524 0.4948717 -0.0000000), wk = 0.0036765 k( 55) = ( 0.3730159 0.5086181 -0.0000000), wk = 0.0036765 k( 56) = ( 0.3650794 0.5223645 -0.0000000), wk = 0.0036765 k( 57) = ( 0.3571429 0.5361110 -0.0000000), wk = 0.0036765 k( 58) = ( 0.3492063 0.5498574 -0.0000000), wk = 0.0036765 k( 59) = ( 0.3412698 0.5636038 -0.0000000), wk = 0.0036765 k( 60) = ( 0.3333333 0.5773503 -0.0000000), wk = 0.0036765 k( 61) = ( 0.3333333 0.5773503 -0.0000000), wk = 0.0036765 k( 62) = ( 0.3253968 0.5636038 -0.0000000), wk = 0.0036765 k( 63) = ( 0.3174603 0.5498574 -0.0000000), wk = 0.0036765 k( 64) = ( 0.3095238 0.5361110 -0.0000000), wk = 0.0036765 k( 65) = ( 0.3015873 0.5223645 -0.0000000), wk = 0.0036765 k( 66) = ( 0.2936508 0.5086181 -0.0000000), wk = 0.0036765 k( 67) = ( 0.2857143 0.4948717 -0.0000000), wk = 0.0036765 k( 68) = ( 0.2777778 0.4811252 -0.0000000), wk = 0.0036765 k( 69) = ( 0.2698413 0.4673788 -0.0000000), wk = 0.0036765 k( 70) = ( 0.2619048 0.4536324 -0.0000000), wk = 0.0036765 k( 71) = ( 0.2539683 0.4398859 -0.0000000), wk = 0.0036765 k( 72) = ( 0.2460317 0.4261395 -0.0000000), wk = 0.0036765 k( 73) = ( 0.2380952 0.4123931 -0.0000000), wk = 0.0036765 k( 74) = ( 0.2301587 0.3986466 -0.0000000), wk = 0.0036765 k( 75) = ( 0.2222222 0.3849002 -0.0000000), wk = 0.0036765 k( 76) = ( 0.2142857 0.3711537 -0.0000000), wk = 0.0036765 k( 77) = ( 0.2063492 0.3574073 -0.0000000), wk = 0.0036765 k( 78) = ( 0.1984127 0.3436609 -0.0000000), wk = 0.0036765 k( 79) = ( 0.1904762 0.3299144 -0.0000000), wk = 0.0036765 k( 80) = ( 0.1825397 0.3161680 -0.0000000), wk = 0.0036765 k( 81) = ( 0.1746032 0.3024216 -0.0000000), wk = 0.0036765 k( 82) = ( 0.1666667 0.2886751 -0.0000000), wk = 0.0036765 k( 83) = ( 0.1587302 0.2749287 -0.0000000), wk = 0.0036765 k( 84) = ( 0.1507937 0.2611823 -0.0000000), wk = 0.0036765 k( 85) = ( 0.1428571 0.2474358 -0.0000000), wk = 0.0036765 k( 86) = ( 0.1349206 0.2336894 -0.0000000), wk = 0.0036765 k( 87) = ( 0.1269841 0.2199430 -0.0000000), wk = 0.0036765 k( 88) = ( 0.1190476 0.2061965 -0.0000000), wk = 0.0036765 k( 89) = ( 0.1111111 0.1924501 -0.0000000), wk = 0.0036765 k( 90) = ( 0.1031746 0.1787036 -0.0000000), wk = 0.0036765 k( 91) = ( 0.0952381 0.1649572 -0.0000000), wk = 0.0036765 k( 92) = ( 0.0873016 0.1512108 -0.0000000), wk = 0.0036765 k( 93) = ( 0.0793651 0.1374644 -0.0000000), wk = 0.0036765 k( 94) = ( 0.0714286 0.1237179 -0.0000000), wk = 0.0036765 k( 95) = ( 0.0634921 0.1099715 -0.0000000), wk = 0.0036765 k( 96) = ( 0.0555556 0.0962251 -0.0000000), wk = 0.0036765 k( 97) = ( 0.0476191 0.0824786 -0.0000000), wk = 0.0036765 k( 98) = ( 0.0396825 0.0687322 -0.0000000), wk = 0.0036765 k( 99) = ( 0.0317460 0.0549857 -0.0000000), wk = 0.0036765 k( 100) = ( 0.0238095 0.0412393 -0.0000000), wk = 0.0036765 k( 101) = ( 0.0158730 0.0274929 -0.0000000), wk = 0.0036765 k( 102) = ( 0.0079365 0.0137464 -0.0000000), wk = 0.0036765 k( 103) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0036765 k( 104) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0036765 k( 105) = ( 0.0000000 0.0000000 0.0156257), wk = 0.0036765 k( 106) = ( 0.0000000 0.0000000 0.0312514), wk = 0.0036765 k( 107) = ( 0.0000000 0.0000000 0.0468770), wk = 0.0036765 k( 108) = ( 0.0000000 0.0000000 0.0625027), wk = 0.0036765 k( 109) = ( 0.0000000 0.0000000 0.0781284), wk = 0.0036765 k( 110) = ( 0.0000000 0.0000000 0.0937541), wk = 0.0036765 k( 111) = ( 0.0000000 0.0000000 0.1093798), wk = 0.0036765 k( 112) = ( 0.0000000 0.0000000 0.1250055), wk = 0.0036765 k( 113) = ( 0.0000000 0.0000000 0.1406311), wk = 0.0036765 k( 114) = ( 0.0000000 0.0000000 0.1562568), wk = 0.0036765 k( 115) = ( 0.0000000 0.0000000 0.1718825), wk = 0.0036765 k( 116) = ( 0.0000000 0.0000000 0.1875082), wk = 0.0036765 k( 117) = ( 0.0000000 0.0000000 0.2031339), wk = 0.0036765 k( 118) = ( 0.0000000 0.0000000 0.2187595), wk = 0.0036765 k( 119) = ( 0.0000000 0.0000000 0.2343852), wk = 0.0036765 k( 120) = ( 0.0000000 0.0000000 0.2500109), wk = 0.0036765 k( 121) = ( 0.0000000 0.0000000 0.2656366), wk = 0.0036765 k( 122) = ( 0.0000000 0.0000000 0.2812623), wk = 0.0036765 k( 123) = ( 0.0000000 0.0000000 0.2968880), wk = 0.0036765 k( 124) = ( 0.0000000 0.0000000 0.3125136), wk = 0.0036765 k( 125) = ( 0.0000000 0.0000000 0.3281393), wk = 0.0036765 k( 126) = ( 0.0000000 0.0000000 0.3281393), wk = 0.0036765 k( 127) = ( 0.0135135 0.0078020 0.3281393), wk = 0.0036765 k( 128) = ( 0.0270270 0.0156041 0.3281393), wk = 0.0036765 k( 129) = ( 0.0405405 0.0234061 0.3281393), wk = 0.0036765 k( 130) = ( 0.0540540 0.0312081 0.3281393), wk = 0.0036765 k( 131) = ( 0.0675676 0.0390102 0.3281393), wk = 0.0036765 k( 132) = ( 0.0810811 0.0468122 0.3281393), wk = 0.0036765 k( 133) = ( 0.0945946 0.0546142 0.3281393), wk = 0.0036765 k( 134) = ( 0.1081081 0.0624162 0.3281393), wk = 0.0036765 k( 135) = ( 0.1216216 0.0702183 0.3281393), wk = 0.0036765 k( 136) = ( 0.1351351 0.0780203 0.3281393), wk = 0.0036765 k( 137) = ( 0.1486486 0.0858223 0.3281393), wk = 0.0036765 k( 138) = ( 0.1621622 0.0936244 0.3281393), wk = 0.0036765 k( 139) = ( 0.1756757 0.1014264 0.3281393), wk = 0.0036765 k( 140) = ( 0.1891892 0.1092284 0.3281393), wk = 0.0036765 k( 141) = ( 0.2027027 0.1170305 0.3281393), wk = 0.0036765 k( 142) = ( 0.2162162 0.1248325 0.3281393), wk = 0.0036765 k( 143) = ( 0.2297297 0.1326345 0.3281393), wk = 0.0036765 k( 144) = ( 0.2432432 0.1404366 0.3281393), wk = 0.0036765 k( 145) = ( 0.2567568 0.1482386 0.3281393), wk = 0.0036765 k( 146) = ( 0.2702703 0.1560406 0.3281393), wk = 0.0036765 k( 147) = ( 0.2837838 0.1638426 0.3281393), wk = 0.0036765 k( 148) = ( 0.2972973 0.1716447 0.3281393), wk = 0.0036765 k( 149) = ( 0.3108108 0.1794467 0.3281393), wk = 0.0036765 k( 150) = ( 0.3243243 0.1872487 0.3281393), wk = 0.0036765 k( 151) = ( 0.3378378 0.1950508 0.3281393), wk = 0.0036765 k( 152) = ( 0.3513514 0.2028528 0.3281393), wk = 0.0036765 k( 153) = ( 0.3648649 0.2106548 0.3281393), wk = 0.0036765 k( 154) = ( 0.3783784 0.2184569 0.3281393), wk = 0.0036765 k( 155) = ( 0.3918919 0.2262589 0.3281393), wk = 0.0036765 k( 156) = ( 0.4054054 0.2340609 0.3281393), wk = 0.0036765 k( 157) = ( 0.4189189 0.2418630 0.3281393), wk = 0.0036765 k( 158) = ( 0.4324324 0.2496650 0.3281393), wk = 0.0036765 k( 159) = ( 0.4459459 0.2574670 0.3281393), wk = 0.0036765 k( 160) = ( 0.4594595 0.2652690 0.3281393), wk = 0.0036765 k( 161) = ( 0.4729730 0.2730711 0.3281393), wk = 0.0036765 k( 162) = ( 0.4864865 0.2808731 0.3281393), wk = 0.0036765 k( 163) = ( 0.5000000 0.2886751 0.3281393), wk = 0.0036765 k( 164) = ( 0.5000000 0.2886751 0.3281393), wk = 0.0036765 k( 165) = ( 0.4920635 0.3024216 0.3281393), wk = 0.0036765 k( 166) = ( 0.4841270 0.3161680 0.3281393), wk = 0.0036765 k( 167) = ( 0.4761905 0.3299144 0.3281393), wk = 0.0036765 k( 168) = ( 0.4682540 0.3436609 0.3281393), wk = 0.0036765 k( 169) = ( 0.4603175 0.3574073 0.3281393), wk = 0.0036765 k( 170) = ( 0.4523810 0.3711537 0.3281393), wk = 0.0036765 k( 171) = ( 0.4444444 0.3849002 0.3281393), wk = 0.0036765 k( 172) = ( 0.4365079 0.3986466 0.3281393), wk = 0.0036765 k( 173) = ( 0.4285714 0.4123930 0.3281393), wk = 0.0036765 k( 174) = ( 0.4206349 0.4261395 0.3281393), wk = 0.0036765 k( 175) = ( 0.4126984 0.4398859 0.3281393), wk = 0.0036765 k( 176) = ( 0.4047619 0.4536324 0.3281393), wk = 0.0036765 k( 177) = ( 0.3968254 0.4673788 0.3281393), wk = 0.0036765 k( 178) = ( 0.3888889 0.4811252 0.3281393), wk = 0.0036765 k( 179) = ( 0.3809524 0.4948717 0.3281393), wk = 0.0036765 k( 180) = ( 0.3730159 0.5086181 0.3281393), wk = 0.0036765 k( 181) = ( 0.3650794 0.5223645 0.3281393), wk = 0.0036765 k( 182) = ( 0.3571429 0.5361110 0.3281393), wk = 0.0036765 k( 183) = ( 0.3492063 0.5498574 0.3281393), wk = 0.0036765 k( 184) = ( 0.3412698 0.5636038 0.3281393), wk = 0.0036765 k( 185) = ( 0.3333333 0.5773503 0.3281393), wk = 0.0036765 k( 186) = ( 0.3333333 0.5773503 0.3281393), wk = 0.0036765 k( 187) = ( 0.3253968 0.5636038 0.3281393), wk = 0.0036765 k( 188) = ( 0.3174603 0.5498574 0.3281393), wk = 0.0036765 k( 189) = ( 0.3095238 0.5361110 0.3281393), wk = 0.0036765 k( 190) = ( 0.3015873 0.5223645 0.3281393), wk = 0.0036765 k( 191) = ( 0.2936508 0.5086181 0.3281393), wk = 0.0036765 k( 192) = ( 0.2857143 0.4948717 0.3281393), wk = 0.0036765 k( 193) = ( 0.2777778 0.4811252 0.3281393), wk = 0.0036765 k( 194) = ( 0.2698413 0.4673788 0.3281393), wk = 0.0036765 k( 195) = ( 0.2619048 0.4536324 0.3281393), wk = 0.0036765 k( 196) = ( 0.2539683 0.4398859 0.3281393), wk = 0.0036765 k( 197) = ( 0.2460317 0.4261395 0.3281393), wk = 0.0036765 k( 198) = ( 0.2380952 0.4123931 0.3281393), wk = 0.0036765 k( 199) = ( 0.2301587 0.3986466 0.3281393), wk = 0.0036765 k( 200) = ( 0.2222222 0.3849002 0.3281393), wk = 0.0036765 k( 201) = ( 0.2142857 0.3711537 0.3281393), wk = 0.0036765 k( 202) = ( 0.2063492 0.3574073 0.3281393), wk = 0.0036765 k( 203) = ( 0.1984127 0.3436609 0.3281393), wk = 0.0036765 k( 204) = ( 0.1904762 0.3299144 0.3281393), wk = 0.0036765 k( 205) = ( 0.1825397 0.3161680 0.3281393), wk = 0.0036765 k( 206) = ( 0.1746032 0.3024216 0.3281393), wk = 0.0036765 k( 207) = ( 0.1666667 0.2886751 0.3281393), wk = 0.0036765 k( 208) = ( 0.1587302 0.2749287 0.3281393), wk = 0.0036765 k( 209) = ( 0.1507937 0.2611823 0.3281393), wk = 0.0036765 k( 210) = ( 0.1428571 0.2474358 0.3281393), wk = 0.0036765 k( 211) = ( 0.1349206 0.2336894 0.3281393), wk = 0.0036765 k( 212) = ( 0.1269841 0.2199430 0.3281393), wk = 0.0036765 k( 213) = ( 0.1190476 0.2061965 0.3281393), wk = 0.0036765 k( 214) = ( 0.1111111 0.1924501 0.3281393), wk = 0.0036765 k( 215) = ( 0.1031746 0.1787036 0.3281393), wk = 0.0036765 k( 216) = ( 0.0952381 0.1649572 0.3281393), wk = 0.0036765 k( 217) = ( 0.0873016 0.1512108 0.3281393), wk = 0.0036765 k( 218) = ( 0.0793651 0.1374644 0.3281393), wk = 0.0036765 k( 219) = ( 0.0714286 0.1237179 0.3281393), wk = 0.0036765 k( 220) = ( 0.0634921 0.1099715 0.3281393), wk = 0.0036765 k( 221) = ( 0.0555556 0.0962251 0.3281393), wk = 0.0036765 k( 222) = ( 0.0476191 0.0824786 0.3281393), wk = 0.0036765 k( 223) = ( 0.0396825 0.0687322 0.3281393), wk = 0.0036765 k( 224) = ( 0.0317460 0.0549857 0.3281393), wk = 0.0036765 k( 225) = ( 0.0238095 0.0412393 0.3281393), wk = 0.0036765 k( 226) = ( 0.0158730 0.0274929 0.3281393), wk = 0.0036765 k( 227) = ( 0.0079365 0.0137464 0.3281393), wk = 0.0036765 k( 228) = ( 0.0000000 0.0000000 0.3281393), wk = 0.0036765 k( 229) = ( 0.5000000 0.2886751 0.3281393), wk = 0.0036765 k( 230) = ( 0.5000000 0.2886751 0.3125136), wk = 0.0036765 k( 231) = ( 0.5000000 0.2886751 0.2968880), wk = 0.0036765 k( 232) = ( 0.5000000 0.2886751 0.2812623), wk = 0.0036765 k( 233) = ( 0.5000000 0.2886751 0.2656366), wk = 0.0036765 k( 234) = ( 0.5000000 0.2886751 0.2500109), wk = 0.0036765 k( 235) = ( 0.5000000 0.2886751 0.2343852), wk = 0.0036765 k( 236) = ( 0.5000000 0.2886751 0.2187595), wk = 0.0036765 k( 237) = ( 0.5000000 0.2886751 0.2031339), wk = 0.0036765 k( 238) = ( 0.5000000 0.2886751 0.1875082), wk = 0.0036765 k( 239) = ( 0.5000000 0.2886751 0.1718825), wk = 0.0036765 k( 240) = ( 0.5000000 0.2886751 0.1562568), wk = 0.0036765 k( 241) = ( 0.5000000 0.2886751 0.1406311), wk = 0.0036765 k( 242) = ( 0.5000000 0.2886751 0.1250055), wk = 0.0036765 k( 243) = ( 0.5000000 0.2886751 0.1093798), wk = 0.0036765 k( 244) = ( 0.5000000 0.2886751 0.0937541), wk = 0.0036765 k( 245) = ( 0.5000000 0.2886751 0.0781284), wk = 0.0036765 k( 246) = ( 0.5000000 0.2886751 0.0625027), wk = 0.0036765 k( 247) = ( 0.5000000 0.2886751 0.0468770), wk = 0.0036765 k( 248) = ( 0.5000000 0.2886751 0.0312514), wk = 0.0036765 k( 249) = ( 0.5000000 0.2886751 0.0156257), wk = 0.0036765 k( 250) = ( 0.5000000 0.2886751 -0.0000000), wk = 0.0036765 k( 251) = ( 0.3333333 0.5773503 -0.0000000), wk = 0.0036765 k( 252) = ( 0.3333333 0.5773503 0.0156257), wk = 0.0036765 k( 253) = ( 0.3333333 0.5773503 0.0312514), wk = 0.0036765 k( 254) = ( 0.3333333 0.5773503 0.0468770), wk = 0.0036765 k( 255) = ( 0.3333333 0.5773503 0.0625027), wk = 0.0036765 k( 256) = ( 0.3333333 0.5773503 0.0781284), wk = 0.0036765 k( 257) = ( 0.3333333 0.5773503 0.0937541), wk = 0.0036765 k( 258) = ( 0.3333333 0.5773503 0.1093798), wk = 0.0036765 k( 259) = ( 0.3333333 0.5773503 0.1250055), wk = 0.0036765 k( 260) = ( 0.3333333 0.5773503 0.1406311), wk = 0.0036765 k( 261) = ( 0.3333333 0.5773503 0.1562568), wk = 0.0036765 k( 262) = ( 0.3333333 0.5773503 0.1718825), wk = 0.0036765 k( 263) = ( 0.3333333 0.5773503 0.1875082), wk = 0.0036765 k( 264) = ( 0.3333333 0.5773503 0.2031339), wk = 0.0036765 k( 265) = ( 0.3333333 0.5773503 0.2187595), wk = 0.0036765 k( 266) = ( 0.3333333 0.5773503 0.2343852), wk = 0.0036765 k( 267) = ( 0.3333333 0.5773503 0.2500109), wk = 0.0036765 k( 268) = ( 0.3333333 0.5773503 0.2656366), wk = 0.0036765 k( 269) = ( 0.3333333 0.5773503 0.2812623), wk = 0.0036765 k( 270) = ( 0.3333333 0.5773503 0.2968880), wk = 0.0036765 k( 271) = ( 0.3333333 0.5773503 0.3125136), wk = 0.0036765 k( 272) = ( 0.3333333 0.5773503 0.3281393), wk = 0.0036765 cryst. coord. k( 1) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0036765 k( 2) = ( 0.0135135 -0.0000000 -0.0000000), wk = 0.0036765 k( 3) = ( 0.0270270 -0.0000000 0.0000000), wk = 0.0036765 k( 4) = ( 0.0405405 -0.0000000 -0.0000000), wk = 0.0036765 k( 5) = ( 0.0540540 -0.0000000 -0.0000000), wk = 0.0036765 k( 6) = ( 0.0675676 -0.0000000 -0.0000000), wk = 0.0036765 k( 7) = ( 0.0810811 -0.0000000 -0.0000000), wk = 0.0036765 k( 8) = ( 0.0945946 -0.0000000 0.0000000), wk = 0.0036765 k( 9) = ( 0.1081081 -0.0000000 -0.0000000), wk = 0.0036765 k( 10) = ( 0.1216216 -0.0000000 -0.0000000), wk = 0.0036765 k( 11) = ( 0.1351351 -0.0000000 -0.0000000), wk = 0.0036765 k( 12) = ( 0.1486486 -0.0000000 -0.0000000), wk = 0.0036765 k( 13) = ( 0.1621622 -0.0000000 -0.0000000), wk = 0.0036765 k( 14) = ( 0.1756757 -0.0000000 -0.0000000), wk = 0.0036765 k( 15) = ( 0.1891892 -0.0000000 -0.0000000), wk = 0.0036765 k( 16) = ( 0.2027027 -0.0000000 -0.0000000), wk = 0.0036765 k( 17) = ( 0.2162162 -0.0000000 -0.0000000), wk = 0.0036765 k( 18) = ( 0.2297297 0.0000000 -0.0000000), wk = 0.0036765 k( 19) = ( 0.2432432 -0.0000000 -0.0000000), wk = 0.0036765 k( 20) = ( 0.2567568 -0.0000000 -0.0000000), wk = 0.0036765 k( 21) = ( 0.2702703 -0.0000000 0.0000000), wk = 0.0036765 k( 22) = ( 0.2837838 -0.0000000 -0.0000000), wk = 0.0036765 k( 23) = ( 0.2972973 -0.0000000 -0.0000000), wk = 0.0036765 k( 24) = ( 0.3108108 -0.0000000 -0.0000000), wk = 0.0036765 k( 25) = ( 0.3243243 -0.0000000 -0.0000000), wk = 0.0036765 k( 26) = ( 0.3378378 -0.0000000 -0.0000000), wk = 0.0036765 k( 27) = ( 0.3513514 0.0000000 -0.0000000), wk = 0.0036765 k( 28) = ( 0.3648649 -0.0000000 -0.0000000), wk = 0.0036765 k( 29) = ( 0.3783784 -0.0000000 -0.0000000), wk = 0.0036765 k( 30) = ( 0.3918919 -0.0000000 0.0000000), wk = 0.0036765 k( 31) = ( 0.4054054 -0.0000000 -0.0000000), wk = 0.0036765 k( 32) = ( 0.4189189 -0.0000000 -0.0000000), wk = 0.0036765 k( 33) = ( 0.4324324 -0.0000000 -0.0000000), wk = 0.0036765 k( 34) = ( 0.4459459 0.0000000 -0.0000000), wk = 0.0036765 k( 35) = ( 0.4594595 0.0000000 -0.0000000), wk = 0.0036765 k( 36) = ( 0.4729730 -0.0000000 -0.0000000), wk = 0.0036765 k( 37) = ( 0.4864865 -0.0000000 -0.0000000), wk = 0.0036765 k( 38) = ( 0.5000000 0.0000000 -0.0000000), wk = 0.0036765 k( 39) = ( 0.5000000 0.0000000 -0.0000000), wk = 0.0036765 k( 40) = ( 0.4920635 0.0158730 -0.0000000), wk = 0.0036765 k( 41) = ( 0.4841270 0.0317460 0.0000000), wk = 0.0036765 k( 42) = ( 0.4761905 0.0476190 -0.0000000), wk = 0.0036765 k( 43) = ( 0.4682540 0.0634921 -0.0000000), wk = 0.0036765 k( 44) = ( 0.4603175 0.0793651 -0.0000000), wk = 0.0036765 k( 45) = ( 0.4523810 0.0952381 0.0000000), wk = 0.0036765 k( 46) = ( 0.4444444 0.1111111 0.0000000), wk = 0.0036765 k( 47) = ( 0.4365079 0.1269841 0.0000000), wk = 0.0036765 k( 48) = ( 0.4285714 0.1428571 -0.0000000), wk = 0.0036765 k( 49) = ( 0.4206349 0.1587302 0.0000000), wk = 0.0036765 k( 50) = ( 0.4126984 0.1746032 0.0000000), wk = 0.0036765 k( 51) = ( 0.4047619 0.1904762 -0.0000000), wk = 0.0036765 k( 52) = ( 0.3968254 0.2063492 0.0000000), wk = 0.0036765 k( 53) = ( 0.3888889 0.2222222 0.0000000), wk = 0.0036765 k( 54) = ( 0.3809524 0.2380952 0.0000000), wk = 0.0036765 k( 55) = ( 0.3730159 0.2539683 -0.0000000), wk = 0.0036765 k( 56) = ( 0.3650794 0.2698413 -0.0000000), wk = 0.0036765 k( 57) = ( 0.3571429 0.2857143 -0.0000000), wk = 0.0036765 k( 58) = ( 0.3492063 0.3015873 -0.0000000), wk = 0.0036765 k( 59) = ( 0.3412698 0.3174603 -0.0000000), wk = 0.0036765 k( 60) = ( 0.3333333 0.3333333 -0.0000000), wk = 0.0036765 k( 61) = ( 0.3333333 0.3333333 -0.0000000), wk = 0.0036765 k( 62) = ( 0.3253968 0.3253968 -0.0000000), wk = 0.0036765 k( 63) = ( 0.3174603 0.3174603 0.0000000), wk = 0.0036765 k( 64) = ( 0.3095238 0.3095238 0.0000000), wk = 0.0036765 k( 65) = ( 0.3015873 0.3015873 -0.0000000), wk = 0.0036765 k( 66) = ( 0.2936508 0.2936508 -0.0000000), wk = 0.0036765 k( 67) = ( 0.2857143 0.2857143 0.0000000), wk = 0.0036765 k( 68) = ( 0.2777778 0.2777778 -0.0000000), wk = 0.0036765 k( 69) = ( 0.2698413 0.2698413 -0.0000000), wk = 0.0036765 k( 70) = ( 0.2619048 0.2619048 -0.0000000), wk = 0.0036765 k( 71) = ( 0.2539683 0.2539683 -0.0000000), wk = 0.0036765 k( 72) = ( 0.2460317 0.2460317 -0.0000000), wk = 0.0036765 k( 73) = ( 0.2380952 0.2380952 -0.0000000), wk = 0.0036765 k( 74) = ( 0.2301587 0.2301587 -0.0000000), wk = 0.0036765 k( 75) = ( 0.2222222 0.2222222 0.0000000), wk = 0.0036765 k( 76) = ( 0.2142857 0.2142857 -0.0000000), wk = 0.0036765 k( 77) = ( 0.2063492 0.2063492 -0.0000000), wk = 0.0036765 k( 78) = ( 0.1984127 0.1984127 0.0000000), wk = 0.0036765 k( 79) = ( 0.1904762 0.1904762 -0.0000000), wk = 0.0036765 k( 80) = ( 0.1825397 0.1825397 0.0000000), wk = 0.0036765 k( 81) = ( 0.1746032 0.1746032 -0.0000000), wk = 0.0036765 k( 82) = ( 0.1666667 0.1666667 0.0000000), wk = 0.0036765 k( 83) = ( 0.1587302 0.1587302 0.0000000), wk = 0.0036765 k( 84) = ( 0.1507937 0.1507937 -0.0000000), wk = 0.0036765 k( 85) = ( 0.1428571 0.1428571 0.0000000), wk = 0.0036765 k( 86) = ( 0.1349206 0.1349206 -0.0000000), wk = 0.0036765 k( 87) = ( 0.1269841 0.1269841 -0.0000000), wk = 0.0036765 k( 88) = ( 0.1190476 0.1190476 -0.0000000), wk = 0.0036765 k( 89) = ( 0.1111111 0.1111111 0.0000000), wk = 0.0036765 k( 90) = ( 0.1031746 0.1031746 0.0000000), wk = 0.0036765 k( 91) = ( 0.0952381 0.0952381 0.0000000), wk = 0.0036765 k( 92) = ( 0.0873016 0.0873016 0.0000000), wk = 0.0036765 k( 93) = ( 0.0793651 0.0793651 0.0000000), wk = 0.0036765 k( 94) = ( 0.0714286 0.0714286 0.0000000), wk = 0.0036765 k( 95) = ( 0.0634921 0.0634921 0.0000000), wk = 0.0036765 k( 96) = ( 0.0555556 0.0555556 0.0000000), wk = 0.0036765 k( 97) = ( 0.0476191 0.0476191 0.0000000), wk = 0.0036765 k( 98) = ( 0.0396825 0.0396825 0.0000000), wk = 0.0036765 k( 99) = ( 0.0317460 0.0317460 0.0000000), wk = 0.0036765 k( 100) = ( 0.0238095 0.0238095 -0.0000000), wk = 0.0036765 k( 101) = ( 0.0158730 0.0158730 -0.0000000), wk = 0.0036765 k( 102) = ( 0.0079365 0.0079365 -0.0000000), wk = 0.0036765 k( 103) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0036765 k( 104) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0036765 k( 105) = ( 0.0000000 0.0000000 0.0238095), wk = 0.0036765 k( 106) = ( 0.0000000 0.0000000 0.0476191), wk = 0.0036765 k( 107) = ( 0.0000000 0.0000000 0.0714286), wk = 0.0036765 k( 108) = ( 0.0000000 0.0000000 0.0952381), wk = 0.0036765 k( 109) = ( 0.0000000 0.0000000 0.1190476), wk = 0.0036765 k( 110) = ( 0.0000000 0.0000000 0.1428571), wk = 0.0036765 k( 111) = ( 0.0000000 0.0000000 0.1666667), wk = 0.0036765 k( 112) = ( 0.0000000 0.0000000 0.1904762), wk = 0.0036765 k( 113) = ( 0.0000000 0.0000000 0.2142857), wk = 0.0036765 k( 114) = ( 0.0000000 0.0000000 0.2380952), wk = 0.0036765 k( 115) = ( 0.0000000 0.0000000 0.2619048), wk = 0.0036765 k( 116) = ( 0.0000000 0.0000000 0.2857143), wk = 0.0036765 k( 117) = ( 0.0000000 0.0000000 0.3095238), wk = 0.0036765 k( 118) = ( 0.0000000 0.0000000 0.3333333), wk = 0.0036765 k( 119) = ( 0.0000000 0.0000000 0.3571429), wk = 0.0036765 k( 120) = ( 0.0000000 0.0000000 0.3809524), wk = 0.0036765 k( 121) = ( 0.0000000 0.0000000 0.4047619), wk = 0.0036765 k( 122) = ( 0.0000000 0.0000000 0.4285714), wk = 0.0036765 k( 123) = ( 0.0000000 0.0000000 0.4523810), wk = 0.0036765 k( 124) = ( 0.0000000 0.0000000 0.4761905), wk = 0.0036765 k( 125) = ( 0.0000000 0.0000000 0.5000000), wk = 0.0036765 k( 126) = ( 0.0000000 0.0000000 0.5000000), wk = 0.0036765 k( 127) = ( 0.0135135 -0.0000000 0.5000000), wk = 0.0036765 k( 128) = ( 0.0270270 -0.0000000 0.5000000), wk = 0.0036765 k( 129) = ( 0.0405405 -0.0000000 0.5000000), wk = 0.0036765 k( 130) = ( 0.0540540 -0.0000000 0.5000000), wk = 0.0036765 k( 131) = ( 0.0675676 -0.0000000 0.5000000), wk = 0.0036765 k( 132) = ( 0.0810811 -0.0000000 0.5000000), wk = 0.0036765 k( 133) = ( 0.0945946 -0.0000000 0.5000000), wk = 0.0036765 k( 134) = ( 0.1081081 -0.0000000 0.5000000), wk = 0.0036765 k( 135) = ( 0.1216216 -0.0000000 0.5000000), wk = 0.0036765 k( 136) = ( 0.1351351 -0.0000000 0.5000000), wk = 0.0036765 k( 137) = ( 0.1486486 -0.0000000 0.5000000), wk = 0.0036765 k( 138) = ( 0.1621622 -0.0000000 0.5000000), wk = 0.0036765 k( 139) = ( 0.1756757 -0.0000000 0.5000000), wk = 0.0036765 k( 140) = ( 0.1891892 -0.0000000 0.5000000), wk = 0.0036765 k( 141) = ( 0.2027027 -0.0000000 0.5000000), wk = 0.0036765 k( 142) = ( 0.2162162 -0.0000000 0.5000000), wk = 0.0036765 k( 143) = ( 0.2297297 0.0000000 0.5000000), wk = 0.0036765 k( 144) = ( 0.2432432 -0.0000000 0.5000000), wk = 0.0036765 k( 145) = ( 0.2567568 -0.0000000 0.5000000), wk = 0.0036765 k( 146) = ( 0.2702703 -0.0000000 0.5000000), wk = 0.0036765 k( 147) = ( 0.2837838 -0.0000000 0.5000000), wk = 0.0036765 k( 148) = ( 0.2972973 -0.0000000 0.5000000), wk = 0.0036765 k( 149) = ( 0.3108108 -0.0000000 0.5000000), wk = 0.0036765 k( 150) = ( 0.3243243 -0.0000000 0.5000000), wk = 0.0036765 k( 151) = ( 0.3378378 -0.0000000 0.5000000), wk = 0.0036765 k( 152) = ( 0.3513514 0.0000000 0.5000000), wk = 0.0036765 k( 153) = ( 0.3648649 -0.0000000 0.5000000), wk = 0.0036765 k( 154) = ( 0.3783784 -0.0000000 0.5000000), wk = 0.0036765 k( 155) = ( 0.3918919 -0.0000000 0.5000000), wk = 0.0036765 k( 156) = ( 0.4054054 -0.0000000 0.5000000), wk = 0.0036765 k( 157) = ( 0.4189189 -0.0000000 0.5000000), wk = 0.0036765 k( 158) = ( 0.4324324 -0.0000000 0.5000000), wk = 0.0036765 k( 159) = ( 0.4459459 0.0000000 0.5000000), wk = 0.0036765 k( 160) = ( 0.4594595 0.0000000 0.5000000), wk = 0.0036765 k( 161) = ( 0.4729730 -0.0000000 0.5000000), wk = 0.0036765 k( 162) = ( 0.4864865 -0.0000000 0.5000000), wk = 0.0036765 k( 163) = ( 0.5000000 0.0000000 0.5000000), wk = 0.0036765 k( 164) = ( 0.5000000 0.0000000 0.5000000), wk = 0.0036765 k( 165) = ( 0.4920635 0.0158730 0.5000000), wk = 0.0036765 k( 166) = ( 0.4841270 0.0317460 0.5000000), wk = 0.0036765 k( 167) = ( 0.4761905 0.0476190 0.5000000), wk = 0.0036765 k( 168) = ( 0.4682540 0.0634921 0.5000000), wk = 0.0036765 k( 169) = ( 0.4603175 0.0793651 0.5000000), wk = 0.0036765 k( 170) = ( 0.4523810 0.0952381 0.5000000), wk = 0.0036765 k( 171) = ( 0.4444444 0.1111111 0.5000000), wk = 0.0036765 k( 172) = ( 0.4365079 0.1269841 0.5000000), wk = 0.0036765 k( 173) = ( 0.4285714 0.1428571 0.5000000), wk = 0.0036765 k( 174) = ( 0.4206349 0.1587302 0.5000000), wk = 0.0036765 k( 175) = ( 0.4126984 0.1746032 0.5000000), wk = 0.0036765 k( 176) = ( 0.4047619 0.1904762 0.5000000), wk = 0.0036765 k( 177) = ( 0.3968254 0.2063492 0.5000000), wk = 0.0036765 k( 178) = ( 0.3888889 0.2222222 0.5000000), wk = 0.0036765 k( 179) = ( 0.3809524 0.2380952 0.5000000), wk = 0.0036765 k( 180) = ( 0.3730159 0.2539683 0.5000000), wk = 0.0036765 k( 181) = ( 0.3650794 0.2698413 0.5000000), wk = 0.0036765 k( 182) = ( 0.3571429 0.2857143 0.5000000), wk = 0.0036765 k( 183) = ( 0.3492063 0.3015873 0.5000000), wk = 0.0036765 k( 184) = ( 0.3412698 0.3174603 0.5000000), wk = 0.0036765 k( 185) = ( 0.3333333 0.3333333 0.5000000), wk = 0.0036765 k( 186) = ( 0.3333333 0.3333333 0.5000000), wk = 0.0036765 k( 187) = ( 0.3253968 0.3253968 0.5000000), wk = 0.0036765 k( 188) = ( 0.3174603 0.3174603 0.5000000), wk = 0.0036765 k( 189) = ( 0.3095238 0.3095238 0.5000000), wk = 0.0036765 k( 190) = ( 0.3015873 0.3015873 0.5000000), wk = 0.0036765 k( 191) = ( 0.2936508 0.2936508 0.5000000), wk = 0.0036765 k( 192) = ( 0.2857143 0.2857143 0.5000000), wk = 0.0036765 k( 193) = ( 0.2777778 0.2777778 0.5000000), wk = 0.0036765 k( 194) = ( 0.2698413 0.2698413 0.5000000), wk = 0.0036765 k( 195) = ( 0.2619048 0.2619048 0.5000000), wk = 0.0036765 k( 196) = ( 0.2539683 0.2539683 0.5000000), wk = 0.0036765 k( 197) = ( 0.2460317 0.2460317 0.5000000), wk = 0.0036765 k( 198) = ( 0.2380952 0.2380952 0.5000000), wk = 0.0036765 k( 199) = ( 0.2301587 0.2301587 0.5000000), wk = 0.0036765 k( 200) = ( 0.2222222 0.2222222 0.5000000), wk = 0.0036765 k( 201) = ( 0.2142857 0.2142857 0.5000000), wk = 0.0036765 k( 202) = ( 0.2063492 0.2063492 0.5000000), wk = 0.0036765 k( 203) = ( 0.1984127 0.1984127 0.5000000), wk = 0.0036765 k( 204) = ( 0.1904762 0.1904762 0.5000000), wk = 0.0036765 k( 205) = ( 0.1825397 0.1825397 0.5000000), wk = 0.0036765 k( 206) = ( 0.1746032 0.1746032 0.5000000), wk = 0.0036765 k( 207) = ( 0.1666667 0.1666667 0.5000000), wk = 0.0036765 k( 208) = ( 0.1587302 0.1587302 0.5000000), wk = 0.0036765 k( 209) = ( 0.1507937 0.1507937 0.5000000), wk = 0.0036765 k( 210) = ( 0.1428571 0.1428571 0.5000000), wk = 0.0036765 k( 211) = ( 0.1349206 0.1349206 0.5000000), wk = 0.0036765 k( 212) = ( 0.1269841 0.1269841 0.5000000), wk = 0.0036765 k( 213) = ( 0.1190476 0.1190476 0.5000000), wk = 0.0036765 k( 214) = ( 0.1111111 0.1111111 0.5000000), wk = 0.0036765 k( 215) = ( 0.1031746 0.1031746 0.5000000), wk = 0.0036765 k( 216) = ( 0.0952381 0.0952381 0.5000000), wk = 0.0036765 k( 217) = ( 0.0873016 0.0873016 0.5000000), wk = 0.0036765 k( 218) = ( 0.0793651 0.0793651 0.5000000), wk = 0.0036765 k( 219) = ( 0.0714286 0.0714286 0.5000000), wk = 0.0036765 k( 220) = ( 0.0634921 0.0634921 0.5000000), wk = 0.0036765 k( 221) = ( 0.0555556 0.0555556 0.5000000), wk = 0.0036765 k( 222) = ( 0.0476191 0.0476191 0.5000000), wk = 0.0036765 k( 223) = ( 0.0396825 0.0396825 0.5000000), wk = 0.0036765 k( 224) = ( 0.0317460 0.0317460 0.5000000), wk = 0.0036765 k( 225) = ( 0.0238095 0.0238095 0.5000000), wk = 0.0036765 k( 226) = ( 0.0158730 0.0158730 0.5000000), wk = 0.0036765 k( 227) = ( 0.0079365 0.0079365 0.5000000), wk = 0.0036765 k( 228) = ( 0.0000000 0.0000000 0.5000000), wk = 0.0036765 k( 229) = ( 0.5000000 0.0000000 0.5000000), wk = 0.0036765 k( 230) = ( 0.5000000 0.0000000 0.4761905), wk = 0.0036765 k( 231) = ( 0.5000000 0.0000000 0.4523810), wk = 0.0036765 k( 232) = ( 0.5000000 0.0000000 0.4285714), wk = 0.0036765 k( 233) = ( 0.5000000 0.0000000 0.4047619), wk = 0.0036765 k( 234) = ( 0.5000000 0.0000000 0.3809524), wk = 0.0036765 k( 235) = ( 0.5000000 0.0000000 0.3571429), wk = 0.0036765 k( 236) = ( 0.5000000 0.0000000 0.3333333), wk = 0.0036765 k( 237) = ( 0.5000000 0.0000000 0.3095238), wk = 0.0036765 k( 238) = ( 0.5000000 0.0000000 0.2857143), wk = 0.0036765 k( 239) = ( 0.5000000 0.0000000 0.2619048), wk = 0.0036765 k( 240) = ( 0.5000000 0.0000000 0.2380952), wk = 0.0036765 k( 241) = ( 0.5000000 0.0000000 0.2142857), wk = 0.0036765 k( 242) = ( 0.5000000 0.0000000 0.1904762), wk = 0.0036765 k( 243) = ( 0.5000000 0.0000000 0.1666667), wk = 0.0036765 k( 244) = ( 0.5000000 0.0000000 0.1428571), wk = 0.0036765 k( 245) = ( 0.5000000 0.0000000 0.1190476), wk = 0.0036765 k( 246) = ( 0.5000000 0.0000000 0.0952381), wk = 0.0036765 k( 247) = ( 0.5000000 0.0000000 0.0714286), wk = 0.0036765 k( 248) = ( 0.5000000 0.0000000 0.0476191), wk = 0.0036765 k( 249) = ( 0.5000000 0.0000000 0.0238095), wk = 0.0036765 k( 250) = ( 0.5000000 0.0000000 -0.0000000), wk = 0.0036765 k( 251) = ( 0.3333333 0.3333333 -0.0000000), wk = 0.0036765 k( 252) = ( 0.3333333 0.3333333 0.0238095), wk = 0.0036765 k( 253) = ( 0.3333333 0.3333333 0.0476191), wk = 0.0036765 k( 254) = ( 0.3333333 0.3333333 0.0714286), wk = 0.0036765 k( 255) = ( 0.3333333 0.3333333 0.0952381), wk = 0.0036765 k( 256) = ( 0.3333333 0.3333333 0.1190476), wk = 0.0036765 k( 257) = ( 0.3333333 0.3333333 0.1428571), wk = 0.0036765 k( 258) = ( 0.3333333 0.3333333 0.1666667), wk = 0.0036765 k( 259) = ( 0.3333333 0.3333333 0.1904762), wk = 0.0036765 k( 260) = ( 0.3333333 0.3333333 0.2142857), wk = 0.0036765 k( 261) = ( 0.3333333 0.3333333 0.2380952), wk = 0.0036765 k( 262) = ( 0.3333333 0.3333333 0.2619048), wk = 0.0036765 k( 263) = ( 0.3333333 0.3333333 0.2857143), wk = 0.0036765 k( 264) = ( 0.3333333 0.3333333 0.3095238), wk = 0.0036765 k( 265) = ( 0.3333333 0.3333333 0.3333333), wk = 0.0036765 k( 266) = ( 0.3333333 0.3333333 0.3571429), wk = 0.0036765 k( 267) = ( 0.3333333 0.3333333 0.3809524), wk = 0.0036765 k( 268) = ( 0.3333333 0.3333333 0.4047619), wk = 0.0036765 k( 269) = ( 0.3333333 0.3333333 0.4285714), wk = 0.0036765 k( 270) = ( 0.3333333 0.3333333 0.4523810), wk = 0.0036765 k( 271) = ( 0.3333333 0.3333333 0.4761905), wk = 0.0036765 k( 272) = ( 0.3333333 0.3333333 0.5000000), wk = 0.0036765 Dense grid: 305607 G-vectors FFT dimensions: ( 80, 80, 120) Smooth grid: 48861 G-vectors FFT dimensions: ( 45, 45, 64) Largest allocated arrays est. size (Mb) dimensions Kohn-Sham Wavefunctions 0.54 Mb ( 352, 100) NL pseudopotentials 0.67 Mb ( 176, 248) Each V/rho on FFT grid 0.39 Mb ( 25600) Each G-vector array 0.06 Mb ( 8489) G-vector shells 0.03 Mb ( 3680) Largest temporary arrays est. size (Mb) dimensions Auxiliary wavefunctions 2.15 Mb ( 352, 400) Each subspace H/S matrix 0.15 Mb ( 100, 100) Each matrix 0.76 Mb ( 248, 2, 100) The potential is recalculated from file : ./CdSO4.save/charge-density.dat Starting wfc are 116 randomized atomic wfcs Band Structure Calculation Davidson diagonalization with overlap Computing kpt #: 1 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 7.4 secs Computing kpt #: 2 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 11.5 secs Computing kpt #: 3 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 15.5 secs Computing kpt #: 4 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 19.6 secs Computing kpt #: 5 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 23.6 secs Computing kpt #: 6 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 27.6 secs Computing kpt #: 7 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 31.6 secs Computing kpt #: 8 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 35.6 secs Computing kpt #: 9 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 39.7 secs Computing kpt #: 10 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 43.7 secs Computing kpt #: 11 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 47.8 secs Computing kpt #: 12 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 51.9 secs Computing kpt #: 13 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 55.9 secs Computing kpt #: 14 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 60.0 secs Computing kpt #: 15 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 64.0 secs Computing kpt #: 16 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 68.1 secs Computing kpt #: 17 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 72.1 secs Computing kpt #: 18 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 76.2 secs Computing kpt #: 19 total cpu time spent up to now is 79.9 secs Computing kpt #: 20 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 84.0 secs Computing kpt #: 21 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 88.0 secs Computing kpt #: 22 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 92.1 secs Computing kpt #: 23 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 96.2 secs Computing kpt #: 24 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 100.2 secs Computing kpt #: 25 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 104.3 secs Computing kpt #: 26 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 108.4 secs Computing kpt #: 27 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 112.5 secs Computing kpt #: 28 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 116.6 secs Computing kpt #: 29 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 120.6 secs Computing kpt #: 30 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 124.6 secs Computing kpt #: 31 total cpu time spent up to now is 128.4 secs Computing kpt #: 32 total cpu time spent up to now is 131.8 secs Computing kpt #: 33 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 135.7 secs Computing kpt #: 34 total cpu time spent up to now is 139.1 secs Computing kpt #: 35 total cpu time spent up to now is 142.4 secs Computing kpt #: 36 total cpu time spent up to now is 144.8 secs Computing kpt #: 37 total cpu time spent up to now is 147.4 secs Computing kpt #: 38 total cpu time spent up to now is 150.7 secs Computing kpt #: 39 total cpu time spent up to now is 153.1 secs Computing kpt #: 40 total cpu time spent up to now is 155.5 secs Computing kpt #: 41 total cpu time spent up to now is 158.7 secs Computing kpt #: 42 total cpu time spent up to now is 162.0 secs Computing kpt #: 43 total cpu time spent up to now is 165.3 secs Computing kpt #: 44 total cpu time spent up to now is 167.7 secs Computing kpt #: 45 total cpu time spent up to now is 171.4 secs Computing kpt #: 46 total cpu time spent up to now is 174.7 secs Computing kpt #: 47 total cpu time spent up to now is 178.4 secs Computing kpt #: 48 total cpu time spent up to now is 181.2 secs Computing kpt #: 49 total cpu time spent up to now is 185.0 secs Computing kpt #: 50 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 189.5 secs Computing kpt #: 51 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 193.5 secs Computing kpt #: 52 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 197.5 secs Computing kpt #: 53 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 201.5 secs Computing kpt #: 54 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 205.5 secs Computing kpt #: 55 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 209.4 secs Computing kpt #: 56 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 213.5 secs Computing kpt #: 57 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 217.4 secs Computing kpt #: 58 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 221.5 secs Computing kpt #: 59 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 225.7 secs Computing kpt #: 60 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 229.6 secs Computing kpt #: 61 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 233.5 secs Computing kpt #: 62 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 237.5 secs Computing kpt #: 63 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 241.6 secs Computing kpt #: 64 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 245.5 secs Computing kpt #: 65 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 249.6 secs Computing kpt #: 66 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 253.7 secs Computing kpt #: 67 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 257.8 secs Computing kpt #: 68 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 261.8 secs Computing kpt #: 69 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 265.7 secs Computing kpt #: 70 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 269.7 secs Computing kpt #: 71 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 273.8 secs Computing kpt #: 72 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 277.7 secs Computing kpt #: 73 total cpu time spent up to now is 281.3 secs Computing kpt #: 74 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 285.4 secs Computing kpt #: 75 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 289.3 secs Computing kpt #: 76 total cpu time spent up to now is 292.7 secs Computing kpt #: 77 total cpu time spent up to now is 296.1 secs Computing kpt #: 78 total cpu time spent up to now is 297.9 secs Computing kpt #: 79 total cpu time spent up to now is 299.9 secs Computing kpt #: 80 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 303.8 secs Computing kpt #: 81 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 307.8 secs Computing kpt #: 82 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 311.9 secs Computing kpt #: 83 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 316.0 secs Computing kpt #: 84 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 320.0 secs Computing kpt #: 85 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 324.1 secs Computing kpt #: 86 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 328.1 secs Computing kpt #: 87 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 332.2 secs Computing kpt #: 88 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 336.3 secs Computing kpt #: 89 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 340.3 secs Computing kpt #: 90 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 344.4 secs Computing kpt #: 91 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 348.4 secs Computing kpt #: 92 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 352.5 secs Computing kpt #: 93 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 356.6 secs Computing kpt #: 94 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 360.7 secs Computing kpt #: 95 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 364.7 secs Computing kpt #: 96 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 368.7 secs Computing kpt #: 97 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 372.8 secs Computing kpt #: 98 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 376.8 secs Computing kpt #: 99 total cpu time spent up to now is 380.7 secs Computing kpt #: 100 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 384.7 secs Computing kpt #: 101 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 388.7 secs Computing kpt #: 102 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 392.8 secs Computing kpt #: 103 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 396.8 secs Computing kpt #: 104 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 400.9 secs Computing kpt #: 105 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 404.9 secs Computing kpt #: 106 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 409.0 secs Computing kpt #: 107 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 413.0 secs Computing kpt #: 108 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 417.1 secs Computing kpt #: 109 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 421.1 secs Computing kpt #: 110 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 425.2 secs Computing kpt #: 111 total cpu time spent up to now is 429.1 secs Computing kpt #: 112 total cpu time spent up to now is 432.8 secs Computing kpt #: 113 total cpu time spent up to now is 436.3 secs Computing kpt #: 114 total cpu time spent up to now is 439.5 secs Computing kpt #: 115 total cpu time spent up to now is 442.7 secs Computing kpt #: 116 total cpu time spent up to now is 445.5 secs Computing kpt #: 117 total cpu time spent up to now is 448.3 secs Computing kpt #: 118 total cpu time spent up to now is 451.1 secs Computing kpt #: 119 total cpu time spent up to now is 453.7 secs Computing kpt #: 120 total cpu time spent up to now is 456.1 secs Computing kpt #: 121 total cpu time spent up to now is 458.5 secs Computing kpt #: 122 total cpu time spent up to now is 460.9 secs Computing kpt #: 123 total cpu time spent up to now is 463.0 secs Computing kpt #: 124 total cpu time spent up to now is 465.2 secs Computing kpt #: 125 total cpu time spent up to now is 467.3 secs Computing kpt #: 126 total cpu time spent up to now is 469.4 secs Computing kpt #: 127 total cpu time spent up to now is 471.5 secs Computing kpt #: 128 total cpu time spent up to now is 473.7 secs Computing kpt #: 129 total cpu time spent up to now is 476.0 secs Computing kpt #: 130 total cpu time spent up to now is 478.1 secs Computing kpt #: 131 total cpu time spent up to now is 480.3 secs Computing kpt #: 132 total cpu time spent up to now is 482.5 secs Computing kpt #: 133 total cpu time spent up to now is 484.7 secs Computing kpt #: 134 total cpu time spent up to now is 487.5 secs Computing kpt #: 135 total cpu time spent up to now is 489.9 secs Computing kpt #: 136 total cpu time spent up to now is 492.2 secs Computing kpt #: 137 total cpu time spent up to now is 494.4 secs Computing kpt #: 138 total cpu time spent up to now is 496.8 secs Computing kpt #: 139 total cpu time spent up to now is 499.3 secs Computing kpt #: 140 total cpu time spent up to now is 501.5 secs Computing kpt #: 141 total cpu time spent up to now is 504.0 secs Computing kpt #: 142 total cpu time spent up to now is 506.8 secs Computing kpt #: 143 total cpu time spent up to now is 509.5 secs Computing kpt #: 144 total cpu time spent up to now is 512.8 secs Computing kpt #: 145 total cpu time spent up to now is 516.3 secs Computing kpt #: 146 total cpu time spent up to now is 519.8 secs Computing kpt #: 147 total cpu time spent up to now is 522.5 secs Computing kpt #: 148 total cpu time spent up to now is 525.0 secs Computing kpt #: 149 total cpu time spent up to now is 528.4 secs Computing kpt #: 150 total cpu time spent up to now is 531.9 secs Computing kpt #: 151 total cpu time spent up to now is 534.4 secs Computing kpt #: 152 total cpu time spent up to now is 537.1 secs Computing kpt #: 153 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 541.3 secs Computing kpt #: 154 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 545.4 secs Computing kpt #: 155 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 549.6 secs Computing kpt #: 156 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 553.7 secs Computing kpt #: 157 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 557.8 secs Computing kpt #: 158 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 561.9 secs Computing kpt #: 159 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 566.0 secs Computing kpt #: 160 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 570.1 secs Computing kpt #: 161 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 574.0 secs Computing kpt #: 162 total cpu time spent up to now is 577.2 secs Computing kpt #: 163 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 581.2 secs Computing kpt #: 164 total cpu time spent up to now is 584.5 secs Computing kpt #: 165 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 588.4 secs Computing kpt #: 166 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 592.4 secs Computing kpt #: 167 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 596.4 secs Computing kpt #: 168 total cpu time spent up to now is 600.0 secs Computing kpt #: 169 total cpu time spent up to now is 603.4 secs Computing kpt #: 170 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 607.4 secs Computing kpt #: 171 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 611.4 secs Computing kpt #: 172 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 615.4 secs Computing kpt #: 173 total cpu time spent up to now is 619.2 secs Computing kpt #: 174 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 623.1 secs Computing kpt #: 175 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 627.1 secs Computing kpt #: 176 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 631.2 secs Computing kpt #: 177 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 635.3 secs Computing kpt #: 178 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 639.3 secs Computing kpt #: 179 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 643.4 secs Computing kpt #: 180 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 647.5 secs Computing kpt #: 181 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 651.4 secs Computing kpt #: 182 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 655.5 secs Computing kpt #: 183 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 659.6 secs Computing kpt #: 184 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 663.5 secs Computing kpt #: 185 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 667.5 secs Computing kpt #: 186 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 671.6 secs Computing kpt #: 187 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 675.7 secs Computing kpt #: 188 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 679.8 secs Computing kpt #: 189 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 683.7 secs Computing kpt #: 190 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 687.8 secs Computing kpt #: 191 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 691.9 secs Computing kpt #: 192 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 696.0 secs Computing kpt #: 193 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 700.1 secs Computing kpt #: 194 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 704.2 secs Computing kpt #: 195 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 708.3 secs Computing kpt #: 196 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 712.5 secs Computing kpt #: 197 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 716.7 secs Computing kpt #: 198 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 720.8 secs Computing kpt #: 199 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 725.0 secs Computing kpt #: 200 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 729.2 secs Computing kpt #: 201 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 733.3 secs Computing kpt #: 202 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 737.4 secs Computing kpt #: 203 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 741.6 secs Computing kpt #: 204 total cpu time spent up to now is 744.0 secs Computing kpt #: 205 total cpu time spent up to now is 747.5 secs Computing kpt #: 206 total cpu time spent up to now is 749.9 secs Computing kpt #: 207 total cpu time spent up to now is 753.8 secs Computing kpt #: 208 total cpu time spent up to now is 756.6 secs Computing kpt #: 209 total cpu time spent up to now is 760.0 secs Computing kpt #: 210 total cpu time spent up to now is 762.9 secs Computing kpt #: 211 total cpu time spent up to now is 766.0 secs Computing kpt #: 212 total cpu time spent up to now is 768.5 secs Computing kpt #: 213 total cpu time spent up to now is 770.7 secs Computing kpt #: 214 total cpu time spent up to now is 773.3 secs Computing kpt #: 215 total cpu time spent up to now is 775.7 secs Computing kpt #: 216 total cpu time spent up to now is 778.2 secs Computing kpt #: 217 total cpu time spent up to now is 780.4 secs Computing kpt #: 218 total cpu time spent up to now is 782.7 secs Computing kpt #: 219 total cpu time spent up to now is 785.1 secs Computing kpt #: 220 total cpu time spent up to now is 787.7 secs Computing kpt #: 221 total cpu time spent up to now is 789.9 secs Computing kpt #: 222 total cpu time spent up to now is 792.1 secs Computing kpt #: 223 total cpu time spent up to now is 794.2 secs Computing kpt #: 224 total cpu time spent up to now is 796.4 secs Computing kpt #: 225 total cpu time spent up to now is 798.5 secs Computing kpt #: 226 total cpu time spent up to now is 800.6 secs Computing kpt #: 227 total cpu time spent up to now is 802.7 secs Computing kpt #: 228 total cpu time spent up to now is 804.9 secs Computing kpt #: 229 total cpu time spent up to now is 808.2 secs Computing kpt #: 230 total cpu time spent up to now is 811.5 secs Computing kpt #: 231 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 815.5 secs Computing kpt #: 232 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 819.6 secs Computing kpt #: 233 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 823.7 secs Computing kpt #: 234 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 827.8 secs Computing kpt #: 235 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 831.8 secs Computing kpt #: 236 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 835.9 secs Computing kpt #: 237 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 840.0 secs Computing kpt #: 238 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 844.1 secs Computing kpt #: 239 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 848.2 secs Computing kpt #: 240 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 852.3 secs Computing kpt #: 241 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 856.5 secs Computing kpt #: 242 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 860.5 secs Computing kpt #: 243 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 864.6 secs Computing kpt #: 244 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 868.7 secs Computing kpt #: 245 total cpu time spent up to now is 872.2 secs Computing kpt #: 246 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 876.2 secs Computing kpt #: 247 total cpu time spent up to now is 879.9 secs Computing kpt #: 248 total cpu time spent up to now is 883.3 secs Computing kpt #: 249 total cpu time spent up to now is 886.7 secs Computing kpt #: 250 total cpu time spent up to now is 890.0 secs Computing kpt #: 251 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 893.9 secs Computing kpt #: 252 total cpu time spent up to now is 895.6 secs Computing kpt #: 253 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 899.7 secs Computing kpt #: 254 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 903.7 secs Computing kpt #: 255 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 907.6 secs Computing kpt #: 256 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 911.5 secs Computing kpt #: 257 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 915.5 secs Computing kpt #: 258 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 919.4 secs Computing kpt #: 259 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 923.5 secs Computing kpt #: 260 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 927.5 secs Computing kpt #: 261 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 931.4 secs Computing kpt #: 262 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 935.5 secs Computing kpt #: 263 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 939.4 secs Computing kpt #: 264 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 943.4 secs Computing kpt #: 265 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 947.5 secs Computing kpt #: 266 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 951.6 secs Computing kpt #: 267 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 955.7 secs Computing kpt #: 268 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 959.7 secs Computing kpt #: 269 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 963.6 secs Computing kpt #: 270 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 967.5 secs Computing kpt #: 271 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 971.6 secs Computing kpt #: 272 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 975.7 secs ethr = 1.19E-08, avg # of iterations =100.6 total cpu time spent up to now is 975.7 secs End of band structure calculation k = 0.0000 0.0000 0.0000 ( 6097 PWs) bands (ev): -14.6875 -14.6875 -14.0808 -14.0808 -13.1412 -13.1412 -13.0124 -13.0124 -10.7221 -10.7221 -10.7214 -10.7214 -10.6686 -10.6686 -10.6654 -10.6654 -6.3083 -6.3083 -6.2786 -6.2786 -3.0651 -3.0651 -2.9488 -2.9488 -2.4735 -2.4735 -2.3015 -2.3015 -2.2779 -2.2779 -1.9459 -1.9459 -1.8673 -1.8673 -1.4276 -1.4276 -1.3312 -1.3312 -1.1523 -1.1523 -0.5003 -0.5003 -0.0017 -0.0017 0.0184 0.0184 0.0229 0.0229 0.1274 0.1274 0.1329 0.1329 0.2797 0.2797 0.6525 0.6525 1.5446 1.5446 2.2623 2.2623 2.2751 2.2751 2.3639 2.3639 2.3925 2.3925 3.0325 3.0325 4.0878 4.0878 4.1042 4.1042 4.7250 4.7250 4.7265 4.7265 5.4803 5.4803 5.5279 5.5279 5.6036 5.6036 5.6317 5.6317 5.8053 5.8053 5.8272 5.8272 6.0972 6.0972 6.9215 6.9215 6.9701 6.9701 7.0067 7.0067 7.0548 7.0548 9.1620 9.1654 k = 0.0135 0.0078-0.0000 ( 6105 PWs) bands (ev): -14.6871 -14.6871 -14.0810 -14.0810 -13.1410 -13.1410 -13.0122 -13.0122 -10.7224 -10.7224 -10.7215 -10.7215 -10.6691 -10.6691 -10.6658 -10.6658 -6.3087 -6.3087 -6.2791 -6.2791 -3.0649 -3.0649 -2.9488 -2.9488 -2.4731 -2.4731 -2.3014 -2.3014 -2.2778 -2.2778 -1.9460 -1.9460 -1.8675 -1.8675 -1.4275 -1.4275 -1.3316 -1.3316 -1.1527 -1.1527 -0.4982 -0.4982 -0.0051 -0.0051 0.0139 0.0139 0.0326 0.0326 0.1274 0.1274 0.1326 0.1326 0.2793 0.2793 0.6560 0.6560 1.5453 1.5453 2.2575 2.2575 2.2709 2.2709 2.3693 2.3693 2.3973 2.3973 3.0328 3.0328 4.0873 4.0873 4.1037 4.1037 4.7237 4.7237 4.7255 4.7255 5.4779 5.4779 5.5253 5.5253 5.6007 5.6007 5.6291 5.6291 5.8047 5.8047 5.8266 5.8266 6.1027 6.1027 6.9211 6.9211 6.9696 6.9696 7.0056 7.0056 7.0536 7.0536 9.1620 9.1654 k = 0.0270 0.0156-0.0000 ( 6111 PWs) bands (ev): -14.6862 -14.6862 -14.0814 -14.0814 -13.1403 -13.1403 -13.0115 -13.0115 -10.7235 -10.7235 -10.7218 -10.7218 -10.6707 -10.6707 -10.6666 -10.6666 -6.3100 -6.3100 -6.2804 -6.2804 -3.0642 -3.0642 -2.9487 -2.9487 -2.4720 -2.4720 -2.3010 -2.3010 -2.2776 -2.2776 -1.9462 -1.9462 -1.8677 -1.8677 -1.4271 -1.4271 -1.3327 -1.3327 -1.1537 -1.1537 -0.4919 -0.4919 -0.0128 -0.0128 0.0126 0.0126 0.0462 0.0462 0.1264 0.1264 0.1338 0.1338 0.2784 0.2784 0.6663 0.6663 1.5474 1.5474 2.2457 2.2457 2.2601 2.2601 2.3831 2.3831 2.4099 2.4099 3.0335 3.0335 4.0858 4.0858 4.1024 4.1024 4.7190 4.7190 4.7229 4.7229 5.4708 5.4708 5.5180 5.5180 5.5890 5.5890 5.6251 5.6251 5.8021 5.8021 5.8253 5.8253 6.1185 6.1185 6.9198 6.9198 6.9683 6.9683 7.0019 7.0019 7.0507 7.0507 9.1617 9.1643 k = 0.0405 0.0234-0.0000 ( 6107 PWs) bands (ev): -14.6847 -14.6847 -14.0822 -14.0822 -13.1392 -13.1392 -13.0103 -13.0103 -10.7255 -10.7255 -10.7221 -10.7221 -10.6740 -10.6740 -10.6673 -10.6673 -6.3120 -6.3120 -6.2825 -6.2825 -3.0630 -3.0630 -2.9484 -2.9484 -2.4701 -2.4701 -2.3003 -2.3003 -2.2771 -2.2771 -1.9467 -1.9467 -1.8681 -1.8681 -1.4264 -1.4264 -1.3344 -1.3344 -1.1553 -1.1553 -0.4815 -0.4815 -0.0210 -0.0210 0.0132 0.0132 0.0593 0.0593 0.1256 0.1256 0.1379 0.1379 0.2768 0.2768 0.6828 0.6828 1.5509 1.5509 2.2302 2.2302 2.2458 2.2458 2.4016 2.4016 2.4274 2.4274 3.0348 3.0348 4.0830 4.0830 4.1005 4.1005 4.7107 4.7107 4.7191 4.7191 5.4586 5.4586 5.5068 5.5068 5.5657 5.5657 5.6242 5.6242 5.7955 5.7955 5.8252 5.8252 6.1429 6.1429 6.9169 6.9169 6.9666 6.9666 6.9945 6.9945 7.0472 7.0472 9.1614 9.1614 k = 0.0541 0.0312-0.0000 ( 6106 PWs) bands (ev): -14.6825 -14.6825 -14.0832 -14.0832 -13.1376 -13.1376 -13.0087 -13.0087 -10.7283 -10.7283 -10.7224 -10.7224 -10.6789 -10.6789 -10.6681 -10.6681 -6.3149 -6.3149 -6.2855 -6.2855 -3.0614 -3.0614 -2.9480 -2.9480 -2.4676 -2.4676 -2.2994 -2.2994 -2.2765 -2.2765 -1.9473 -1.9473 -1.8685 -1.8685 -1.4254 -1.4254 -1.3366 -1.3366 -1.1573 -1.1573 -0.4674 -0.4674 -0.0287 -0.0287 0.0145 0.0145 0.0674 0.0674 0.1300 0.1300 0.1448 0.1448 0.2747 0.2747 0.7046 0.7046 1.5559 1.5559 2.2135 2.2135 2.2305 2.2305 2.4225 2.4225 2.4475 2.4475 3.0366 3.0366 4.0785 4.0785 4.0984 4.0984 4.6990 4.6990 4.7139 4.7139 5.4413 5.4413 5.4922 5.4922 5.5339 5.5339 5.6254 5.6254 5.7837 5.7837 5.8272 5.8272 6.1734 6.1734 6.9120 6.9120 6.9650 6.9650 6.9826 6.9826 7.0444 7.0444 9.1609 9.1635 k = 0.0676 0.0390-0.0000 ( 6108 PWs) bands (ev): -14.6797 -14.6797 -14.0846 -14.0846 -13.1356 -13.1356 -13.0066 -13.0066 -10.7320 -10.7320 -10.7228 -10.7228 -10.6853 -10.6853 -10.6688 -10.6688 -6.3186 -6.3186 -6.2892 -6.2892 -3.0594 -3.0594 -2.9475 -2.9475 -2.4643 -2.4643 -2.2983 -2.2983 -2.2757 -2.2757 -1.9482 -1.9482 -1.8691 -1.8691 -1.4243 -1.4243 -1.3392 -1.3392 -1.1597 -1.1597 -0.4499 -0.4499 -0.0357 -0.0357 0.0157 0.0157 0.0682 0.0682 0.1420 0.1420 0.1560 0.1560 0.2722 0.2722 0.7308 0.7308 1.5624 1.5624 2.1965 2.1965 2.2155 2.2155 2.4445 2.4445 2.4689 2.4689 3.0389 3.0389 4.0721 4.0721 4.0963 4.0963 4.6838 4.6838 4.7071 4.7071 5.4189 5.4189 5.4742 5.4742 5.4970 5.4970 5.6278 5.6278 5.7671 5.7671 5.8308 5.8308 6.2083 6.2083 6.9045 6.9045 6.9594 6.9594 6.9702 6.9702 7.0428 7.0428 9.1603 9.1635 k = 0.0811 0.0468-0.0000 ( 6110 PWs) bands (ev): -14.6763 -14.6763 -14.0863 -14.0863 -13.1331 -13.1331 -13.0040 -13.0040 -10.7364 -10.7364 -10.7233 -10.7233 -10.6931 -10.6931 -10.6697 -10.6697 -6.3230 -6.3230 -6.2938 -6.2938 -3.0569 -3.0569 -2.9470 -2.9470 -2.4603 -2.4603 -2.2970 -2.2970 -2.2747 -2.2747 -1.9494 -1.9494 -1.8698 -1.8698 -1.4231 -1.4231 -1.3419 -1.3419 -1.1623 -1.1623 -0.4295 -0.4295 -0.0425 -0.0425 0.0164 0.0164 0.0649 0.0649 0.1567 0.1567 0.1747 0.1747 0.2693 0.2693 0.7605 0.7605 1.5707 1.5707 2.1798 2.1798 2.2019 2.2019 2.4670 2.4670 2.4909 2.4909 3.0417 3.0417 4.0640 4.0640 4.0943 4.0943 4.6652 4.6652 4.6988 4.6988 5.3920 5.3920 5.4499 5.4499 5.4599 5.4599 5.6310 5.6310 5.7461 5.7461 5.8356 5.8356 6.2456 6.2456 6.8946 6.8946 6.9384 6.9384 6.9692 6.9692 7.0425 7.0425 9.1595 9.1604 k = 0.0946 0.0546-0.0000 ( 6098 PWs) bands (ev): -14.6724 -14.6724 -14.0882 -14.0882 -13.1302 -13.1302 -13.0010 -13.0010 -10.7416 -10.7416 -10.7239 -10.7239 -10.7022 -10.7022 -10.6708 -10.6708 -6.3281 -6.3281 -6.2991 -6.2991 -3.0540 -3.0540 -2.9463 -2.9463 -2.4557 -2.4557 -2.2954 -2.2954 -2.2736 -2.2736 -1.9507 -1.9507 -1.8705 -1.8705 -1.4217 -1.4217 -1.3444 -1.3444 -1.1649 -1.1649 -0.4067 -0.4067 -0.0496 -0.0496 0.0164 0.0164 0.0612 0.0612 0.1716 0.1716 0.2007 0.2007 0.2663 0.2663 0.7928 0.7928 1.5808 1.5808 2.1636 2.1636 2.1903 2.1903 2.4896 2.4896 2.5131 2.5131 3.0450 3.0450 4.0541 4.0541 4.0923 4.0923 4.6429 4.6429 4.6890 4.6890 5.3609 5.3609 5.4102 5.4102 5.4330 5.4330 5.6349 5.6349 5.7211 5.7211 5.8411 5.8411 6.2839 6.2839 6.8828 6.8828 6.9105 6.9105 6.9715 6.9715 7.0428 7.0428 9.1585 9.1600 k = 0.1081 0.0624-0.0000 ( 6094 PWs) bands (ev): -14.6678 -14.6678 -14.0905 -14.0905 -13.1268 -13.1268 -12.9977 -12.9977 -10.7475 -10.7475 -10.7245 -10.7245 -10.7125 -10.7125 -10.6719 -10.6719 -6.3339 -6.3339 -6.3050 -6.3050 -3.0509 -3.0509 -2.9456 -2.9456 -2.4505 -2.4505 -2.2938 -2.2938 -2.2723 -2.2723 -1.9523 -1.9523 -1.8712 -1.8712 -1.4205 -1.4205 -1.3465 -1.3465 -1.1675 -1.1675 -0.3819 -0.3819 -0.0575 -0.0575 0.0159 0.0159 0.0592 0.0592 0.1879 0.1879 0.2306 0.2306 0.2637 0.2637 0.8269 0.8269 1.5928 1.5928 2.1482 2.1482 2.1810 2.1810 2.5120 2.5120 2.5352 2.5352 3.0488 3.0488 4.0426 4.0426 4.0902 4.0902 4.6170 4.6170 4.6774 4.6774 5.3261 5.3261 5.3659 5.3659 5.4067 5.4067 5.6396 5.6396 5.6924 5.6924 5.8473 5.8473 6.3217 6.3217 6.8685 6.8685 6.8798 6.8798 6.9749 6.9749 7.0437 7.0437 9.1574 9.1575 k = 0.1216 0.0702-0.0000 ( 6098 PWs) bands (ev): -14.6627 -14.6627 -14.0932 -14.0932 -13.1231 -13.1231 -12.9939 -12.9939 -10.7541 -10.7541 -10.7252 -10.7252 -10.7239 -10.7239 -10.6732 -10.6732 -6.3402 -6.3402 -6.3116 -6.3116 -3.0474 -3.0474 -2.9449 -2.9449 -2.4447 -2.4447 -2.2920 -2.2920 -2.2709 -2.2709 -1.9544 -1.9544 -1.8718 -1.8718 -1.4195 -1.4195 -1.3480 -1.3480 -1.1700 -1.1700 -0.3559 -0.3559 -0.0662 -0.0662 0.0153 0.0153 0.0593 0.0593 0.2061 0.2061 0.2552 0.2552 0.2699 0.2699 0.8623 0.8623 1.6071 1.6071 2.1338 2.1338 2.1743 2.1743 2.5338 2.5338 2.5569 2.5569 3.0531 3.0531 4.0296 4.0296 4.0879 4.0879 4.5875 4.5875 4.6642 4.6642 5.2877 5.2877 5.3207 5.3207 5.3787 5.3787 5.6440 5.6440 5.6612 5.6612 5.8538 5.8538 6.3573 6.3573 6.8384 6.8384 6.8614 6.8614 6.9790 6.9790 7.0446 7.0446 9.1570 9.1598 k = 0.1351 0.0780-0.0000 ( 6100 PWs) bands (ev): -14.6571 -14.6571 -14.0961 -14.0961 -13.1188 -13.1188 -12.9897 -12.9897 -10.7614 -10.7614 -10.7365 -10.7365 -10.7259 -10.7259 -10.6746 -10.6746 -6.3471 -6.3471 -6.3189 -6.3189 -3.0436 -3.0436 -2.9442 -2.9442 -2.4385 -2.4385 -2.2902 -2.2902 -2.2695 -2.2695 -1.9568 -1.9568 -1.8724 -1.8724 -1.4189 -1.4189 -1.3485 -1.3485 -1.1723 -1.1723 -0.3292 -0.3292 -0.0753 -0.0753 0.0150 0.0150 0.0616 0.0616 0.2252 0.2252 0.2571 0.2571 0.3032 0.3032 0.8982 0.8982 1.6239 1.6239 2.1206 2.1206 2.1704 2.1704 2.5550 2.5550 2.5781 2.5781 3.0579 3.0579 4.0153 4.0153 4.0854 4.0854 4.5543 4.5543 4.6491 4.6491 5.2462 5.2462 5.2752 5.2752 5.3491 5.3491 5.6226 5.6226 5.6532 5.6532 5.8606 5.8606 6.3888 6.3888 6.7984 6.7984 6.8518 6.8518 6.9834 6.9834 7.0456 7.0456 9.1545 9.1607 k = 0.1486 0.0858-0.0000 ( 6104 PWs) bands (ev): -14.6509 -14.6509 -14.0994 -14.0994 -13.1142 -13.1142 -12.9853 -12.9853 -10.7694 -10.7694 -10.7500 -10.7500 -10.7267 -10.7267 -10.6761 -10.6761 -6.3545 -6.3545 -6.3266 -6.3266 -3.0396 -3.0396 -2.9435 -2.9435 -2.4318 -2.4318 -2.2882 -2.2882 -2.2680 -2.2680 -1.9595 -1.9595 -1.8729 -1.8729 -1.4187 -1.4187 -1.3479 -1.3479 -1.1745 -1.1745 -0.3029 -0.3029 -0.0837 -0.0837 0.0148 0.0148 0.0657 0.0657 0.2391 0.2391 0.2641 0.2641 0.3414 0.3414 0.9343 0.9343 1.6434 1.6434 2.1087 2.1087 2.1692 2.1692 2.5753 2.5753 2.5988 2.5988 3.0632 3.0632 3.9996 3.9996 4.0827 4.0827 4.5177 4.5177 4.6322 4.6322 5.2016 5.2016 5.2301 5.2301 5.3184 5.3184 5.5844 5.5844 5.6596 5.6596 5.8677 5.8677 6.4137 6.4137 6.7546 6.7546 6.8475 6.8475 6.9881 6.9881 7.0464 7.0464 9.1528 9.1532 k = 0.1622 0.0936-0.0000 ( 6104 PWs) bands (ev): -14.6443 -14.6443 -14.1031 -14.1031 -13.1092 -13.1092 -12.9805 -12.9805 -10.7781 -10.7781 -10.7643 -10.7643 -10.7275 -10.7275 -10.6777 -10.6777 -6.3623 -6.3623 -6.3348 -6.3348 -3.0354 -3.0354 -2.9427 -2.9427 -2.4247 -2.4247 -2.2862 -2.2862 -2.2664 -2.2664 -1.9626 -1.9626 -1.8732 -1.8732 -1.4188 -1.4188 -1.3460 -1.3460 -1.1763 -1.1763 -0.2779 -0.2779 -0.0904 -0.0904 0.0144 0.0144 0.0715 0.0715 0.2421 0.2421 0.2848 0.2848 0.3818 0.3818 0.9700 0.9700 1.6658 1.6658 2.0983 2.0983 2.1707 2.1707 2.5947 2.5947 2.6187 2.6187 3.0690 3.0690 3.9826 3.9826 4.0798 4.0798 4.4775 4.4775 4.6134 4.6134 5.1545 5.1545 5.1856 5.1856 5.2873 5.2873 5.5429 5.5429 5.6669 5.6669 5.8750 5.8750 6.4294 6.4294 6.7077 6.7077 6.8503 6.8503 6.9929 6.9929 7.0470 7.0470 9.1508 9.1516 k = 0.1757 0.1014-0.0000 ( 6104 PWs) bands (ev): -14.6371 -14.6371 -14.1070 -14.1070 -13.1038 -13.1038 -12.9754 -12.9754 -10.7879 -10.7879 -10.7788 -10.7788 -10.7284 -10.7284 -10.6793 -10.6793 -6.3705 -6.3705 -6.3434 -6.3434 -3.0309 -3.0309 -2.9420 -2.9420 -2.4172 -2.4172 -2.2842 -2.2842 -2.2649 -2.2649 -1.9661 -1.9661 -1.8733 -1.8733 -1.4193 -1.4193 -1.3430 -1.3430 -1.1779 -1.1779 -0.2559 -0.2559 -0.0937 -0.0937 0.0136 0.0136 0.0785 0.0785 0.2424 0.2424 0.3116 0.3116 0.4240 0.4240 1.0051 1.0051 1.6914 1.6914 2.0895 2.0895 2.1748 2.1748 2.6130 2.6130 2.6378 2.6378 3.0754 3.0754 3.9644 3.9644 4.0765 4.0765 4.4342 4.4342 4.5925 4.5925 5.1050 5.1050 5.1422 5.1422 5.2561 5.2561 5.4989 5.4989 5.6748 5.6748 5.8826 5.8826 6.4339 6.4339 6.6581 6.6581 6.8621 6.8621 6.9976 6.9976 7.0472 7.0472 9.1496 9.1527 k = 0.1892 0.1092-0.0000 ( 6100 PWs) bands (ev): -14.6295 -14.6295 -14.1113 -14.1113 -13.0980 -13.0980 -12.9700 -12.9700 -10.8001 -10.8001 -10.7920 -10.7920 -10.7293 -10.7293 -10.6811 -10.6811 -6.3789 -6.3789 -6.3523 -6.3523 -3.0264 -3.0264 -2.9413 -2.9413 -2.4095 -2.4095 -2.2821 -2.2821 -2.2634 -2.2634 -1.9699 -1.9699 -1.8732 -1.8732 -1.4200 -1.4200 -1.3388 -1.3388 -1.1791 -1.1791 -0.2386 -0.2386 -0.0919 -0.0919 0.0121 0.0121 0.0858 0.0858 0.2438 0.2438 0.3414 0.3414 0.4678 0.4678 1.0392 1.0392 1.7203 1.7203 2.0824 2.0824 2.1814 2.1814 2.6301 2.6301 2.6561 2.6561 3.0822 3.0822 3.9450 3.9450 4.0729 4.0729 4.3880 4.3880 4.5695 4.5695 5.0536 5.0536 5.0999 5.0999 5.2254 5.2254 5.4527 5.4527 5.6830 5.6830 5.8903 5.8903 6.4267 6.4267 6.6064 6.6064 6.8832 6.8832 7.0022 7.0022 7.0470 7.0470 9.1462 9.1469 k = 0.2027 0.1170-0.0000 ( 6092 PWs) bands (ev): -14.6215 -14.6215 -14.1160 -14.1160 -13.0919 -13.0919 -12.9645 -12.9645 -10.8153 -10.8153 -10.8033 -10.8033 -10.7303 -10.7303 -10.6829 -10.6829 -6.3876 -6.3876 -6.3615 -6.3615 -3.0217 -3.0217 -2.9406 -2.9406 -2.4016 -2.4016 -2.2799 -2.2799 -2.2619 -2.2619 -1.9741 -1.9741 -1.8728 -1.8728 -1.4208 -1.4208 -1.3337 -1.3337 -1.1801 -1.1801 -0.2273 -0.2273 -0.0841 -0.0841 0.0101 0.0101 0.0925 0.0925 0.2478 0.2478 0.3734 0.3734 0.5131 0.5131 1.0722 1.0722 1.7526 1.7526 2.0770 2.0770 2.1902 2.1902 2.6460 2.6460 2.6733 2.6733 3.0896 3.0896 3.9244 3.9244 4.0690 4.0690 4.3394 4.3394 4.5443 4.5443 5.0007 5.0007 5.0590 5.0590 5.1954 5.1954 5.4048 5.4048 5.6914 5.6914 5.8981 5.8981 6.4082 6.4082 6.5531 6.5531 6.9124 6.9124 7.0066 7.0066 7.0464 7.0464 9.1436 9.1454 k = 0.2162 0.1248-0.0000 ( 6100 PWs) bands (ev): -14.6130 -14.6130 -14.1210 -14.1210 -13.0854 -13.0854 -12.9588 -12.9588 -10.8321 -10.8321 -10.8138 -10.8138 -10.7312 -10.7312 -10.6848 -10.6848 -6.3965 -6.3965 -6.3709 -6.3709 -3.0170 -3.0170 -2.9400 -2.9400 -2.3936 -2.3936 -2.2778 -2.2778 -2.2606 -2.2606 -1.9786 -1.9786 -1.8723 -1.8723 -1.4216 -1.4216 -1.3278 -1.3278 -1.1809 -1.1809 -0.2217 -0.2217 -0.0706 -0.0706 0.0077 0.0077 0.0977 0.0977 0.2557 0.2557 0.4072 0.4072 0.5596 0.5596 1.1040 1.1040 1.7881 1.7881 2.0734 2.0734 2.2011 2.2011 2.6607 2.6607 2.6894 2.6894 3.0975 3.0975 3.9025 3.9025 4.0646 4.0646 4.2887 4.2887 4.5169 4.5169 4.9468 4.9468 5.0197 5.0197 5.1666 5.1666 5.3554 5.3554 5.7000 5.7000 5.9062 5.9062 6.3798 6.3798 6.4990 6.4990 6.9478 6.9478 7.0108 7.0108 7.0454 7.0454 9.1406 9.1407 k = 0.2297 0.1326-0.0000 ( 6098 PWs) bands (ev): -14.6042 -14.6042 -14.1263 -14.1263 -13.0787 -13.0787 -12.9529 -12.9529 -10.8495 -10.8495 -10.8243 -10.8243 -10.7322 -10.7322 -10.6867 -10.6867 -6.4054 -6.4054 -6.3804 -6.3804 -3.0123 -3.0123 -2.9395 -2.9395 -2.3856 -2.3856 -2.2756 -2.2756 -2.2594 -2.2594 -1.9834 -1.9834 -1.8716 -1.8716 -1.4222 -1.4222 -1.3212 -1.3212 -1.1814 -1.1814 -0.2204 -0.2204 -0.0537 -0.0537 0.0049 0.0049 0.1009 0.1009 0.2680 0.2680 0.4426 0.4426 0.6073 0.6073 1.1345 1.1345 1.8266 1.8266 2.0716 2.0716 2.2136 2.2136 2.6741 2.6741 2.7044 2.7044 3.1059 3.1059 3.8793 3.8793 4.0597 4.0597 4.2367 4.2367 4.4874 4.4874 4.8924 4.8924 4.9822 4.9822 5.1392 5.1392 5.3052 5.3052 5.7086 5.7086 5.9144 5.9144 6.3426 6.3426 6.4450 6.4450 6.9871 6.9871 7.0152 7.0152 7.0440 7.0440 9.1374 9.1375 k = 0.2432 0.1404-0.0000 ( 6094 PWs) bands (ev): -14.5950 -14.5950 -14.1320 -14.1320 -13.0717 -13.0717 -12.9469 -12.9469 -10.8674 -10.8674 -10.8349 -10.8349 -10.7332 -10.7332 -10.6886 -10.6886 -6.4144 -6.4144 -6.3899 -6.3899 -3.0077 -3.0077 -2.9389 -2.9389 -2.3775 -2.3775 -2.2734 -2.2734 -2.2582 -2.2582 -1.9884 -1.9884 -1.8706 -1.8706 -1.4225 -1.4225 -1.3141 -1.3141 -1.1816 -1.1816 -0.2214 -0.2214 -0.0360 -0.0360 0.0024 0.0024 0.1020 0.1020 0.2849 0.2849 0.4793 0.4793 0.6560 0.6560 1.1639 1.1639 1.8680 1.8680 2.0716 2.0716 2.2275 2.2275 2.6862 2.6862 2.7180 2.7180 3.1148 3.1148 3.8547 3.8547 4.0542 4.0542 4.1840 4.1840 4.4558 4.4558 4.8381 4.8381 4.9464 4.9464 5.1134 5.1134 5.2545 5.2545 5.7171 5.7171 5.9227 5.9227 6.2975 6.2975 6.3920 6.3920 7.0156 7.0156 7.0311 7.0311 7.0438 7.0438 9.1339 9.1339 k = 0.2568 0.1482-0.0000 ( 6100 PWs) bands (ev): -14.5856 -14.5856 -14.1380 -14.1380 -13.0646 -13.0646 -12.9409 -12.9409 -10.8855 -10.8855 -10.8455 -10.8455 -10.7341 -10.7341 -10.6906 -10.6906 -6.4234 -6.4234 -6.3994 -6.3994 -3.0031 -3.0031 -2.9385 -2.9385 -2.3696 -2.3696 -2.2713 -2.2713 -2.2572 -2.2572 -1.9935 -1.9935 -1.8695 -1.8695 -1.4227 -1.4227 -1.3067 -1.3067 -1.1816 -1.1816 -0.2234 -0.2234 -0.0214 -0.0214 0.0018 0.0018 0.1019 0.1019 0.3061 0.3061 0.5171 0.5171 0.7057 0.7057 1.1922 1.1922 1.9115 1.9115 2.0733 2.0733 2.2424 2.2424 2.6970 2.6970 2.7304 2.7304 3.1241 3.1241 3.8285 3.8285 4.0479 4.0479 4.1314 4.1314 4.4223 4.4223 4.7842 4.7842 4.9126 4.9126 5.0893 5.0893 5.2037 5.2037 5.7255 5.7255 5.9312 5.9312 6.2453 6.2453 6.3406 6.3406 7.0200 7.0200 7.0386 7.0386 7.0769 7.0769 9.1299 9.1306 k = 0.2703 0.1560-0.0000 ( 6090 PWs) bands (ev): -14.5758 -14.5758 -14.1442 -14.1442 -13.0572 -13.0572 -12.9348 -12.9348 -10.9036 -10.9036 -10.8561 -10.8561 -10.7351 -10.7351 -10.6925 -10.6925 -6.4322 -6.4322 -6.4088 -6.4088 -2.9985 -2.9985 -2.9381 -2.9381 -2.3618 -2.3618 -2.2692 -2.2692 -2.2563 -2.2563 -1.9988 -1.9988 -1.8682 -1.8682 -1.4226 -1.4226 -1.2989 -1.2989 -1.1813 -1.1813 -0.2256 -0.2256 -0.0158 -0.0158 0.0074 0.0074 0.1019 0.1019 0.3309 0.3309 0.5558 0.5558 0.7562 0.7562 1.2196 1.2196 1.9568 1.9568 2.0767 2.0767 2.2580 2.2580 2.7066 2.7066 2.7414 2.7414 3.1337 3.1337 3.8007 3.8007 4.0406 4.0406 4.0798 4.0798 4.3872 4.3872 4.7315 4.7315 4.8809 4.8809 5.0670 5.0670 5.1535 5.1535 5.7337 5.7337 5.9398 5.9398 6.1874 6.1874 6.2906 6.2906 7.0226 7.0226 7.0364 7.0364 7.1213 7.1213 9.1257 9.1307 k = 0.2838 0.1638-0.0000 ( 6090 PWs) bands (ev): -14.5659 -14.5659 -14.1508 -14.1508 -13.0498 -13.0498 -12.9288 -12.9288 -10.9216 -10.9216 -10.8667 -10.8667 -10.7360 -10.7360 -10.6945 -10.6945 -6.4410 -6.4410 -6.4180 -6.4180 -2.9941 -2.9941 -2.9377 -2.9377 -2.3543 -2.3543 -2.2672 -2.2672 -2.2555 -2.2555 -2.0041 -2.0041 -1.8667 -1.8667 -1.4223 -1.4223 -1.2911 -1.2911 -1.1808 -1.1808 -0.2274 -0.2274 -0.0176 -0.0176 0.0157 0.0157 0.1038 0.1038 0.3587 0.3587 0.5952 0.5952 0.8074 0.8074 1.2460 1.2460 2.0031 2.0031 2.0817 2.0817 2.2740 2.2740 2.7150 2.7150 2.7509 2.7509 3.1435 3.1435 3.7710 3.7710 4.0279 4.0279 4.0341 4.0341 4.3509 4.3509 4.6804 4.6804 4.8515 4.8515 5.0464 5.0464 5.1043 5.1043 5.7416 5.7416 5.9485 5.9485 6.1253 6.1253 6.2413 6.2413 7.0241 7.0241 7.0342 7.0342 7.1659 7.1659 9.1206 9.1284 k = 0.2973 0.1716-0.0000 ( 6102 PWs) bands (ev): -14.5558 -14.5558 -14.1576 -14.1576 -13.0423 -13.0423 -12.9229 -12.9229 -10.9394 -10.9394 -10.8772 -10.8772 -10.7369 -10.7369 -10.6964 -10.6964 -6.4495 -6.4495 -6.4269 -6.4269 -2.9899 -2.9899 -2.9375 -2.9375 -2.3471 -2.3471 -2.2654 -2.2654 -2.2547 -2.2547 -2.0095 -2.0095 -1.8652 -1.8652 -1.4217 -1.4217 -1.2833 -1.2833 -1.1802 -1.1802 -0.2285 -0.2285 -0.0215 -0.0215 0.0201 0.0201 0.1089 0.1089 0.3888 0.3888 0.6350 0.6350 0.8592 0.8592 1.2716 1.2716 2.0496 2.0496 2.0882 2.0882 2.2902 2.2902 2.7222 2.7222 2.7592 2.7592 3.1530 3.1530 3.7395 3.7395 3.9822 3.9822 4.0224 4.0224 4.3141 4.3141 4.6314 4.6314 4.8245 4.8245 5.0275 5.0275 5.0567 5.0567 5.7492 5.7492 5.9572 5.9572 6.0603 6.0603 6.1924 6.1924 7.0238 7.0238 7.0330 7.0330 7.2098 7.2098 9.1138 9.1179 k = 0.3108 0.1794-0.0000 ( 6106 PWs) bands (ev): -14.5455 -14.5455 -14.1647 -14.1647 -13.0348 -13.0348 -12.9171 -12.9171 -10.9568 -10.9568 -10.8875 -10.8875 -10.7378 -10.7378 -10.6983 -10.6983 -6.4578 -6.4578 -6.4355 -6.4355 -2.9859 -2.9859 -2.9372 -2.9372 -2.3403 -2.3403 -2.2638 -2.2638 -2.2537 -2.2537 -2.0147 -2.0147 -1.8636 -1.8636 -1.4210 -1.4210 -1.2755 -1.2755 -1.1794 -1.1794 -0.2288 -0.2288 -0.0261 -0.0261 0.0193 0.0193 0.1175 0.1175 0.4207 0.4207 0.6749 0.6749 0.9114 0.9114 1.2963 1.2963 2.0915 2.0915 2.1002 2.1002 2.3062 2.3062 2.7283 2.7283 2.7661 2.7661 3.1619 3.1619 3.7067 3.7067 3.9384 3.9384 4.0100 4.0100 4.2776 4.2776 4.5850 4.5850 4.8002 4.8002 5.0074 5.0074 5.0139 5.0139 5.7563 5.7563 5.9655 5.9655 5.9937 5.9937 6.1437 6.1437 7.0213 7.0213 7.0334 7.0334 7.2526 7.2526 9.1029 9.1046 k = 0.3243 0.1872-0.0000 ( 6106 PWs) bands (ev): -14.5352 -14.5352 -14.1719 -14.1719 -13.0274 -13.0274 -12.9114 -12.9114 -10.9738 -10.9738 -10.8975 -10.8975 -10.7386 -10.7386 -10.7001 -10.7001 -6.4658 -6.4658 -6.4438 -6.4438 -2.9821 -2.9821 -2.9370 -2.9370 -2.3339 -2.3339 -2.2625 -2.2625 -2.2526 -2.2526 -2.0198 -2.0198 -1.8620 -1.8620 -1.4200 -1.4200 -1.2679 -1.2679 -1.1784 -1.1784 -0.2282 -0.2282 -0.0310 -0.0310 0.0144 0.0144 0.1281 0.1281 0.4537 0.4537 0.7147 0.7147 0.9636 0.9636 1.3202 1.3202 2.1033 2.1033 2.1417 2.1417 2.3220 2.3220 2.7336 2.7336 2.7719 2.7719 3.1695 3.1695 3.6731 3.6731 3.8985 3.8985 3.9946 3.9946 4.2427 4.2427 4.5415 4.5415 4.7788 4.7788 4.9666 4.9666 4.9959 4.9959 5.7631 5.7631 5.9250 5.9250 5.9747 5.9747 6.0953 6.0953 7.0177 7.0177 7.0344 7.0344 7.2937 7.2937 9.0864 9.0872 k = 0.3378 0.1951-0.0000 ( 6110 PWs) bands (ev): -14.5249 -14.5249 -14.1793 -14.1793 -13.0201 -13.0201 -12.9060 -12.9060 -10.9901 -10.9901 -10.9071 -10.9071 -10.7393 -10.7393 -10.7019 -10.7019 -6.4735 -6.4735 -6.4516 -6.4516 -2.9785 -2.9785 -2.9368 -2.9368 -2.3280 -2.3280 -2.2616 -2.2616 -2.2512 -2.2512 -2.0248 -2.0248 -1.8604 -1.8604 -1.4189 -1.4189 -1.2607 -1.2607 -1.1773 -1.1773 -0.2266 -0.2266 -0.0361 -0.0361 0.0067 0.0067 0.1396 0.1396 0.4875 0.4875 0.7540 0.7540 1.0157 1.0157 1.3431 1.3431 2.1129 2.1129 2.1840 2.1840 2.3376 2.3376 2.7382 2.7382 2.7766 2.7766 3.1746 3.1746 3.6401 3.6401 3.8627 3.8627 3.9754 3.9754 4.2107 4.2107 4.5012 4.5012 4.7603 4.7603 4.9260 4.9260 4.9819 4.9819 5.7693 5.7693 5.8566 5.8566 5.9827 5.9827 6.0476 6.0476 7.0135 7.0135 7.0355 7.0355 7.3328 7.3328 9.0681 9.0685 k = 0.3514 0.2029-0.0000 ( 6106 PWs) bands (ev): -14.5146 -14.5146 -14.1868 -14.1868 -13.0130 -13.0130 -12.9008 -12.9008 -11.0057 -11.0057 -10.9163 -10.9163 -10.7401 -10.7401 -10.7036 -10.7036 -6.4807 -6.4807 -6.4590 -6.4590 -2.9752 -2.9752 -2.9365 -2.9365 -2.3226 -2.3226 -2.2609 -2.2609 -2.2496 -2.2496 -2.0295 -2.0295 -1.8587 -1.8587 -1.4177 -1.4177 -1.2538 -1.2538 -1.1761 -1.1761 -0.2241 -0.2241 -0.0412 -0.0412 -0.0026 -0.0026 0.1510 0.1510 0.5215 0.5215 0.7925 0.7925 1.0672 1.0672 1.3649 1.3649 2.1228 2.1228 2.2230 2.2230 2.3531 2.3531 2.7424 2.7424 2.7805 2.7805 3.1762 3.1762 3.6093 3.6093 3.8313 3.8313 3.9518 3.9518 4.1829 4.1829 4.4642 4.4642 4.7451 4.7451 4.8885 4.8885 4.9695 4.9695 5.7736 5.7736 5.7897 5.7897 5.9870 5.9870 6.0041 6.0041 7.0091 7.0091 7.0365 7.0365 7.3696 7.3696 9.0492 9.0493 k = 0.3649 0.2107-0.0000 ( 6106 PWs) bands (ev): -14.5045 -14.5045 -14.1944 -14.1944 -13.0062 -13.0062 -12.8960 -12.8960 -11.0204 -11.0204 -10.9250 -10.9250 -10.7407 -10.7407 -10.7051 -10.7051 -6.4875 -6.4875 -6.4658 -6.4658 -2.9723 -2.9723 -2.9362 -2.9362 -2.3177 -2.3177 -2.2605 -2.2605 -2.2477 -2.2477 -2.0339 -2.0339 -1.8571 -1.8571 -1.4165 -1.4165 -1.2473 -1.2473 -1.1747 -1.1747 -0.2206 -0.2206 -0.0462 -0.0462 -0.0130 -0.0130 0.1617 0.1617 0.5552 0.5552 0.8299 0.8299 1.1176 1.1176 1.3854 1.3854 2.1328 2.1328 2.2577 2.2577 2.3685 2.3685 2.7466 2.7466 2.7838 2.7838 3.1727 3.1727 3.5824 3.5824 3.8042 3.8042 3.9238 3.9238 4.1598 4.1598 4.4305 4.4305 4.7330 4.7330 4.8544 4.8544 4.9586 4.9586 5.7196 5.7196 5.7812 5.7812 5.9517 5.9517 6.0012 6.0012 7.0046 7.0046 7.0374 7.0374 7.4039 7.4039 9.0305 9.0306 k = 0.3784 0.2185-0.0000 ( 6098 PWs) bands (ev): -14.4946 -14.4946 -14.2019 -14.2019 -12.9997 -12.9997 -12.8915 -12.8915 -11.0342 -11.0342 -10.9331 -10.9331 -10.7413 -10.7413 -10.7066 -10.7066 -6.4938 -6.4938 -6.4721 -6.4721 -2.9696 -2.9696 -2.9359 -2.9359 -2.3134 -2.3134 -2.2603 -2.2603 -2.2458 -2.2458 -2.0380 -2.0380 -1.8556 -1.8556 -1.4153 -1.4153 -1.2414 -1.2414 -1.1733 -1.1733 -0.2162 -0.2162 -0.0512 -0.0512 -0.0239 -0.0239 0.1717 0.1717 0.5882 0.5882 0.8656 0.8656 1.1665 1.1665 1.4046 1.4046 2.1427 2.1427 2.2874 2.2874 2.3840 2.3840 2.7511 2.7511 2.7867 2.7867 3.1629 3.1629 3.5608 3.5608 3.7817 3.7817 3.8921 3.8921 4.1416 4.1416 4.4002 4.4002 4.7240 4.7240 4.8239 4.8239 4.9489 4.9489 5.6535 5.6535 5.7857 5.7857 5.9077 5.9077 6.0082 6.0082 7.0002 7.0002 7.0381 7.0381 7.4355 7.4355 9.0128 9.0128 k = 0.3919 0.2263-0.0000 ( 6090 PWs) bands (ev): -14.4850 -14.4850 -14.2093 -14.2093 -12.9937 -12.9937 -12.8874 -12.8874 -11.0468 -11.0468 -10.9406 -10.9406 -10.7419 -10.7419 -10.7080 -10.7080 -6.4996 -6.4996 -6.4778 -6.4778 -2.9672 -2.9672 -2.9356 -2.9356 -2.3096 -2.3096 -2.2602 -2.2602 -2.2439 -2.2439 -2.0417 -2.0417 -1.8541 -1.8541 -1.4140 -1.4140 -1.2360 -1.2360 -1.1717 -1.1717 -0.2110 -0.2110 -0.0561 -0.0561 -0.0350 -0.0350 0.1806 0.1806 0.6199 0.6199 0.8994 0.8994 1.2133 1.2133 1.4221 1.4221 2.1521 2.1521 2.3117 2.3117 2.3992 2.3992 2.7567 2.7567 2.7895 2.7895 3.1463 3.1463 3.5453 3.5453 3.7637 3.7637 3.8582 3.8582 4.1276 4.1276 4.3733 4.3733 4.7179 4.7179 4.7973 4.7973 4.9405 4.9405 5.5895 5.5895 5.7897 5.7897 5.8656 5.8656 6.0151 6.0151 6.9959 6.9959 7.0388 7.0388 7.4641 7.4641 8.9964 8.9964 k = 0.4054 0.2341-0.0000 ( 6084 PWs) bands (ev): -14.4760 -14.4760 -14.2164 -14.2164 -12.9881 -12.9881 -12.8837 -12.8837 -11.0582 -11.0582 -10.9474 -10.9474 -10.7424 -10.7424 -10.7092 -10.7092 -6.5048 -6.5048 -6.4829 -6.4829 -2.9652 -2.9652 -2.9353 -2.9353 -2.3064 -2.3064 -2.2602 -2.2602 -2.2420 -2.2420 -2.0451 -2.0451 -1.8528 -1.8528 -1.4128 -1.4128 -1.2313 -1.2313 -1.1702 -1.1702 -0.2049 -0.2049 -0.0612 -0.0612 -0.0457 -0.0457 0.1884 0.1884 0.6497 0.6497 0.9307 0.9307 1.2574 1.2574 1.4378 1.4378 2.1609 2.1609 2.3312 2.3312 2.4132 2.4132 2.7637 2.7637 2.7923 2.7923 3.1233 3.1233 3.5351 3.5351 3.7505 3.7505 3.8236 3.8236 4.1170 4.1170 4.3496 4.3496 4.7145 4.7145 4.7746 4.7746 4.9332 4.9332 5.5285 5.5285 5.7922 5.7922 5.8269 5.8269 6.0216 6.0216 6.9919 6.9919 7.0393 7.0393 7.4897 7.4897 8.9816 8.9816 k = 0.4189 0.2419-0.0000 ( 6082 PWs) bands (ev): -14.4675 -14.4675 -14.2232 -14.2232 -12.9831 -12.9831 -12.8804 -12.8804 -11.0683 -11.0683 -10.9534 -10.9534 -10.7428 -10.7428 -10.7103 -10.7103 -6.5093 -6.5093 -6.4873 -6.4873 -2.9635 -2.9635 -2.9349 -2.9349 -2.3037 -2.3037 -2.2603 -2.2603 -2.2402 -2.2402 -2.0481 -2.0481 -1.8516 -1.8516 -1.4118 -1.4118 -1.2272 -1.2272 -1.1687 -1.1687 -0.1983 -0.1983 -0.0675 -0.0675 -0.0549 -0.0549 0.1952 0.1952 0.6772 0.6772 0.9591 0.9591 1.2981 1.2981 1.4513 1.4513 2.1686 2.1686 2.3470 2.3470 2.4250 2.4250 2.7727 2.7727 2.7953 2.7953 3.0952 3.0952 3.5291 3.5291 3.7421 3.7421 3.7901 3.7901 4.1091 4.1091 4.3291 4.3291 4.7132 4.7132 4.7560 4.7560 4.9270 4.9270 5.4717 5.4717 5.7826 5.7826 5.8031 5.8031 6.0274 6.0274 6.9882 6.9882 7.0396 7.0396 7.5120 7.5120 8.9684 8.9684 k = 0.4324 0.2497-0.0000 ( 6082 PWs) bands (ev): -14.4598 -14.4598 -14.2294 -14.2294 -12.9788 -12.9788 -12.8776 -12.8776 -11.0770 -11.0770 -10.9586 -10.9586 -10.7431 -10.7431 -10.7112 -10.7112 -6.5133 -6.5133 -6.4911 -6.4911 -2.9621 -2.9621 -2.9346 -2.9346 -2.3015 -2.3015 -2.2603 -2.2603 -2.2386 -2.2386 -2.0506 -2.0506 -1.8505 -1.8505 -1.4108 -1.4108 -1.2238 -1.2238 -1.1674 -1.1674 -0.1910 -0.1910 -0.0759 -0.0759 -0.0613 -0.0613 0.2010 0.2010 0.7018 0.7018 0.9841 0.9841 1.3347 1.3347 1.4624 1.4624 2.1752 2.1752 2.3603 2.3603 2.4335 2.4335 2.7837 2.7837 2.7987 2.7987 3.0637 3.0637 3.5255 3.5255 3.7379 3.7379 3.7591 3.7591 4.1033 4.1033 4.3119 4.3119 4.7134 4.7134 4.7414 4.7414 4.9218 4.9218 5.4201 5.4201 5.7532 5.7532 5.8026 5.8026 6.0325 6.0325 6.9850 6.9850 7.0399 7.0399 7.5310 7.5310 8.9571 8.9571 k = 0.4459 0.2575-0.0000 ( 6086 PWs) bands (ev): -14.4531 -14.4531 -14.2349 -14.2349 -12.9751 -12.9751 -12.8753 -12.8753 -11.0843 -11.0843 -10.9629 -10.9629 -10.7434 -10.7434 -10.7120 -10.7120 -6.5165 -6.5165 -6.4943 -6.4943 -2.9610 -2.9610 -2.9343 -2.9343 -2.2998 -2.2998 -2.2604 -2.2604 -2.2373 -2.2373 -2.0528 -2.0528 -1.8497 -1.8497 -1.4100 -1.4100 -1.2211 -1.2211 -1.1661 -1.1661 -0.1834 -0.1834 -0.0858 -0.0858 -0.0653 -0.0653 0.2056 0.2056 0.7228 0.7228 1.0053 1.0053 1.3665 1.3665 1.4710 1.4710 2.1806 2.1806 2.3720 2.3720 2.4384 2.4384 2.7952 2.7952 2.8042 2.8042 3.0308 3.0308 3.5232 3.5232 3.7304 3.7304 3.7386 3.7386 4.0990 4.0990 4.2978 4.2978 4.7145 4.7145 4.7307 4.7307 4.9176 4.9176 5.3752 5.3752 5.7255 5.7255 5.8043 5.8043 6.0368 6.0368 6.9822 6.9822 7.0402 7.0402 7.5467 7.5467 8.9477 8.9477 k = 0.4595 0.2653-0.0000 ( 6094 PWs) bands (ev): -14.4476 -14.4476 -14.2394 -14.2394 -12.9723 -12.9723 -12.8735 -12.8735 -11.0900 -11.0900 -10.9663 -10.9663 -10.7437 -10.7437 -10.7127 -10.7127 -6.5191 -6.5191 -6.4967 -6.4967 -2.9602 -2.9602 -2.9341 -2.9341 -2.2985 -2.2985 -2.2605 -2.2605 -2.2362 -2.2362 -2.0544 -2.0544 -1.8490 -1.8490 -1.4094 -1.4094 -1.2189 -1.2189 -1.1652 -1.1652 -0.1757 -0.1757 -0.0957 -0.0957 -0.0681 -0.0681 0.2092 0.2092 0.7398 0.7398 1.0223 1.0223 1.3930 1.3930 1.4768 1.4768 2.1848 2.1848 2.3824 2.3824 2.4398 2.4398 2.8014 2.8014 2.8172 2.8172 2.9980 2.9980 3.5216 3.5216 3.7085 3.7085 3.7396 3.7396 4.0960 4.0960 4.2868 4.2868 4.7151 4.7151 4.7243 4.7243 4.9144 4.9144 5.3382 5.3382 5.7029 5.7029 5.8059 5.8059 6.0402 6.0402 6.9799 6.9799 7.0403 7.0403 7.5589 7.5589 8.9403 8.9403 k = 0.4730 0.2731-0.0000 ( 6094 PWs) bands (ev): -14.4435 -14.4435 -14.2429 -14.2429 -12.9702 -12.9702 -12.8722 -12.8722 -11.0941 -11.0941 -10.9687 -10.9687 -10.7438 -10.7438 -10.7131 -10.7131 -6.5209 -6.5209 -6.4985 -6.4985 -2.9597 -2.9597 -2.9339 -2.9339 -2.2976 -2.2976 -2.2605 -2.2605 -2.2354 -2.2354 -2.0556 -2.0556 -1.8485 -1.8485 -1.4089 -1.4089 -1.2174 -1.2174 -1.1644 -1.1644 -0.1685 -0.1685 -0.1047 -0.1047 -0.0699 -0.0699 0.2118 0.2118 0.7523 0.7523 1.0347 1.0347 1.4134 1.4134 1.4801 1.4801 2.1877 2.1877 2.3915 2.3915 2.4387 2.4387 2.8043 2.8043 2.8348 2.8348 2.9674 2.9674 3.5204 3.5204 3.6917 3.6917 3.7419 3.7419 4.0940 4.0940 4.2790 4.2790 4.7138 4.7138 4.7224 4.7224 4.9122 4.9122 5.3105 5.3105 5.6861 5.6861 5.8071 5.8071 6.0427 6.0427 6.9783 6.9783 7.0404 7.0404 7.5677 7.5677 8.9350 8.9350 k = 0.4865 0.2809-0.0000 ( 6086 PWs) bands (ev): -14.4410 -14.4410 -14.2450 -14.2450 -12.9689 -12.9689 -12.8714 -12.8714 -11.0966 -11.0966 -10.9702 -10.9702 -10.7439 -10.7439 -10.7134 -10.7134 -6.5220 -6.5220 -6.4995 -6.4995 -2.9593 -2.9593 -2.9337 -2.9337 -2.2971 -2.2971 -2.2605 -2.2605 -2.2349 -2.2349 -2.0563 -2.0563 -1.8482 -1.8482 -1.4086 -1.4086 -1.2165 -1.2165 -1.1639 -1.1639 -0.1628 -0.1628 -0.1114 -0.1114 -0.0710 -0.0710 0.2133 0.2133 0.7600 0.7600 1.0423 1.0423 1.4266 1.4266 1.4812 1.4812 2.1894 2.1894 2.3983 2.3983 2.4364 2.4364 2.8059 2.8059 2.8522 2.8522 2.9420 2.9420 3.5196 3.5196 3.6813 3.6813 3.7440 3.7440 4.0928 4.0928 4.2743 4.2743 4.7121 4.7121 4.7227 4.7227 4.9108 4.9108 5.2933 5.2933 5.6758 5.6758 5.8078 5.8078 6.0442 6.0442 6.9773 6.9773 7.0405 7.0405 7.5729 7.5729 8.9319 8.9319 k = 0.5000 0.2887-0.0000 ( 6092 PWs) bands (ev): -14.4401 -14.4401 -14.2457 -14.2457 -12.9685 -12.9685 -12.8711 -12.8711 -11.0974 -11.0974 -10.9707 -10.9707 -10.7440 -10.7440 -10.7135 -10.7135 -6.5224 -6.5224 -6.4999 -6.4999 -2.9592 -2.9592 -2.9337 -2.9337 -2.2969 -2.2969 -2.2605 -2.2605 -2.2347 -2.2347 -2.0566 -2.0566 -1.8481 -1.8481 -1.4085 -1.4085 -1.2162 -1.2162 -1.1637 -1.1637 -0.1606 -0.1606 -0.1141 -0.1141 -0.0714 -0.0714 0.2138 0.2138 0.7625 0.7625 1.0448 1.0448 1.4313 1.4313 1.4814 1.4814 2.1899 2.1899 2.4011 2.4011 2.4351 2.4351 2.8065 2.8065 2.8609 2.8609 2.9306 2.9306 3.5193 3.5193 3.6777 3.6777 3.7447 3.7447 4.0925 4.0925 4.2727 4.2727 4.7114 4.7114 4.7230 4.7230 4.9104 4.9104 5.2875 5.2875 5.6723 5.6723 5.8081 5.8081 6.0447 6.0447 6.9770 6.9770 7.0405 7.0405 7.5747 7.5747 8.9308 8.9308 k = 0.5000 0.2887-0.0000 ( 6092 PWs) bands (ev): -14.4401 -14.4401 -14.2457 -14.2457 -12.9685 -12.9685 -12.8711 -12.8711 -11.0974 -11.0974 -10.9707 -10.9707 -10.7440 -10.7440 -10.7135 -10.7135 -6.5224 -6.5224 -6.4999 -6.4999 -2.9592 -2.9592 -2.9337 -2.9337 -2.2969 -2.2969 -2.2605 -2.2605 -2.2347 -2.2347 -2.0566 -2.0566 -1.8481 -1.8481 -1.4085 -1.4085 -1.2162 -1.2162 -1.1637 -1.1637 -0.1606 -0.1606 -0.1141 -0.1141 -0.0714 -0.0714 0.2138 0.2138 0.7625 0.7625 1.0448 1.0448 1.4313 1.4313 1.4814 1.4814 2.1899 2.1899 2.4011 2.4011 2.4351 2.4351 2.8065 2.8065 2.8609 2.8609 2.9306 2.9306 3.5193 3.5193 3.6777 3.6777 3.7447 3.7447 4.0925 4.0925 4.2727 4.2727 4.7114 4.7114 4.7230 4.7230 4.9104 4.9104 5.2875 5.2875 5.6723 5.6723 5.8081 5.8081 6.0447 6.0447 6.9770 6.9770 7.0405 7.0405 7.5747 7.5747 8.9308 8.9308 k = 0.4921 0.3024-0.0000 ( 6096 PWs) bands (ev): -14.4398 -14.4398 -14.2460 -14.2460 -12.9682 -12.9682 -12.8711 -12.8711 -11.0974 -11.0974 -10.9706 -10.9706 -10.7442 -10.7442 -10.7138 -10.7138 -6.5224 -6.5224 -6.5000 -6.5000 -2.9592 -2.9592 -2.9337 -2.9337 -2.2969 -2.2969 -2.2605 -2.2605 -2.2348 -2.2348 -2.0563 -2.0563 -1.8483 -1.8483 -1.4084 -1.4084 -1.2166 -1.2166 -1.1638 -1.1638 -0.1609 -0.1609 -0.1140 -0.1140 -0.0733 -0.0733 0.2174 0.2174 0.7626 0.7626 1.0473 1.0473 1.4313 1.4313 1.4824 1.4824 2.1877 2.1877 2.4007 2.4007 2.4368 2.4368 2.7995 2.7995 2.8678 2.8678 2.9303 2.9303 3.5196 3.5196 3.6732 3.6732 3.7462 3.7462 4.0910 4.0910 4.2740 4.2740 4.7107 4.7107 4.7214 4.7214 4.9093 4.9093 5.2898 5.2898 5.6744 5.6744 5.8091 5.8091 6.0443 6.0443 6.9743 6.9743 7.0386 7.0386 7.5750 7.5750 8.9311 8.9311 k = 0.4841 0.3162-0.0000 ( 6092 PWs) bands (ev): -14.4391 -14.4391 -14.2466 -14.2466 -12.9675 -12.9675 -12.8712 -12.8712 -11.0976 -11.0976 -10.9705 -10.9705 -10.7449 -10.7449 -10.7148 -10.7148 -6.5225 -6.5225 -6.5003 -6.5003 -2.9590 -2.9590 -2.9338 -2.9338 -2.2966 -2.2966 -2.2605 -2.2605 -2.2349 -2.2349 -2.0552 -2.0552 -1.8489 -1.8489 -1.4080 -1.4080 -1.2177 -1.2177 -1.1640 -1.1640 -0.1618 -0.1618 -0.1139 -0.1139 -0.0787 -0.0787 0.2278 0.2278 0.7627 0.7627 1.0548 1.0548 1.4315 1.4315 1.4853 1.4853 2.1811 2.1811 2.3996 2.3996 2.4419 2.4419 2.7842 2.7842 2.8829 2.8829 2.9295 2.9295 3.5205 3.5205 3.6610 3.6610 3.7497 3.7497 4.0865 4.0865 4.2780 4.2780 4.7083 4.7083 4.7169 4.7169 4.9061 4.9061 5.2968 5.2968 5.6807 5.6807 5.8122 5.8122 6.0431 6.0431 6.9663 6.9663 7.0328 7.0328 7.5759 7.5759 8.9319 8.9319 k = 0.4762 0.3299-0.0000 ( 6084 PWs) bands (ev): -14.4378 -14.4378 -14.2477 -14.2477 -12.9663 -12.9663 -12.8712 -12.8712 -11.0978 -11.0978 -10.9702 -10.9702 -10.7461 -10.7461 -10.7164 -10.7164 -6.5226 -6.5226 -6.5008 -6.5008 -2.9587 -2.9587 -2.9340 -2.9340 -2.2961 -2.2961 -2.2604 -2.2604 -2.2351 -2.2351 -2.0534 -2.0534 -1.8497 -1.8497 -1.4074 -1.4074 -1.2196 -1.2196 -1.1642 -1.1642 -0.1635 -0.1635 -0.1138 -0.1138 -0.0865 -0.0865 0.2443 0.2443 0.7631 0.7631 1.0667 1.0667 1.4318 1.4318 1.4901 1.4901 2.1704 2.1704 2.3977 2.3977 2.4499 2.4499 2.7665 2.7665 2.9005 2.9005 2.9281 2.9281 3.5219 3.5219 3.6430 3.6430 3.7534 3.7534 4.0793 4.0793 4.2842 4.2842 4.7042 4.7042 4.7093 4.7093 4.9010 4.9010 5.3085 5.3085 5.6909 5.6909 5.8174 5.8174 6.0413 6.0413 6.9531 6.9531 7.0234 7.0234 7.5774 7.5774 8.9334 8.9334 k = 0.4683 0.3437-0.0000 ( 6080 PWs) bands (ev): -14.4360 -14.4360 -14.2491 -14.2491 -12.9646 -12.9646 -12.8713 -12.8713 -11.0981 -11.0981 -10.9698 -10.9698 -10.7476 -10.7476 -10.7186 -10.7186 -6.5227 -6.5227 -6.5016 -6.5016 -2.9583 -2.9583 -2.9342 -2.9342 -2.2955 -2.2955 -2.2604 -2.2604 -2.2354 -2.2354 -2.0509 -2.0509 -1.8509 -1.8509 -1.4065 -1.4065 -1.2221 -1.2221 -1.1646 -1.1646 -0.1662 -0.1662 -0.1139 -0.1139 -0.0955 -0.0955 0.2656 0.2656 0.7642 0.7642 1.0826 1.0826 1.4324 1.4324 1.4967 1.4967 2.1562 2.1562 2.3948 2.3948 2.4604 2.4604 2.7484 2.7484 2.9183 2.9183 2.9267 2.9267 3.5238 3.5238 3.6209 3.6209 3.7564 3.7564 4.0694 4.0694 4.2923 4.2923 4.6972 4.6972 4.7000 4.7000 4.8939 4.8939 5.3248 5.3248 5.7048 5.7048 5.8244 5.8244 6.0389 6.0389 6.9348 6.9348 7.0102 7.0102 7.5794 7.5794 8.9354 8.9354 k = 0.4603 0.3574-0.0000 ( 6094 PWs) bands (ev): -14.4337 -14.4337 -14.2510 -14.2510 -12.9625 -12.9625 -12.8715 -12.8715 -11.0985 -11.0985 -10.9694 -10.9694 -10.7496 -10.7496 -10.7213 -10.7213 -6.5229 -6.5229 -6.5025 -6.5025 -2.9578 -2.9578 -2.9346 -2.9346 -2.2948 -2.2948 -2.2604 -2.2604 -2.2358 -2.2358 -2.0479 -2.0479 -1.8526 -1.8526 -1.4055 -1.4055 -1.2254 -1.2254 -1.1650 -1.1650 -0.1701 -0.1701 -0.1149 -0.1149 -0.1036 -0.1036 0.2909 0.2909 0.7662 0.7662 1.1018 1.1018 1.4332 1.4332 1.5050 1.5050 2.1388 2.1388 2.3907 2.3907 2.4730 2.4730 2.7311 2.7311 2.9228 2.9228 2.9380 2.9380 3.5261 3.5261 3.5957 3.5957 3.7586 3.7586 4.0571 4.0571 4.3018 4.3018 4.6843 4.6843 4.6919 4.6919 4.8852 4.8852 5.3458 5.3458 5.7218 5.7218 5.8331 5.8331 6.0362 6.0362 6.9116 6.9116 6.9934 6.9934 7.5817 7.5817 8.9378 8.9378 k = 0.4524 0.3712-0.0000 ( 6098 PWs) bands (ev): -14.4309 -14.4309 -14.2534 -14.2534 -12.9599 -12.9599 -12.8717 -12.8717 -11.0990 -11.0990 -10.9689 -10.9689 -10.7519 -10.7519 -10.7246 -10.7246 -6.5231 -6.5231 -6.5036 -6.5036 -2.9573 -2.9573 -2.9350 -2.9350 -2.2939 -2.2939 -2.2604 -2.2604 -2.2363 -2.2363 -2.0442 -2.0442 -1.8546 -1.8546 -1.4042 -1.4042 -1.2294 -1.2294 -1.1653 -1.1653 -0.1755 -0.1755 -0.1186 -0.1186 -0.1081 -0.1081 0.3194 0.3194 0.7693 0.7693 1.1235 1.1235 1.4346 1.4346 1.5150 1.5150 2.1187 2.1187 2.3850 2.3850 2.4873 2.4873 2.7152 2.7152 2.9198 2.9198 2.9561 2.9561 3.5286 3.5286 3.5681 3.5681 3.7601 3.7601 4.0427 4.0427 4.3119 4.3119 4.6682 4.6682 4.6825 4.6825 4.8751 4.8751 5.3712 5.3712 5.7416 5.7416 5.8433 5.8433 6.0336 6.0336 6.8839 6.8839 6.9731 6.9731 7.5844 7.5844 8.9408 8.9408 k = 0.4444 0.3849-0.0000 ( 6108 PWs) bands (ev): -14.4276 -14.4276 -14.2561 -14.2561 -12.9570 -12.9570 -12.8720 -12.8720 -11.0997 -11.0997 -10.9684 -10.9684 -10.7544 -10.7544 -10.7282 -10.7282 -6.5234 -6.5234 -6.5048 -6.5048 -2.9566 -2.9566 -2.9355 -2.9355 -2.2930 -2.2930 -2.2604 -2.2604 -2.2369 -2.2369 -2.0399 -2.0399 -1.8569 -1.8569 -1.4026 -1.4026 -1.2340 -1.2340 -1.1656 -1.1656 -0.1826 -0.1826 -0.1241 -0.1241 -0.1092 -0.1092 0.3504 0.3504 0.7738 0.7738 1.1469 1.1469 1.4366 1.4366 1.5263 1.5263 2.0962 2.0962 2.3777 2.3777 2.5029 2.5029 2.7013 2.7013 2.9161 2.9161 2.9741 2.9741 3.5291 3.5291 3.5410 3.5410 3.7612 3.7612 4.0267 4.0267 4.3218 4.3218 4.6502 4.6502 4.6713 4.6713 4.8637 4.8637 5.4008 5.4008 5.7635 5.7635 5.8550 5.8550 6.0313 6.0313 6.8518 6.8518 6.9496 6.9496 7.5872 7.5872 8.9442 8.9442 k = 0.4365 0.3986-0.0000 ( 6100 PWs) bands (ev): -14.4239 -14.4239 -14.2593 -14.2593 -12.9536 -12.9536 -12.8724 -12.8724 -11.1005 -11.1005 -10.9678 -10.9678 -10.7572 -10.7572 -10.7322 -10.7322 -6.5237 -6.5237 -6.5063 -6.5063 -2.9559 -2.9559 -2.9360 -2.9360 -2.2919 -2.2919 -2.2604 -2.2604 -2.2375 -2.2375 -2.0351 -2.0351 -1.8595 -1.8595 -1.4008 -1.4008 -1.2391 -1.2391 -1.1657 -1.1657 -0.1910 -0.1910 -0.1289 -0.1289 -0.1093 -0.1093 0.3833 0.3833 0.7795 0.7795 1.1713 1.1713 1.4396 1.4396 1.5390 1.5390 2.0716 2.0716 2.3684 2.3684 2.5196 2.5196 2.6900 2.6900 2.9116 2.9116 2.9918 2.9918 3.5050 3.5050 3.5373 3.5373 3.7623 3.7623 4.0095 4.0095 4.3307 4.3307 4.6312 4.6312 4.6581 4.6581 4.8513 4.8513 5.4343 5.4343 5.7868 5.7868 5.8679 5.8679 6.0300 6.0300 6.8156 6.8156 6.9230 6.9230 7.5901 7.5901 8.9480 8.9480 k = 0.4286 0.4124-0.0000 ( 6100 PWs) bands (ev): -14.4196 -14.4196 -14.2629 -14.2629 -12.9500 -12.9500 -12.8729 -12.8729 -11.1013 -11.1013 -10.9673 -10.9673 -10.7601 -10.7601 -10.7365 -10.7365 -6.5240 -6.5240 -6.5078 -6.5078 -2.9550 -2.9550 -2.9365 -2.9365 -2.2907 -2.2907 -2.2603 -2.2603 -2.2381 -2.2381 -2.0298 -2.0298 -1.8625 -1.8625 -1.3987 -1.3987 -1.2446 -1.2446 -1.1657 -1.1657 -0.2004 -0.2004 -0.1325 -0.1325 -0.1091 -0.1091 0.4178 0.4178 0.7864 0.7864 1.1957 1.1957 1.4440 1.4440 1.5527 1.5527 2.0453 2.0453 2.3570 2.3570 2.5371 2.5371 2.6814 2.6814 2.9064 2.9064 3.0093 3.0093 3.4731 3.4731 3.5405 3.5405 3.7639 3.7639 3.9914 3.9914 4.3372 4.3372 4.6124 4.6124 4.6428 4.6428 4.8380 4.8380 5.4710 5.4710 5.8106 5.8106 5.8818 5.8818 6.0301 6.0301 6.7757 6.7757 6.8936 6.8936 7.5931 7.5931 8.9522 8.9522 k = 0.4206 0.4261-0.0000 ( 6100 PWs) bands (ev): -14.4150 -14.4150 -14.2669 -14.2669 -12.9460 -12.9460 -12.8735 -12.8735 -11.1024 -11.1024 -10.9667 -10.9667 -10.7631 -10.7631 -10.7409 -10.7409 -6.5243 -6.5243 -6.5094 -6.5094 -2.9542 -2.9542 -2.9371 -2.9371 -2.2896 -2.2896 -2.2602 -2.2602 -2.2388 -2.2388 -2.0242 -2.0242 -1.8658 -1.8658 -1.3965 -1.3965 -1.2505 -1.2505 -1.1656 -1.1656 -0.2101 -0.2101 -0.1350 -0.1350 -0.1089 -0.1089 0.4535 0.4535 0.7943 0.7943 1.2191 1.2191 1.4505 1.4505 1.5671 1.5671 2.0176 2.0176 2.3436 2.3436 2.5551 2.5551 2.6759 2.6759 2.9005 2.9005 3.0266 3.0266 3.4402 3.4402 3.5442 3.5442 3.7662 3.7662 3.9729 3.9729 4.3401 4.3401 4.5955 4.5955 4.6257 4.6257 4.8242 4.8242 5.5107 5.5107 5.8340 5.8340 5.8967 5.8967 6.0324 6.0324 6.7323 6.7323 6.8617 6.8617 7.5960 7.5960 8.9567 8.9567 k = 0.4127 0.4399-0.0000 ( 6100 PWs) bands (ev): -14.4098 -14.4098 -14.2714 -14.2714 -12.9417 -12.9417 -12.8743 -12.8743 -11.1035 -11.1035 -10.9663 -10.9663 -10.7660 -10.7660 -10.7454 -10.7454 -6.5247 -6.5247 -6.5112 -6.5112 -2.9533 -2.9533 -2.9377 -2.9377 -2.2884 -2.2884 -2.2601 -2.2601 -2.2396 -2.2396 -2.0182 -2.0182 -1.8694 -1.8694 -1.3940 -1.3940 -1.2565 -1.2565 -1.1655 -1.1655 -0.2197 -0.2197 -0.1367 -0.1367 -0.1087 -0.1087 0.4900 0.4900 0.8028 0.8028 1.2406 1.2406 1.4596 1.4596 1.5821 1.5821 1.9887 1.9887 2.3286 2.3286 2.5735 2.5735 2.6734 2.6734 2.8937 2.8937 3.0437 3.0437 3.4072 3.4072 3.5478 3.5478 3.7696 3.7696 3.9545 3.9545 4.3378 4.3378 4.5820 4.5820 4.6068 4.6068 4.8098 4.8098 5.5526 5.5526 5.8558 5.8558 5.9125 5.9125 6.0378 6.0378 6.6858 6.6858 6.8276 6.8276 7.5990 7.5990 8.9614 8.9614 k = 0.4048 0.4536-0.0000 ( 6098 PWs) bands (ev): -14.4043 -14.4043 -14.2763 -14.2763 -12.9372 -12.9372 -12.8753 -12.8753 -11.1047 -11.1047 -10.9659 -10.9659 -10.7688 -10.7688 -10.7498 -10.7498 -6.5251 -6.5251 -6.5129 -6.5129 -2.9523 -2.9523 -2.9383 -2.9383 -2.2872 -2.2872 -2.2598 -2.2598 -2.2403 -2.2403 -2.0120 -2.0120 -1.8732 -1.8732 -1.3913 -1.3913 -1.2626 -1.2626 -1.1652 -1.1652 -0.2289 -0.2289 -0.1377 -0.1377 -0.1088 -0.1088 0.5270 0.5270 0.8115 0.8115 1.2592 1.2592 1.4719 1.4719 1.5972 1.5972 1.9592 1.9592 2.3122 2.3122 2.5918 2.5918 2.6739 2.6739 2.8860 2.8860 3.0605 3.0605 3.3745 3.3745 3.5511 3.5511 3.7743 3.7743 3.9368 3.9368 4.3294 4.3294 4.5726 4.5726 4.5874 4.5874 4.7952 4.7952 5.5963 5.5963 5.8747 5.8747 5.9292 5.9292 6.0470 6.0470 6.6366 6.6366 6.7917 6.7917 7.6018 7.6018 8.9664 8.9664 k = 0.3968 0.4674-0.0000 ( 6086 PWs) bands (ev): -14.3983 -14.3983 -14.2815 -14.2815 -12.9326 -12.9326 -12.8764 -12.8764 -11.1060 -11.1060 -10.9656 -10.9656 -10.7714 -10.7714 -10.7542 -10.7542 -6.5255 -6.5255 -6.5147 -6.5147 -2.9513 -2.9513 -2.9389 -2.9389 -2.2861 -2.2861 -2.2595 -2.2595 -2.2411 -2.2411 -2.0057 -2.0057 -1.8772 -1.8772 -1.3885 -1.3885 -1.2686 -1.2686 -1.1649 -1.1649 -0.2373 -0.2373 -0.1382 -0.1382 -0.1090 -0.1090 0.5642 0.5642 0.8198 0.8198 1.2745 1.2745 1.4878 1.4878 1.6120 1.6120 1.9292 1.9292 2.2949 2.2949 2.6100 2.6100 2.6770 2.6770 2.8773 2.8773 3.0771 3.0771 3.3426 3.3426 3.5539 3.5539 3.7804 3.7804 3.9202 3.9202 4.3149 4.3149 4.5600 4.5600 4.5754 4.5754 4.7803 4.7803 5.6411 5.6411 5.8901 5.8901 5.9470 5.9470 6.0604 6.0604 6.5851 6.5851 6.7546 6.7546 7.6044 7.6044 8.9715 8.9716 k = 0.3889 0.4811-0.0000 ( 6086 PWs) bands (ev): -14.3920 -14.3920 -14.2872 -14.2872 -12.9278 -12.9278 -12.8778 -12.8778 -11.1074 -11.1074 -10.9655 -10.9655 -10.7737 -10.7737 -10.7584 -10.7584 -6.5258 -6.5258 -6.5165 -6.5165 -2.9504 -2.9504 -2.9395 -2.9395 -2.2852 -2.2852 -2.2590 -2.2590 -2.2420 -2.2420 -1.9995 -1.9995 -1.8814 -1.8814 -1.3856 -1.3856 -1.2744 -1.2744 -1.1646 -1.1646 -0.2450 -0.2450 -0.1382 -0.1382 -0.1095 -0.1095 0.6010 0.6010 0.8271 0.8271 1.2863 1.2863 1.5070 1.5070 1.6263 1.6263 1.8993 1.8993 2.2774 2.2774 2.6277 2.6277 2.6825 2.6825 2.8675 2.8675 3.0932 3.0932 3.3119 3.3119 3.5559 3.5559 3.7880 3.7880 3.9054 3.9054 4.2953 4.2953 4.5389 4.5389 4.5763 4.5763 4.7651 4.7651 5.6863 5.6863 5.9017 5.9017 5.9660 5.9660 6.0776 6.0776 6.5317 6.5317 6.7168 6.7168 7.6070 7.6070 8.9768 8.9768 k = 0.3810 0.4949-0.0000 ( 6078 PWs) bands (ev): -14.3853 -14.3853 -14.2934 -14.2934 -12.9230 -12.9230 -12.8795 -12.8795 -11.1089 -11.1089 -10.9654 -10.9654 -10.7756 -10.7756 -10.7623 -10.7623 -6.5262 -6.5262 -6.5182 -6.5182 -2.9494 -2.9494 -2.9401 -2.9401 -2.2843 -2.2843 -2.2585 -2.2585 -2.2427 -2.2427 -1.9934 -1.9934 -1.8855 -1.8855 -1.3827 -1.3827 -1.2798 -1.2798 -1.1643 -1.1643 -0.2517 -0.2517 -0.1377 -0.1377 -0.1102 -0.1102 0.6371 0.6371 0.8329 0.8329 1.2952 1.2952 1.5288 1.5288 1.6396 1.6396 1.8700 1.8700 2.2602 2.2602 2.6446 2.6446 2.6902 2.6902 2.8565 2.8565 3.1088 3.1088 3.2831 3.2831 3.5569 3.5569 3.7970 3.7970 3.8927 3.8927 4.2724 4.2724 4.5163 4.5163 4.5824 4.5824 4.7499 4.7499 5.7311 5.7311 5.9099 5.9099 5.9865 5.9865 6.0973 6.0973 6.4768 6.4768 6.6794 6.6794 7.6094 7.6094 8.9822 8.9823 k = 0.3730 0.5086-0.0000 ( 6080 PWs) bands (ev): -14.3782 -14.3782 -14.2999 -14.2999 -12.9182 -12.9182 -12.8814 -12.8814 -11.1103 -11.1103 -10.9655 -10.9655 -10.7772 -10.7772 -10.7659 -10.7659 -6.5264 -6.5264 -6.5199 -6.5199 -2.9486 -2.9486 -2.9406 -2.9406 -2.2836 -2.2836 -2.2579 -2.2579 -2.2436 -2.2436 -1.9878 -1.9878 -1.8896 -1.8896 -1.3799 -1.3799 -1.2848 -1.2848 -1.1640 -1.1640 -0.2574 -0.2574 -0.1369 -0.1369 -0.1113 -0.1113 0.6719 0.6719 0.8363 0.8363 1.3018 1.3018 1.5524 1.5524 1.6514 1.6514 1.8416 1.8416 2.2439 2.2439 2.6604 2.6604 2.6997 2.6997 2.8443 2.8443 3.1236 3.1236 3.2565 3.2565 3.5567 3.5567 3.8073 3.8073 3.8824 3.8824 4.2482 4.2482 4.4941 4.4941 4.5916 4.5916 4.7345 4.7345 5.7745 5.7745 5.9156 5.9156 6.0089 6.0089 6.1179 6.1179 6.4212 6.4212 6.6432 6.6432 7.6115 7.6115 8.9877 8.9877 k = 0.3651 0.5224-0.0000 ( 6080 PWs) bands (ev): -14.3708 -14.3708 -14.3068 -14.3068 -12.9134 -12.9134 -12.8836 -12.8836 -11.1116 -11.1116 -10.9656 -10.9656 -10.7783 -10.7783 -10.7691 -10.7691 -6.5266 -6.5266 -6.5214 -6.5214 -2.9478 -2.9478 -2.9412 -2.9412 -2.2830 -2.2830 -2.2573 -2.2573 -2.2443 -2.2443 -1.9827 -1.9827 -1.8933 -1.8933 -1.3773 -1.3773 -1.2892 -1.2892 -1.1637 -1.1637 -0.2621 -0.2621 -0.1357 -0.1357 -0.1127 -0.1127 0.7048 0.7048 0.8370 0.8370 1.3066 1.3066 1.5766 1.5766 1.6614 1.6614 1.8149 1.8149 2.2291 2.2291 2.6747 2.6747 2.7109 2.7109 2.8310 2.8310 3.1372 3.1372 3.2327 3.2327 3.5555 3.5555 3.8184 3.8184 3.8748 3.8748 4.2243 4.2243 4.4732 4.4732 4.6028 4.6028 4.7192 4.7192 5.8154 5.8154 5.9194 5.9194 6.0335 6.0335 6.1375 6.1375 6.3654 6.3654 6.6097 6.6097 7.6135 7.6135 8.9932 8.9934 k = 0.3571 0.5361-0.0000 ( 6080 PWs) bands (ev): -14.3631 -14.3631 -14.3141 -14.3141 -12.9087 -12.9087 -12.8862 -12.8862 -11.1128 -11.1128 -10.9658 -10.9658 -10.7789 -10.7789 -10.7718 -10.7718 -6.5266 -6.5266 -6.5228 -6.5228 -2.9470 -2.9470 -2.9417 -2.9417 -2.2826 -2.2826 -2.2566 -2.2566 -2.2450 -2.2450 -1.9784 -1.9784 -1.8966 -1.8966 -1.3750 -1.3750 -1.2927 -1.2927 -1.1635 -1.1635 -0.2658 -0.2658 -0.1341 -0.1341 -0.1143 -0.1143 0.7352 0.7352 0.8343 0.8343 1.3102 1.3102 1.6003 1.6003 1.6689 1.6689 1.7907 1.7907 2.2164 2.2164 2.6871 2.6871 2.7235 2.7235 2.8164 2.8164 3.1493 3.1493 3.2124 3.2124 3.5534 3.5534 3.8295 3.8295 3.8696 3.8696 4.2027 4.2027 4.4549 4.4549 4.6154 4.6154 4.7038 4.7038 5.8522 5.8522 5.9216 5.9216 6.0610 6.0610 6.1540 6.1540 6.3106 6.3106 6.5807 6.5807 7.6151 7.6151 8.9987 8.9990 k = 0.3492 0.5499-0.0000 ( 6068 PWs) bands (ev): -14.3551 -14.3551 -14.3218 -14.3218 -12.9042 -12.9042 -12.8890 -12.8890 -11.1137 -11.1137 -10.9660 -10.9660 -10.7791 -10.7791 -10.7741 -10.7741 -6.5265 -6.5265 -6.5240 -6.5240 -2.9464 -2.9464 -2.9420 -2.9420 -2.2823 -2.2823 -2.2560 -2.2560 -2.2455 -2.2455 -1.9751 -1.9751 -1.8990 -1.8990 -1.3732 -1.3732 -1.2953 -1.2953 -1.1632 -1.1632 -0.2684 -0.2684 -0.1323 -0.1323 -0.1162 -0.1162 0.7621 0.7621 0.8281 0.8281 1.3129 1.3129 1.6225 1.6225 1.6729 1.6729 1.7706 1.7706 2.2066 2.2066 2.6969 2.6969 2.7373 2.7373 2.8010 2.8010 3.1593 3.1593 3.1964 3.1964 3.5511 3.5511 3.8394 3.8394 3.8666 3.8666 4.1850 4.1850 4.4403 4.4403 4.6289 4.6289 4.6884 4.6884 5.8831 5.8831 5.9223 5.9223 6.0918 6.0918 6.1654 6.1654 6.2583 6.2583 6.5583 6.5583 7.6164 7.6164 9.0045 9.0056 k = 0.3413 0.5636-0.0000 ( 6066 PWs) bands (ev): -14.3468 -14.3468 -14.3299 -14.3299 -12.8999 -12.8999 -12.8923 -12.8923 -11.1144 -11.1144 -10.9662 -10.9662 -10.7788 -10.7788 -10.7758 -10.7758 -6.5263 -6.5263 -6.5250 -6.5250 -2.9460 -2.9460 -2.9423 -2.9423 -2.2821 -2.2821 -2.2556 -2.2556 -2.2459 -2.2459 -1.9731 -1.9731 -1.9006 -1.9006 -1.3721 -1.3721 -1.2969 -1.2969 -1.1630 -1.1630 -0.2700 -0.2700 -0.1306 -0.1306 -0.1180 -0.1180 0.7848 0.7848 0.8184 0.8184 1.3146 1.3146 1.6417 1.6417 1.6713 1.6713 1.7570 1.7570 2.2002 2.2002 2.7035 2.7035 2.7523 2.7523 2.7848 2.7848 3.1660 3.1660 3.1858 3.1858 3.5491 3.5491 3.8462 3.8462 3.8655 3.8655 4.1732 4.1732 4.4307 4.4307 4.6431 4.6431 4.6732 4.6732 5.9059 5.9059 5.9212 5.9212 6.1253 6.1253 6.1697 6.1697 6.2120 6.2120 6.5442 6.5442 7.6172 7.6172 9.0097 9.0163 k = 0.3333 0.5774-0.0000 ( 6060 PWs) bands (ev): -14.3385 -14.3385 -14.3382 -14.3382 -12.8964 -12.8964 -12.8955 -12.8955 -11.1146 -11.1146 -10.9663 -10.9663 -10.7785 -10.7785 -10.7766 -10.7766 -6.5259 -6.5259 -6.5257 -6.5257 -2.9458 -2.9458 -2.9424 -2.9424 -2.2820 -2.2820 -2.2555 -2.2555 -2.2460 -2.2460 -1.9724 -1.9724 -1.9011 -1.9011 -1.3717 -1.3717 -1.2974 -1.2974 -1.1630 -1.1630 -0.2705 -0.2705 -0.1297 -0.1297 -0.1189 -0.1189 0.7989 0.7989 0.8087 0.8087 1.3152 1.3152 1.6530 1.6530 1.6662 1.6662 1.7523 1.7523 2.1979 2.1979 2.7059 2.7059 2.7668 2.7668 2.7697 2.7697 3.1678 3.1678 3.1826 3.1826 3.5483 3.5483 3.8484 3.8484 3.8656 3.8656 4.1690 4.1690 4.4272 4.4272 4.6562 4.6562 4.6598 4.6598 5.9173 5.9173 5.9181 5.9181 6.1513 6.1513 6.1650 6.1650 6.1868 6.1868 6.5395 6.5395 7.6175 7.6175 9.0137 9.0158 k = 0.3333 0.5774-0.0000 ( 6060 PWs) bands (ev): -14.3385 -14.3385 -14.3382 -14.3382 -12.8964 -12.8964 -12.8955 -12.8955 -11.1146 -11.1146 -10.9663 -10.9663 -10.7785 -10.7785 -10.7766 -10.7766 -6.5259 -6.5259 -6.5257 -6.5257 -2.9458 -2.9458 -2.9424 -2.9424 -2.2820 -2.2820 -2.2555 -2.2555 -2.2460 -2.2460 -1.9724 -1.9724 -1.9011 -1.9011 -1.3717 -1.3717 -1.2974 -1.2974 -1.1630 -1.1630 -0.2705 -0.2705 -0.1297 -0.1297 -0.1189 -0.1189 0.7989 0.7989 0.8087 0.8087 1.3152 1.3152 1.6530 1.6530 1.6662 1.6662 1.7523 1.7523 2.1979 2.1979 2.7059 2.7059 2.7668 2.7668 2.7697 2.7697 3.1678 3.1678 3.1826 3.1826 3.5483 3.5483 3.8484 3.8484 3.8656 3.8656 4.1690 4.1690 4.4272 4.4272 4.6562 4.6562 4.6598 4.6598 5.9173 5.9173 5.9181 5.9181 6.1513 6.1513 6.1650 6.1650 6.1868 6.1868 6.5395 6.5395 7.6175 7.6175 9.0135 9.0158 k = 0.3254 0.5636-0.0000 ( 6064 PWs) bands (ev): -14.3471 -14.3471 -14.3296 -14.3296 -12.9000 -12.9000 -12.8923 -12.8923 -11.1143 -11.1143 -10.9662 -10.9662 -10.7788 -10.7788 -10.7758 -10.7758 -6.5263 -6.5263 -6.5250 -6.5250 -2.9460 -2.9460 -2.9423 -2.9423 -2.2821 -2.2821 -2.2556 -2.2556 -2.2459 -2.2459 -1.9730 -1.9730 -1.9006 -1.9006 -1.3721 -1.3721 -1.2969 -1.2969 -1.1630 -1.1630 -0.2700 -0.2700 -0.1308 -0.1308 -0.1178 -0.1178 0.7856 0.7856 0.8175 0.8175 1.3145 1.3145 1.6405 1.6405 1.6729 1.6729 1.7564 1.7564 2.2003 2.2003 2.7030 2.7030 2.7523 2.7523 2.7851 2.7851 3.1681 3.1681 3.1838 3.1838 3.5493 3.5493 3.8466 3.8466 3.8647 3.8647 4.1735 4.1735 4.4310 4.4310 4.6430 4.6430 4.6734 4.6734 5.9109 5.9109 5.9148 5.9148 6.1337 6.1337 6.1631 6.1631 6.2123 6.2123 6.5438 6.5438 7.6172 7.6172 9.0099 9.0111 k = 0.3175 0.5499-0.0000 ( 6070 PWs) bands (ev): -14.3562 -14.3562 -14.3207 -14.3207 -12.9044 -12.9044 -12.8890 -12.8890 -11.1135 -11.1135 -10.9658 -10.9658 -10.7791 -10.7791 -10.7741 -10.7741 -6.5264 -6.5264 -6.5240 -6.5240 -2.9464 -2.9464 -2.9421 -2.9421 -2.2823 -2.2823 -2.2560 -2.2560 -2.2456 -2.2456 -1.9748 -1.9748 -1.8993 -1.8993 -1.3732 -1.3732 -1.2955 -1.2955 -1.1632 -1.1632 -0.2685 -0.2685 -0.1338 -0.1338 -0.1147 -0.1147 0.7652 0.7652 0.8243 0.8243 1.3121 1.3121 1.6181 1.6181 1.6789 1.6789 1.7673 1.7673 2.2075 2.2075 2.6936 2.6936 2.7380 2.7380 2.8024 2.8024 3.1708 3.1708 3.1858 3.1858 3.5526 3.5526 3.8419 3.8419 3.8609 3.8609 4.1868 4.1868 4.4426 4.4426 4.6285 4.6285 4.6891 4.6891 5.8951 5.8951 5.9002 5.9002 6.1215 6.1215 6.1546 6.1546 6.2532 6.2532 6.5556 6.5556 7.6160 7.6160 9.0055 9.0072 k = 0.3095 0.5361-0.0000 ( 6076 PWs) bands (ev): -14.3656 -14.3656 -14.3117 -14.3117 -12.9092 -12.9092 -12.8862 -12.8862 -11.1119 -11.1119 -10.9652 -10.9652 -10.7791 -10.7791 -10.7719 -10.7719 -6.5261 -6.5261 -6.5227 -6.5227 -2.9470 -2.9470 -2.9419 -2.9419 -2.2827 -2.2827 -2.2566 -2.2566 -2.2452 -2.2452 -1.9774 -1.9774 -1.8973 -1.8973 -1.3749 -1.3749 -1.2934 -1.2934 -1.1635 -1.1635 -0.2659 -0.2659 -0.1379 -0.1379 -0.1104 -0.1104 0.7416 0.7416 0.8255 0.8255 1.3078 1.3078 1.5911 1.5911 1.6797 1.6797 1.7838 1.7838 2.2193 2.2193 2.6775 2.6775 2.7257 2.7257 2.8201 2.8201 3.1737 3.1737 3.1911 3.1911 3.5582 3.5582 3.8352 3.8352 3.8542 3.8542 4.2080 4.2080 4.4623 4.4623 4.6143 4.6143 4.7054 4.7054 5.8629 5.8629 5.8841 5.8841 6.1200 6.1200 6.1470 6.1470 6.2965 6.2965 6.5729 6.5729 7.6139 7.6139 9.0008 9.0017 k = 0.3016 0.5224-0.0000 ( 6070 PWs) bands (ev): -14.3754 -14.3754 -14.3025 -14.3025 -12.9144 -12.9144 -12.8839 -12.8839 -11.1096 -11.1096 -10.9641 -10.9641 -10.7787 -10.7787 -10.7694 -10.7694 -6.5255 -6.5255 -6.5210 -6.5210 -2.9477 -2.9477 -2.9415 -2.9415 -2.2832 -2.2832 -2.2572 -2.2572 -2.2448 -2.2448 -1.9805 -1.9805 -1.8948 -1.8948 -1.3770 -1.3770 -1.2908 -1.2908 -1.1639 -1.1639 -0.2624 -0.2624 -0.1425 -0.1425 -0.1054 -0.1054 0.7153 0.7153 0.8211 0.8211 1.3012 1.3012 1.5605 1.5605 1.6747 1.6747 1.8051 1.8051 2.2351 2.2351 2.6559 2.6559 2.7142 2.7142 2.8380 2.8380 3.1732 3.1732 3.2038 3.2038 3.5661 3.5661 3.8273 3.8273 3.8455 3.8455 4.2359 4.2359 4.4898 4.4898 4.6007 4.6007 4.7225 4.7225 5.8234 5.8234 5.8630 5.8630 6.1234 6.1234 6.1446 6.1446 6.3404 6.3404 6.5938 6.5938 7.6106 7.6106 8.9972 8.9975 k = 0.2937 0.5086-0.0000 ( 6082 PWs) bands (ev): -14.3854 -14.3854 -14.2932 -14.2932 -12.9201 -12.9201 -12.8822 -12.8822 -11.1064 -11.1064 -10.9627 -10.9627 -10.7780 -10.7780 -10.7664 -10.7664 -6.5245 -6.5245 -6.5190 -6.5190 -2.9486 -2.9486 -2.9412 -2.9412 -2.2840 -2.2840 -2.2579 -2.2579 -2.2445 -2.2445 -1.9839 -1.9839 -1.8923 -1.8923 -1.3795 -1.3795 -1.2878 -1.2878 -1.1645 -1.1645 -0.2579 -0.2579 -0.1477 -0.1477 -0.0997 -0.0997 0.6867 0.6867 0.8114 0.8114 1.2921 1.2921 1.5267 1.5267 1.6643 1.6643 1.8306 1.8306 2.2537 2.2537 2.6303 2.6303 2.7029 2.7029 2.8554 2.8554 3.1708 3.1708 3.2229 3.2229 3.5758 3.5758 3.8191 3.8191 3.8360 3.8360 4.2689 4.2689 4.5241 4.5241 4.5883 4.5883 4.7404 4.7404 5.7811 5.7811 5.8372 5.8372 6.1258 6.1258 6.1507 6.1507 6.3843 6.3843 6.6171 6.6171 7.6060 7.6060 8.9946 8.9948 k = 0.2857 0.4949-0.0000 ( 6094 PWs) bands (ev): -14.3956 -14.3956 -14.2838 -14.2838 -12.9261 -12.9261 -12.8810 -12.8810 -11.1023 -11.1023 -10.9607 -10.9607 -10.7769 -10.7769 -10.7632 -10.7632 -6.5230 -6.5230 -6.5165 -6.5165 -2.9497 -2.9497 -2.9410 -2.9410 -2.2852 -2.2852 -2.2584 -2.2584 -2.2444 -2.2444 -1.9874 -1.9874 -1.8897 -1.8897 -1.3823 -1.3823 -1.2848 -1.2848 -1.1653 -1.1653 -0.2525 -0.2525 -0.1532 -0.1532 -0.0935 -0.0935 0.6562 0.6562 0.7970 0.7970 1.2803 1.2803 1.4897 1.4897 1.6489 1.6489 1.8594 1.8594 2.2740 2.2740 2.6014 2.6014 2.6914 2.6914 2.8720 2.8720 3.1684 3.1684 3.2469 3.2469 3.5866 3.5866 3.8119 3.8119 3.8269 3.8269 4.3057 4.3057 4.5592 4.5592 4.5824 4.5824 4.7595 4.7595 5.7386 5.7386 5.8079 5.8079 6.1280 6.1280 6.1628 6.1628 6.4276 6.4276 6.6416 6.6416 7.5999 7.5999 8.9930 8.9930 k = 0.2778 0.4811-0.0000 ( 6108 PWs) bands (ev): -14.4061 -14.4061 -14.2745 -14.2745 -12.9325 -12.9325 -12.8803 -12.8803 -11.0972 -11.0972 -10.9582 -10.9582 -10.7755 -10.7755 -10.7598 -10.7598 -6.5211 -6.5211 -6.5136 -6.5136 -2.9510 -2.9510 -2.9407 -2.9407 -2.2867 -2.2867 -2.2589 -2.2589 -2.2444 -2.2444 -1.9909 -1.9909 -1.8871 -1.8871 -1.3852 -1.3852 -1.2819 -1.2819 -1.1662 -1.1662 -0.2462 -0.2462 -0.1590 -0.1590 -0.0866 -0.0866 0.6240 0.6240 0.7786 0.7786 1.2655 1.2655 1.4500 1.4500 1.6293 1.6293 1.8907 1.8907 2.2946 2.2946 2.5696 2.5696 2.6801 2.6801 2.8868 2.8868 3.1673 3.1673 3.2747 3.2747 3.5978 3.5978 3.8063 3.8063 3.8199 3.8199 4.3449 4.3449 4.5594 4.5594 4.6179 4.6179 4.7801 4.7801 5.6975 5.6975 5.7763 5.7763 6.1320 6.1320 6.1774 6.1774 6.4700 6.4700 6.6667 6.6667 7.5919 7.5919 8.9926 8.9927 k = 0.2698 0.4674-0.0000 ( 6104 PWs) bands (ev): -14.4168 -14.4168 -14.2650 -14.2650 -12.9392 -12.9392 -12.8803 -12.8803 -11.0911 -11.0911 -10.9551 -10.9551 -10.7738 -10.7738 -10.7561 -10.7561 -6.5186 -6.5186 -6.5102 -6.5102 -2.9524 -2.9524 -2.9404 -2.9404 -2.2884 -2.2884 -2.2591 -2.2591 -2.2445 -2.2445 -1.9940 -1.9940 -1.8847 -1.8847 -1.3882 -1.3882 -1.2791 -1.2791 -1.1672 -1.1672 -0.2391 -0.2391 -0.1649 -0.1649 -0.0792 -0.0792 0.5905 0.5905 0.7568 0.7568 1.2476 1.2476 1.4079 1.4079 1.6062 1.6062 1.9232 1.9232 2.3143 2.3143 2.5354 2.5354 2.6691 2.6691 2.8990 2.8990 3.1686 3.1686 3.3059 3.3059 3.6089 3.6089 3.8020 3.8020 3.8176 3.8176 4.3855 4.3855 4.5497 4.5497 4.6693 4.6693 4.8025 4.8025 5.6586 5.6586 5.7437 5.7437 6.1382 6.1382 6.1932 6.1932 6.5113 6.5113 6.6919 6.6919 7.5819 7.5819 8.9937 8.9938 k = 0.2619 0.4536-0.0000 ( 6108 PWs) bands (ev): -14.4277 -14.4277 -14.2556 -14.2556 -12.9463 -12.9463 -12.8808 -12.8808 -11.0839 -11.0839 -10.9515 -10.9515 -10.7720 -10.7720 -10.7523 -10.7523 -6.5157 -6.5157 -6.5063 -6.5063 -2.9541 -2.9541 -2.9401 -2.9401 -2.2907 -2.2907 -2.2593 -2.2593 -2.2449 -2.2449 -1.9969 -1.9969 -1.8825 -1.8825 -1.3912 -1.3912 -1.2767 -1.2767 -1.1684 -1.1684 -0.2311 -0.2311 -0.1710 -0.1710 -0.0712 -0.0712 0.5560 0.5560 0.7324 0.7324 1.2263 1.2263 1.3637 1.3637 1.5804 1.5804 1.9560 1.9560 2.3319 2.3319 2.4989 2.4989 2.6590 2.6590 2.9080 2.9080 3.1726 3.1726 3.3397 3.3397 3.6199 3.6199 3.7987 3.7987 3.8220 3.8220 4.4264 4.4264 4.5405 4.5405 4.7255 4.7255 4.8271 4.8271 5.6225 5.6225 5.7110 5.7110 6.1462 6.1462 6.2096 6.2096 6.5512 6.5512 6.7168 6.7168 7.5697 7.5697 8.9965 8.9965 k = 0.2540 0.4399-0.0000 ( 6114 PWs) bands (ev): -14.4388 -14.4388 -14.2463 -14.2463 -12.9537 -12.9537 -12.8820 -12.8820 -11.0756 -11.0756 -10.9472 -10.9472 -10.7699 -10.7699 -10.7484 -10.7484 -6.5123 -6.5123 -6.5019 -6.5019 -2.9560 -2.9560 -2.9398 -2.9398 -2.2934 -2.2934 -2.2593 -2.2593 -2.2455 -2.2455 -1.9994 -1.9994 -1.8805 -1.8805 -1.3943 -1.3943 -1.2747 -1.2747 -1.1697 -1.1697 -0.2224 -0.2224 -0.1770 -0.1770 -0.0628 -0.0628 0.5206 0.5206 0.7057 0.7057 1.2014 1.2014 1.3178 1.3178 1.5527 1.5527 1.9877 1.9877 2.3467 2.3467 2.4604 2.4604 2.6499 2.6499 2.9131 2.9131 3.1788 3.1788 3.3757 3.3757 3.6316 3.6316 3.7971 3.7971 3.8333 3.8333 4.4667 4.4667 4.5326 4.5326 4.7853 4.7853 4.8542 4.8542 5.5897 5.5897 5.6790 5.6790 6.1559 6.1559 6.2265 6.2265 6.5896 6.5896 6.7411 6.7411 7.5550 7.5550 9.0009 9.0009 k = 0.2460 0.4261-0.0000 ( 6114 PWs) bands (ev): -14.4499 -14.4499 -14.2370 -14.2370 -12.9614 -12.9614 -12.8838 -12.8838 -11.0663 -11.0663 -10.9423 -10.9423 -10.7677 -10.7677 -10.7444 -10.7444 -6.5083 -6.5083 -6.4970 -6.4970 -2.9582 -2.9582 -2.9395 -2.9395 -2.2965 -2.2965 -2.2592 -2.2592 -2.2463 -2.2463 -2.0014 -2.0014 -1.8788 -1.8788 -1.3973 -1.3973 -1.2733 -1.2733 -1.1710 -1.1710 -0.2131 -0.2131 -0.1829 -0.1829 -0.0538 -0.0538 0.4846 0.4846 0.6775 0.6775 1.1727 1.1727 1.2705 1.2705 1.5240 1.5240 2.0175 2.0175 2.3580 2.3580 2.4203 2.4203 2.6424 2.6424 2.9146 2.9146 3.1861 3.1861 3.4134 3.4134 3.6453 3.6453 3.7984 3.7984 3.8506 3.8506 4.5051 4.5051 4.5271 4.5271 4.8477 4.8477 4.8842 4.8842 5.5605 5.5605 5.6484 5.6484 6.1670 6.1670 6.2436 6.2436 6.6263 6.6263 6.7647 6.7647 7.5377 7.5377 9.0073 9.0073 k = 0.2381 0.4124-0.0000 ( 6116 PWs) bands (ev): -14.4612 -14.4612 -14.2278 -14.2278 -12.9693 -12.9693 -12.8861 -12.8861 -11.0558 -11.0558 -10.9367 -10.9367 -10.7653 -10.7653 -10.7403 -10.7403 -6.5039 -6.5039 -6.4916 -6.4916 -2.9605 -2.9605 -2.9392 -2.9392 -2.3001 -2.3001 -2.2590 -2.2590 -2.2472 -2.2472 -2.0029 -2.0029 -1.8774 -1.8774 -1.4002 -1.4002 -1.2725 -1.2725 -1.1725 -1.1725 -0.2032 -0.2032 -0.1884 -0.1884 -0.0444 -0.0444 0.4482 0.4482 0.6480 0.6480 1.1401 1.1401 1.2223 1.2223 1.4949 1.4949 2.0441 2.0441 2.3651 2.3651 2.3789 2.3789 2.6365 2.6365 2.9127 2.9127 3.1929 3.1929 3.4524 3.4524 3.6629 3.6629 3.8033 3.8033 3.8729 3.8729 4.5208 4.5208 4.5445 4.5445 4.9105 4.9105 4.9185 4.9185 5.5350 5.5350 5.6197 5.6197 6.1794 6.1794 6.2609 6.2609 6.6612 6.6612 6.7873 6.7873 7.5176 7.5176 9.0156 9.0156 k = 0.2302 0.3986-0.0000 ( 6116 PWs) bands (ev): -14.4725 -14.4725 -14.2188 -14.2188 -12.9774 -12.9774 -12.8890 -12.8890 -11.0444 -11.0444 -10.9306 -10.9306 -10.7629 -10.7629 -10.7362 -10.7362 -6.4989 -6.4989 -6.4857 -6.4857 -2.9632 -2.9632 -2.9389 -2.9389 -2.3041 -2.3041 -2.2589 -2.2589 -2.2484 -2.2484 -2.0039 -2.0039 -1.8762 -1.8762 -1.4030 -1.4030 -1.2724 -1.2724 -1.1739 -1.1739 -0.1960 -0.1960 -0.1905 -0.1905 -0.0345 -0.0345 0.4115 0.4115 0.6177 0.6177 1.1035 1.1035 1.1736 1.1736 1.4659 1.4659 2.0670 2.0670 2.3352 2.3352 2.3692 2.3692 2.6327 2.6327 2.9081 2.9081 3.1978 3.1978 3.4921 3.4921 3.6854 3.6854 3.8126 3.8126 3.8992 3.8992 4.5200 4.5200 4.5788 4.5788 4.9516 4.9516 4.9786 4.9786 5.5136 5.5136 5.5930 5.5930 6.1930 6.1930 6.2784 6.2784 6.6943 6.6943 6.8089 6.8089 7.4947 7.4947 9.0260 9.0260 k = 0.2222 0.3849-0.0000 ( 6110 PWs) bands (ev): -14.4839 -14.4839 -14.2098 -14.2098 -12.9857 -12.9857 -12.8924 -12.8924 -11.0319 -11.0319 -10.9239 -10.9239 -10.7604 -10.7604 -10.7321 -10.7321 -6.4934 -6.4934 -6.4793 -6.4793 -2.9660 -2.9660 -2.9387 -2.9387 -2.3085 -2.3085 -2.2588 -2.2588 -2.2495 -2.2495 -2.0044 -2.0044 -1.8752 -1.8752 -1.4058 -1.4058 -1.2730 -1.2730 -1.1753 -1.1753 -0.1997 -0.1997 -0.1809 -0.1809 -0.0243 -0.0243 0.3746 0.3746 0.5870 0.5870 1.0630 1.0630 1.1245 1.1245 1.4374 1.4374 2.0855 2.0855 2.2912 2.2912 2.3687 2.3687 2.6309 2.6309 2.9013 2.9013 3.1996 3.1996 3.5320 3.5320 3.7135 3.7135 3.8269 3.8269 3.9283 3.9283 4.5220 4.5220 4.6111 4.6111 4.9896 4.9896 5.0446 5.0446 5.4963 5.4963 5.5688 5.5688 6.2078 6.2078 6.2961 6.2961 6.7254 6.7254 6.8294 6.8294 7.4689 7.4689 9.0384 9.0384 k = 0.2143 0.3712-0.0000 ( 6116 PWs) bands (ev): -14.4952 -14.4952 -14.2011 -14.2011 -12.9941 -12.9941 -12.8963 -12.8963 -11.0185 -11.0185 -10.9166 -10.9166 -10.7579 -10.7579 -10.7280 -10.7280 -6.4875 -6.4875 -6.4724 -6.4724 -2.9691 -2.9691 -2.9385 -2.9385 -2.3134 -2.3134 -2.2589 -2.2589 -2.2508 -2.2508 -2.0043 -2.0043 -1.8744 -1.8744 -1.4084 -1.4084 -1.2745 -1.2745 -1.1767 -1.1767 -0.2040 -0.2040 -0.1697 -0.1697 -0.0137 -0.0137 0.3377 0.3377 0.5560 0.5560 1.0189 1.0189 1.0755 1.0755 1.4097 1.4097 2.0994 2.0994 2.2463 2.2463 2.3644 2.3644 2.6309 2.6309 2.8927 2.8927 3.1982 3.1982 3.5715 3.5715 3.7466 3.7466 3.8468 3.8468 3.9596 3.9596 4.5280 4.5280 4.6412 4.6412 5.0290 5.0290 5.1108 5.1108 5.4834 5.4834 5.5470 5.5470 6.2240 6.2240 6.3138 6.3138 6.7544 6.7544 6.8486 6.8486 7.4403 7.4403 9.0527 9.0527 k = 0.2063 0.3574-0.0000 ( 6120 PWs) bands (ev): -14.5066 -14.5066 -14.1926 -14.1926 -13.0027 -13.0027 -12.9006 -12.9006 -11.0042 -11.0042 -10.9088 -10.9088 -10.7554 -10.7554 -10.7239 -10.7239 -6.4810 -6.4810 -6.4650 -6.4650 -2.9725 -2.9725 -2.9383 -2.9383 -2.3188 -2.3188 -2.2593 -2.2593 -2.2520 -2.2520 -2.0037 -2.0037 -1.8739 -1.8739 -1.4108 -1.4108 -1.2767 -1.2767 -1.1780 -1.1780 -0.2079 -0.2079 -0.1582 -0.1582 -0.0029 -0.0029 0.3009 0.3009 0.5251 0.5251 0.9717 0.9717 1.0266 1.0266 1.3829 1.3829 2.1087 2.1087 2.2010 2.2010 2.3566 2.3566 2.6325 2.6325 2.8827 2.8827 3.1938 3.1938 3.6097 3.6097 3.7835 3.7835 3.8729 3.8729 3.9921 3.9921 4.5387 4.5387 4.6693 4.6693 5.0688 5.0688 5.1762 5.1762 5.4753 5.4753 5.5279 5.5279 6.2416 6.2416 6.3317 6.3317 6.7813 6.7813 6.8667 6.8667 7.4091 7.4091 9.0689 9.0689 k = 0.1984 0.3437-0.0000 ( 6120 PWs) bands (ev): -14.5178 -14.5178 -14.1843 -14.1843 -13.0112 -13.0112 -12.9054 -12.9054 -10.9891 -10.9891 -10.9006 -10.9006 -10.7529 -10.7529 -10.7199 -10.7199 -6.4742 -6.4742 -6.4571 -6.4571 -2.9761 -2.9761 -2.9382 -2.9382 -2.3246 -2.3246 -2.2600 -2.2600 -2.2529 -2.2529 -2.0026 -2.0026 -1.8736 -1.8736 -1.4131 -1.4131 -1.2797 -1.2797 -1.1792 -1.1792 -0.2111 -0.2111 -0.1465 -0.1465 0.0082 0.0082 0.2643 0.2643 0.4946 0.4946 0.9218 0.9218 0.9779 0.9779 1.3567 1.3567 2.1131 2.1131 2.1563 2.1563 2.3456 2.3456 2.6350 2.6350 2.8715 2.8715 3.1870 3.1870 3.6462 3.6462 3.8227 3.8227 3.9057 3.9057 4.0254 4.0254 4.5551 4.5551 4.6957 4.6957 5.1080 5.1080 5.2403 5.2403 5.4723 5.4723 5.5116 5.5116 6.2608 6.2608 6.3496 6.3496 6.8060 6.8060 6.8834 6.8834 7.3753 7.3753 9.0868 9.0868 k = 0.1905 0.3299-0.0000 ( 6116 PWs) bands (ev): -14.5290 -14.5290 -14.1762 -14.1762 -13.0198 -13.0198 -12.9105 -12.9105 -10.9733 -10.9733 -10.8919 -10.8919 -10.7505 -10.7505 -10.7160 -10.7160 -6.4669 -6.4669 -6.4489 -6.4489 -2.9799 -2.9799 -2.9381 -2.9381 -2.3308 -2.3308 -2.2612 -2.2612 -2.2536 -2.2536 -2.0010 -2.0010 -1.8734 -1.8734 -1.4151 -1.4151 -1.2835 -1.2835 -1.1802 -1.1802 -0.2135 -0.2135 -0.1349 -0.1349 0.0194 0.0194 0.2279 0.2279 0.4646 0.4646 0.8699 0.8699 0.9297 0.9297 1.3311 1.3311 2.1016 2.1016 2.1241 2.1241 2.3320 2.3320 2.6380 2.6380 2.8593 2.8593 3.1784 3.1784 3.6805 3.6805 3.8622 3.8622 3.9449 3.9449 4.0591 4.0591 4.5778 4.5778 4.7208 4.7208 5.1452 5.1452 5.3021 5.3021 5.4746 5.4746 5.4982 5.4982 6.2817 6.2817 6.3677 6.3677 6.8283 6.8283 6.8988 6.8988 7.3395 7.3395 9.1062 9.1063 k = 0.1825 0.3162-0.0000 ( 6116 PWs) bands (ev): -14.5400 -14.5400 -14.1684 -14.1684 -13.0283 -13.0283 -12.9158 -12.9158 -10.9569 -10.9569 -10.8828 -10.8828 -10.7481 -10.7481 -10.7122 -10.7122 -6.4592 -6.4592 -6.4402 -6.4402 -2.9839 -2.9839 -2.9381 -2.9381 -2.3375 -2.3375 -2.2628 -2.2628 -2.2542 -2.2542 -1.9989 -1.9989 -1.8733 -1.8733 -1.4169 -1.4169 -1.2879 -1.2879 -1.1810 -1.1810 -0.2152 -0.2152 -0.1235 -0.1235 0.0307 0.0307 0.1920 0.1920 0.4354 0.4354 0.8165 0.8165 0.8819 0.8819 1.3058 1.3058 2.0601 2.0601 2.1195 2.1195 2.3161 2.3161 2.6409 2.6409 2.8461 2.8461 3.1688 3.1688 3.7126 3.7126 3.9004 3.9004 3.9900 3.9900 4.0930 4.0930 4.6074 4.6074 4.7451 4.7451 5.1791 5.1791 5.3609 5.3609 5.4811 5.4811 5.4896 5.4896 6.3048 6.3048 6.3857 6.3857 6.8482 6.8482 6.9129 6.9129 7.3018 7.3018 9.1268 9.1270 k = 0.1746 0.3024-0.0000 ( 6108 PWs) bands (ev): -14.5508 -14.5508 -14.1609 -14.1609 -13.0367 -13.0367 -12.9215 -12.9215 -10.9399 -10.9399 -10.8735 -10.8735 -10.7457 -10.7457 -10.7085 -10.7085 -6.4511 -6.4511 -6.4312 -6.4312 -2.9881 -2.9881 -2.9381 -2.9381 -2.3444 -2.3444 -2.2646 -2.2646 -2.2547 -2.2547 -1.9965 -1.9965 -1.8733 -1.8733 -1.4184 -1.4184 -1.2929 -1.2929 -1.1816 -1.1816 -0.2161 -0.2161 -0.1124 -0.1124 0.0418 0.0418 0.1566 0.1566 0.4074 0.4074 0.7623 0.7623 0.8346 0.8346 1.2805 1.2805 2.0157 2.0157 2.1167 2.1167 2.2987 2.2987 2.6431 2.6431 2.8319 2.8319 3.1585 3.1585 3.7427 3.7427 3.9358 3.9358 4.0401 4.0401 4.1274 4.1274 4.6439 4.6439 4.7690 4.7690 5.2090 5.2090 5.4146 5.4146 5.4795 5.4795 5.4995 5.4995 6.3301 6.3301 6.4037 6.4037 6.8655 6.8655 6.9256 6.9256 7.2631 7.2631 9.1475 9.1480 k = 0.1667 0.2887-0.0000 ( 6105 PWs) bands (ev): -14.5615 -14.5615 -14.1537 -14.1537 -13.0450 -13.0450 -12.9273 -12.9273 -10.9226 -10.9226 -10.8639 -10.8639 -10.7435 -10.7435 -10.7049 -10.7049 -6.4428 -6.4428 -6.4220 -6.4220 -2.9924 -2.9924 -2.9382 -2.9382 -2.3517 -2.3517 -2.2665 -2.2665 -2.2553 -2.2553 -1.9936 -1.9936 -1.8735 -1.8735 -1.4196 -1.4196 -1.2984 -1.2984 -1.1821 -1.1821 -0.2163 -0.2163 -0.1018 -0.1018 0.0527 0.0527 0.1220 0.1220 0.3807 0.3807 0.7078 0.7078 0.7879 0.7879 1.2548 1.2548 1.9718 1.9718 2.1132 2.1132 2.2804 2.2804 2.6442 2.6442 2.8167 2.8167 3.1481 3.1481 3.7712 3.7712 3.9669 3.9669 4.0940 4.0940 4.1627 4.1627 4.6872 4.6872 4.7929 4.7929 5.2345 5.2345 5.4522 5.4522 5.4881 5.4881 5.5195 5.5195 6.3579 6.3579 6.4216 6.4216 6.8798 6.8798 6.9370 6.9370 7.2239 7.2239 9.1246 9.1699 k = 0.1587 0.2749-0.0000 ( 6107 PWs) bands (ev): -14.5719 -14.5719 -14.1468 -14.1468 -13.0531 -13.0531 -12.9332 -12.9332 -10.9050 -10.9050 -10.8541 -10.8541 -10.7413 -10.7413 -10.7014 -10.7014 -6.4342 -6.4342 -6.4125 -6.4125 -2.9969 -2.9969 -2.9384 -2.9384 -2.3593 -2.3593 -2.2686 -2.2686 -2.2559 -2.2559 -1.9905 -1.9905 -1.8737 -1.8737 -1.4205 -1.4205 -1.3044 -1.3044 -1.1824 -1.1824 -0.2159 -0.2159 -0.0918 -0.0918 0.0626 0.0626 0.0889 0.0889 0.3556 0.3556 0.6534 0.6534 0.7418 0.7418 1.2286 1.2286 1.9291 1.9291 2.1092 2.1092 2.2616 2.2616 2.6439 2.6439 2.8007 2.8007 3.1377 3.1377 3.7983 3.7983 3.9932 3.9932 4.1507 4.1507 4.1992 4.1992 4.7363 4.7363 4.8173 4.8173 5.2560 5.2560 5.4583 5.4583 5.5257 5.5257 5.5444 5.5444 6.3882 6.3882 6.4391 6.4391 6.8908 6.8908 6.9470 6.9470 7.1854 7.1854 9.1281 9.1873 k = 0.1508 0.2612-0.0000 ( 6113 PWs) bands (ev): -14.5820 -14.5820 -14.1402 -14.1402 -13.0610 -13.0610 -12.9392 -12.9392 -10.8872 -10.8872 -10.8442 -10.8442 -10.7392 -10.7392 -10.6981 -10.6981 -6.4255 -6.4255 -6.4029 -6.4029 -3.0016 -3.0016 -2.9387 -2.9387 -2.3672 -2.3672 -2.2708 -2.2708 -2.2567 -2.2567 -1.9871 -1.9871 -1.8739 -1.8739 -1.4211 -1.4211 -1.3105 -1.3105 -1.1825 -1.1825 -0.2151 -0.2151 -0.0825 -0.0825 0.0538 0.0538 0.0751 0.0751 0.3325 0.3325 0.5997 0.5997 0.6962 0.6962 1.2016 1.2016 1.8880 1.8880 2.1053 2.1053 2.2432 2.2432 2.6421 2.6421 2.7836 2.7836 3.1276 3.1276 3.8242 3.8242 4.0145 4.0145 4.2086 4.2086 4.2372 4.2372 4.7904 4.7904 4.8426 4.8426 5.2743 5.2743 5.4581 5.4581 5.5669 5.5669 5.5726 5.5726 6.4209 6.4209 6.4562 6.4562 6.8977 6.8977 6.9556 6.9556 7.1489 7.1489 9.1299 9.1520 k = 0.1429 0.2474-0.0000 ( 6101 PWs) bands (ev): -14.5918 -14.5918 -14.1339 -14.1339 -13.0687 -13.0687 -12.9453 -12.9453 -10.8693 -10.8693 -10.8343 -10.8343 -10.7373 -10.7373 -10.6949 -10.6949 -6.4166 -6.4166 -6.3931 -6.3931 -3.0062 -3.0062 -2.9391 -2.9391 -2.3752 -2.3752 -2.2729 -2.2729 -2.2576 -2.2576 -1.9836 -1.9836 -1.8741 -1.8741 -1.4213 -1.4213 -1.3167 -1.3167 -1.1823 -1.1823 -0.2145 -0.2145 -0.0742 -0.0742 0.0238 0.0238 0.0833 0.0833 0.3118 0.3118 0.5471 0.5471 0.6512 0.6512 1.1734 1.1734 1.8488 1.8488 2.1020 2.1020 2.2257 2.2257 2.6386 2.6386 2.7656 2.7656 3.1178 3.1178 3.8492 3.8492 4.0313 4.0313 4.2655 4.2655 4.2775 4.2775 4.8474 4.8474 4.8702 4.8702 5.2905 5.2905 5.4587 5.4587 5.6017 5.6017 5.6052 5.6052 6.4541 6.4541 6.4742 6.4742 6.8996 6.8996 6.9629 6.9629 7.1163 7.1163 9.1335 9.1787 k = 0.1349 0.2337-0.0000 ( 6093 PWs) bands (ev): -14.6013 -14.6013 -14.1280 -14.1280 -13.0761 -13.0761 -12.9513 -12.9513 -10.8515 -10.8515 -10.8244 -10.8244 -10.7354 -10.7354 -10.6919 -10.6919 -6.4076 -6.4076 -6.3834 -6.3834 -3.0110 -3.0110 -2.9394 -2.9394 -2.3833 -2.3833 -2.2751 -2.2751 -2.2587 -2.2587 -1.9799 -1.9799 -1.8742 -1.8742 -1.4212 -1.4212 -1.3228 -1.3228 -1.1819 -1.1819 -0.2149 -0.2149 -0.0669 -0.0669 -0.0043 -0.0043 0.0912 0.0912 0.2938 0.2938 0.4961 0.4961 0.6068 0.6068 1.1441 1.1441 1.8119 1.8119 2.0995 2.0995 2.2095 2.2095 2.6333 2.6333 2.7466 2.7466 3.1086 3.1086 3.8732 3.8732 4.0445 4.0445 4.3121 4.3121 4.3278 4.3278 4.8938 4.8938 4.9129 4.9129 5.3054 5.3054 5.4609 5.4609 5.6319 5.6319 5.6379 5.6379 6.4776 6.4776 6.5022 6.5022 6.8958 6.8958 6.9688 6.9688 7.0895 7.0895 9.1369 9.1369 k = 0.1270 0.2199-0.0000 ( 6081 PWs) bands (ev): -14.6105 -14.6105 -14.1225 -14.1225 -13.0832 -13.0832 -12.9573 -12.9573 -10.8340 -10.8340 -10.8146 -10.8146 -10.7337 -10.7337 -10.6891 -10.6891 -6.3986 -6.3986 -6.3736 -6.3736 -3.0157 -3.0157 -2.9399 -2.9399 -2.3914 -2.3914 -2.2772 -2.2772 -2.2599 -2.2599 -1.9761 -1.9761 -1.8743 -1.8743 -1.4209 -1.4209 -1.3287 -1.3287 -1.1813 -1.1813 -0.2173 -0.2173 -0.0609 -0.0609 -0.0285 -0.0285 0.0978 0.0978 0.2788 0.2788 0.4470 0.4470 0.5631 0.5631 1.1134 1.1134 1.7773 1.7773 2.0981 2.0981 2.1953 2.1953 2.6263 2.6263 2.7266 2.7266 3.0999 3.0999 3.8963 3.8963 4.0547 4.0547 4.3521 4.3521 4.3826 4.3826 4.9261 4.9261 4.9736 4.9736 5.3198 5.3198 5.4649 5.4649 5.6609 5.6609 5.6662 5.6662 6.4891 6.4891 6.5409 6.5409 6.8863 6.8863 6.9734 6.9734 7.0699 7.0699 9.1427 9.1666 k = 0.1190 0.2062-0.0000 ( 6095 PWs) bands (ev): -14.6192 -14.6192 -14.1173 -14.1173 -13.0899 -13.0899 -12.9631 -12.9631 -10.8167 -10.8167 -10.8050 -10.8050 -10.7321 -10.7321 -10.6864 -10.6864 -6.3897 -6.3897 -6.3640 -6.3640 -3.0205 -3.0205 -2.9405 -2.9405 -2.3996 -2.3996 -2.2795 -2.2795 -2.2613 -2.2613 -1.9725 -1.9725 -1.8743 -1.8743 -1.4204 -1.4204 -1.3341 -1.3341 -1.1805 -1.1805 -0.2234 -0.2234 -0.0581 -0.0581 -0.0454 -0.0454 0.1027 0.1027 0.2671 0.2671 0.4003 0.4003 0.5200 0.5200 1.0813 1.0813 1.7453 1.7453 2.0983 2.0983 2.1833 2.1833 2.6175 2.6175 2.7058 2.7058 3.0917 3.0917 3.9183 3.9183 4.0628 4.0628 4.3909 4.3909 4.4349 4.4349 4.9601 4.9601 5.0360 5.0360 5.3341 5.3341 5.4707 5.4707 5.6870 5.6870 5.6911 5.6911 6.4942 6.4942 6.5829 6.5829 6.8732 6.8732 6.9768 6.9768 7.0572 7.0572 9.1430 9.1551 k = 0.1111 0.1925-0.0000 ( 6097 PWs) bands (ev): -14.6275 -14.6275 -14.1125 -14.1125 -13.0963 -13.0963 -12.9688 -12.9688 -10.8001 -10.8001 -10.7955 -10.7955 -10.7306 -10.7306 -10.6839 -10.6839 -6.3808 -6.3808 -6.3546 -6.3546 -3.0253 -3.0253 -2.9412 -2.9412 -2.4077 -2.4077 -2.2816 -2.2816 -2.2628 -2.2628 -1.9690 -1.9690 -1.8742 -1.8742 -1.4198 -1.4198 -1.3390 -1.3390 -1.1795 -1.1795 -0.2348 -0.2348 -0.0638 -0.0638 -0.0479 -0.0479 0.1059 0.1059 0.2588 0.2588 0.3562 0.3562 0.4777 0.4777 1.0479 1.0479 1.7160 1.7160 2.1000 2.1000 2.1739 2.1739 2.6069 2.6069 2.6841 2.6841 3.0840 3.0840 3.9394 3.9394 4.0691 4.0691 4.4287 4.4287 4.4831 4.4831 4.9972 4.9972 5.0978 5.0978 5.3486 5.3486 5.4784 5.4784 5.7072 5.7072 5.7153 5.7153 6.4924 6.4924 6.6263 6.6263 6.8599 6.8599 6.9789 6.9789 7.0499 7.0499 9.1457 9.1472 k = 0.1032 0.1787-0.0000 ( 6097 PWs) bands (ev): -14.6354 -14.6354 -14.1080 -14.1080 -13.1024 -13.1024 -12.9743 -12.9743 -10.7868 -10.7868 -10.7834 -10.7834 -10.7292 -10.7292 -10.6815 -10.6815 -6.3722 -6.3722 -6.3454 -6.3454 -3.0299 -3.0299 -2.9419 -2.9419 -2.4155 -2.4155 -2.2837 -2.2837 -2.2644 -2.2644 -1.9656 -1.9656 -1.8740 -1.8740 -1.4192 -1.4192 -1.3430 -1.3430 -1.1782 -1.1782 -0.2518 -0.2518 -0.0682 -0.0682 -0.0455 -0.0455 0.1075 0.1075 0.2537 0.2537 0.3151 0.3151 0.4363 0.4363 1.0132 1.0132 1.6893 1.6893 2.1036 2.1036 2.1673 2.1673 2.5947 2.5947 2.6617 2.6617 3.0769 3.0769 3.9594 3.9594 4.0743 4.0743 4.4652 4.4652 4.5265 4.5265 5.0379 5.0379 5.1579 5.1579 5.3636 5.3636 5.4881 5.4881 5.7226 5.7226 5.7378 5.7378 6.4825 6.4825 6.6702 6.6702 6.8498 6.8498 6.9800 6.9800 7.0460 7.0460 9.1482 9.1605 k = 0.0952 0.1650-0.0000 ( 6095 PWs) bands (ev): -14.6428 -14.6428 -14.1039 -14.1039 -13.1080 -13.1080 -12.9795 -12.9795 -10.7780 -10.7780 -10.7680 -10.7680 -10.7279 -10.7279 -10.6793 -10.6793 -6.3639 -6.3639 -6.3366 -6.3366 -3.0344 -3.0344 -2.9426 -2.9426 -2.4231 -2.4231 -2.2858 -2.2858 -2.2660 -2.2660 -1.9624 -1.9624 -1.8737 -1.8737 -1.4187 -1.4187 -1.3460 -1.3460 -1.1766 -1.1766 -0.2735 -0.2735 -0.0670 -0.0670 -0.0431 -0.0431 0.1077 0.1077 0.2507 0.2507 0.2777 0.2777 0.3960 0.3960 0.9776 0.9776 1.6653 1.6653 2.1090 2.1090 2.1636 2.1636 2.5808 2.5808 2.6385 2.6385 3.0704 3.0704 3.9782 3.9782 4.0785 4.0785 4.5003 4.5003 4.5647 4.5647 5.0821 5.0821 5.2151 5.2151 5.3791 5.3791 5.4998 5.4998 5.7344 5.7344 5.7577 5.7577 6.4642 6.4642 6.7140 6.7140 6.8452 6.8452 6.9801 6.9801 7.0440 7.0440 9.1504 9.1517 k = 0.0873 0.1512-0.0000 ( 6099 PWs) bands (ev): -14.6497 -14.6497 -14.1001 -14.1001 -13.1132 -13.1132 -12.9844 -12.9844 -10.7697 -10.7697 -10.7534 -10.7534 -10.7266 -10.7266 -10.6773 -10.6773 -6.3559 -6.3559 -6.3281 -6.3281 -3.0388 -3.0388 -2.9433 -2.9433 -2.4304 -2.4304 -2.2879 -2.2879 -2.2676 -2.2676 -1.9595 -1.9595 -1.8732 -1.8732 -1.4186 -1.4186 -1.3479 -1.3479 -1.1748 -1.1748 -0.2984 -0.2984 -0.0617 -0.0617 -0.0408 -0.0408 0.1069 0.1069 0.2386 0.2386 0.2549 0.2549 0.3571 0.3571 0.9412 0.9412 1.6439 1.6439 2.1163 2.1163 2.1629 2.1629 2.5654 2.5654 2.6149 2.6149 3.0643 3.0643 3.9959 3.9959 4.0820 4.0820 4.5336 4.5336 4.5974 4.5974 5.1293 5.1293 5.2683 5.2683 5.3951 5.3951 5.5136 5.5136 5.7434 5.7434 5.7748 5.7748 6.4382 6.4382 6.7568 6.7568 6.8462 6.8462 6.9793 6.9793 7.0430 7.0430 9.1536 9.1570 k = 0.0794 0.1375-0.0000 ( 6097 PWs) bands (ev): -14.6561 -14.6561 -14.0967 -14.0967 -13.1180 -13.1180 -12.9890 -12.9890 -10.7619 -10.7619 -10.7399 -10.7399 -10.7251 -10.7251 -10.6755 -10.6755 -6.3483 -6.3483 -6.3202 -6.3202 -3.0429 -3.0429 -2.9441 -2.9441 -2.4373 -2.4373 -2.2899 -2.2899 -2.2692 -2.2692 -1.9569 -1.9569 -1.8727 -1.8727 -1.4188 -1.4188 -1.3486 -1.3486 -1.1727 -1.1727 -0.3250 -0.3250 -0.0544 -0.0544 -0.0375 -0.0375 0.1056 0.1056 0.2094 0.2094 0.2541 0.2541 0.3200 0.3200 0.9044 0.9044 1.6249 1.6249 2.1255 2.1255 2.1650 2.1650 2.5484 2.5484 2.5908 2.5908 3.0588 3.0588 4.0122 4.0122 4.0850 4.0850 4.5648 4.5648 4.6251 4.6251 5.1787 5.1787 5.3166 5.3166 5.4118 5.4118 5.5295 5.5295 5.7502 5.7502 5.7889 5.7889 6.4061 6.4061 6.7981 6.7981 6.8521 6.8521 6.9778 6.9778 7.0424 7.0424 9.1586 9.1597 k = 0.0714 0.1237-0.0000 ( 6099 PWs) bands (ev): -14.6619 -14.6619 -14.0936 -14.0936 -13.1224 -13.1224 -12.9933 -12.9933 -10.7546 -10.7546 -10.7292 -10.7292 -10.7220 -10.7220 -10.6739 -10.6739 -6.3412 -6.3412 -6.3127 -6.3127 -3.0468 -3.0468 -2.9448 -2.9448 -2.4438 -2.4438 -2.2918 -2.2918 -2.2707 -2.2707 -1.9546 -1.9546 -1.8720 -1.8720 -1.4194 -1.4194 -1.3482 -1.3482 -1.1704 -1.1704 -0.3520 -0.3520 -0.0482 -0.0482 -0.0312 -0.0312 0.1038 0.1038 0.1824 0.1824 0.2546 0.2546 0.2862 0.2862 0.8678 0.8678 1.6084 1.6084 2.1365 2.1365 2.1700 2.1700 2.5301 2.5301 2.5666 2.5666 3.0538 3.0538 4.0272 4.0272 4.0876 4.0876 4.5938 4.5938 4.6482 4.6482 5.2292 5.2292 5.3590 5.3590 5.4292 5.4292 5.5473 5.5473 5.7556 5.7556 5.8002 5.8002 6.3697 6.3697 6.8372 6.8372 6.8613 6.8613 6.9758 6.9758 7.0419 7.0419 9.1563 9.1580 k = 0.0635 0.1100-0.0000 ( 6123 PWs) bands (ev): -14.6672 -14.6672 -14.0909 -14.0909 -13.1263 -13.1263 -12.9972 -12.9972 -10.7480 -10.7480 -10.7255 -10.7255 -10.7131 -10.7131 -10.6724 -10.6724 -6.3347 -6.3347 -6.3059 -6.3059 -3.0505 -3.0505 -2.9456 -2.9456 -2.4498 -2.4498 -2.2937 -2.2937 -2.2722 -2.2722 -1.9527 -1.9527 -1.8714 -1.8714 -1.4205 -1.4205 -1.3469 -1.3469 -1.1680 -1.1680 -0.3785 -0.3785 -0.0444 -0.0444 -0.0215 -0.0215 0.1014 0.1014 0.1595 0.1595 0.2435 0.2435 0.2669 0.2669 0.8317 0.8317 1.5941 1.5941 2.1492 2.1492 2.1776 2.1776 2.5104 2.5104 2.5423 2.5423 3.0494 3.0494 4.0407 4.0407 4.0899 4.0899 4.6204 4.6204 4.6672 4.6672 5.2794 5.2794 5.3954 5.3954 5.4475 5.4475 5.5659 5.5659 5.7606 5.7606 5.8089 5.8089 6.3306 6.3306 6.8712 6.8712 6.8745 6.8745 6.9736 6.9736 7.0416 7.0416 9.1572 9.1604 k = 0.0556 0.0962-0.0000 ( 6107 PWs) bands (ev): -14.6719 -14.6719 -14.0885 -14.0885 -13.1298 -13.1298 -13.0007 -13.0007 -10.7421 -10.7421 -10.7243 -10.7243 -10.7030 -10.7030 -10.6711 -10.6711 -6.3288 -6.3288 -6.2997 -6.2997 -3.0537 -3.0537 -2.9463 -2.9463 -2.4551 -2.4551 -2.2953 -2.2953 -2.2734 -2.2734 -1.9509 -1.9509 -1.8706 -1.8706 -1.4216 -1.4216 -1.3447 -1.3447 -1.1653 -1.1653 -0.4038 -0.4038 -0.0414 -0.0414 -0.0105 -0.0105 0.0980 0.0980 0.1415 0.1415 0.2162 0.2162 0.2667 0.2667 0.7968 0.7968 1.5818 1.5818 2.1634 2.1634 2.1877 2.1877 2.4897 2.4897 2.5182 2.5182 3.0454 3.0454 4.0527 4.0527 4.0921 4.0921 4.6443 4.6443 4.6828 4.6828 5.3275 5.3275 5.4259 5.4259 5.4670 5.4670 5.5839 5.5839 5.7659 5.7659 5.8152 5.8152 6.2905 6.2905 6.8837 6.8837 6.9062 6.9062 6.9716 6.9716 7.0414 7.0414 9.1584 9.1595 k = 0.0476 0.0825-0.0000 ( 6109 PWs) bands (ev): -14.6760 -14.6760 -14.0865 -14.0865 -13.1328 -13.1328 -13.0037 -13.0037 -10.7368 -10.7368 -10.7235 -10.7235 -10.6938 -10.6938 -10.6699 -10.6699 -6.3235 -6.3235 -6.2943 -6.2943 -3.0567 -3.0567 -2.9469 -2.9469 -2.4599 -2.4599 -2.2968 -2.2968 -2.2746 -2.2746 -1.9494 -1.9494 -1.8699 -1.8699 -1.4229 -1.4229 -1.3422 -1.3422 -1.1626 -1.1626 -0.4273 -0.4273 -0.0380 -0.0380 -0.0006 -0.0006 0.0928 0.0928 0.1291 0.1291 0.1896 0.1896 0.2693 0.2693 0.7637 0.7637 1.5715 1.5715 2.1789 2.1789 2.2000 2.2000 2.4680 2.4680 2.4944 2.4944 3.0420 3.0420 4.0630 4.0630 4.0941 4.0941 4.6654 4.6654 4.6953 4.6953 5.3715 5.3715 5.4514 5.4514 5.4885 5.4885 5.5993 5.5993 5.7724 5.7724 5.8194 5.8194 6.2504 6.2504 6.8947 6.8947 6.9344 6.9344 6.9703 6.9703 7.0415 7.0415 9.1594 9.1643 k = 0.0397 0.0687-0.0000 ( 6109 PWs) bands (ev): -14.6794 -14.6794 -14.0847 -14.0847 -13.1354 -13.1354 -13.0064 -13.0064 -10.7323 -10.7323 -10.7229 -10.7229 -10.6859 -10.6859 -10.6690 -10.6690 -6.3189 -6.3189 -6.2896 -6.2896 -3.0592 -3.0592 -2.9475 -2.9475 -2.4640 -2.4640 -2.2982 -2.2982 -2.2756 -2.2756 -1.9483 -1.9483 -1.8692 -1.8692 -1.4242 -1.4242 -1.3395 -1.3395 -1.1599 -1.1599 -0.4483 -0.4483 -0.0337 -0.0337 0.0067 0.0067 0.0850 0.0850 0.1228 0.1228 0.1673 0.1673 0.2721 0.2721 0.7332 0.7332 1.5630 1.5630 2.1954 2.1954 2.2141 2.2141 2.4458 2.4458 2.4713 2.4713 3.0391 3.0391 4.0715 4.0715 4.0962 4.0962 4.6835 4.6835 4.7053 4.7053 5.4087 5.4087 5.4729 5.4729 5.5128 5.5128 5.6108 5.6108 5.7803 5.7803 5.8218 5.8218 6.2118 6.2118 6.9043 6.9043 6.9559 6.9559 6.9718 6.9718 7.0423 7.0423 9.1603 9.1643 k = 0.0317 0.0550-0.0000 ( 6113 PWs) bands (ev): -14.6823 -14.6823 -14.0833 -14.0833 -13.1375 -13.1375 -13.0085 -13.0085 -10.7285 -10.7285 -10.7225 -10.7225 -10.6793 -10.6793 -10.6681 -10.6681 -6.3152 -6.3152 -6.2857 -6.2857 -3.0613 -3.0613 -2.9480 -2.9480 -2.4674 -2.4674 -2.2994 -2.2994 -2.2765 -2.2765 -1.9474 -1.9474 -1.8686 -1.8686 -1.4254 -1.4254 -1.3368 -1.3368 -1.1575 -1.1575 -0.4663 -0.4663 -0.0281 -0.0281 0.0108 0.0108 0.0745 0.0745 0.1214 0.1214 0.1506 0.1506 0.2746 0.2746 0.7063 0.7063 1.5563 1.5563 2.2124 2.2124 2.2294 2.2294 2.4238 2.4238 2.4491 2.4491 3.0367 3.0367 4.0781 4.0781 4.0983 4.0983 4.6986 4.6986 4.7130 4.7130 5.4372 5.4372 5.4910 5.4910 5.5397 5.5397 5.6180 5.6180 5.7889 5.7889 5.8231 5.8231 6.1758 6.1758 6.9117 6.9117 6.9641 6.9641 6.9823 6.9823 7.0440 7.0440 9.1609 9.1609 k = 0.0238 0.0412-0.0000 ( 6117 PWs) bands (ev): -14.6846 -14.6846 -14.0822 -14.0822 -13.1391 -13.1391 -13.0102 -13.0102 -10.7256 -10.7256 -10.7221 -10.7221 -10.6742 -10.6742 -10.6674 -10.6674 -6.3122 -6.3122 -6.2826 -6.2826 -3.0630 -3.0630 -2.9484 -2.9484 -2.4701 -2.4701 -2.3003 -2.3003 -2.2771 -2.2771 -1.9468 -1.9468 -1.8681 -1.8681 -1.4263 -1.4263 -1.3346 -1.3346 -1.1554 -1.1554 -0.4809 -0.4809 -0.0211 -0.0211 0.0121 0.0121 0.0614 0.0614 0.1232 0.1232 0.1398 0.1398 0.2767 0.2767 0.6838 0.6838 1.5511 1.5511 2.2294 2.2294 2.2451 2.2451 2.4026 2.4026 2.4284 2.4284 3.0349 3.0349 4.0828 4.0828 4.1004 4.1004 4.7104 4.7104 4.7187 4.7187 5.4573 5.4573 5.5061 5.5061 5.5667 5.5667 5.6218 5.6218 5.7967 5.7967 5.8239 5.8239 6.1443 6.1443 6.9168 6.9168 6.9664 6.9664 6.9941 6.9941 7.0469 7.0469 9.1614 9.1648 k = 0.0159 0.0275-0.0000 ( 6109 PWs) bands (ev): -14.6862 -14.6862 -14.0815 -14.0815 -13.1403 -13.1403 -13.0114 -13.0114 -10.7235 -10.7235 -10.7218 -10.7218 -10.6708 -10.6708 -10.6666 -10.6666 -6.3100 -6.3100 -6.2804 -6.2804 -3.0642 -3.0642 -2.9486 -2.9486 -2.4720 -2.4720 -2.3010 -2.3010 -2.2775 -2.2775 -1.9462 -1.9462 -1.8677 -1.8677 -1.4270 -1.4270 -1.3327 -1.3327 -1.1538 -1.1538 -0.4916 -0.4916 -0.0130 -0.0130 0.0124 0.0124 0.0469 0.0469 0.1260 0.1260 0.1342 0.1342 0.2783 0.2783 0.6667 0.6667 1.5475 1.5475 2.2452 2.2452 2.2597 2.2597 2.3837 2.3837 2.4105 2.4105 3.0336 3.0336 4.0857 4.0857 4.1023 4.1023 4.7188 4.7188 4.7228 4.7228 5.4704 5.4704 5.5177 5.5177 5.5887 5.5887 5.6247 5.6247 5.8022 5.8022 5.8251 5.8251 6.1193 6.1193 6.9197 6.9197 6.9682 6.9682 7.0017 7.0017 7.0506 7.0506 9.1617 9.1659 k = 0.0079 0.0137-0.0000 ( 6107 PWs) bands (ev): -14.6871 -14.6871 -14.0810 -14.0810 -13.1410 -13.1410 -13.0122 -13.0122 -10.7224 -10.7224 -10.7216 -10.7216 -10.6691 -10.6691 -10.6658 -10.6658 -6.3087 -6.3087 -6.2791 -6.2791 -3.0649 -3.0649 -2.9488 -2.9488 -2.4731 -2.4731 -2.3014 -2.3014 -2.2778 -2.2778 -1.9460 -1.9460 -1.8675 -1.8675 -1.4275 -1.4275 -1.3316 -1.3316 -1.1527 -1.1527 -0.4981 -0.4981 -0.0052 -0.0052 0.0138 0.0138 0.0328 0.0328 0.1274 0.1274 0.1326 0.1326 0.2793 0.2793 0.6561 0.6561 1.5453 1.5453 2.2574 2.2574 2.2708 2.2708 2.3695 2.3695 2.3974 2.3974 3.0328 3.0328 4.0873 4.0873 4.1037 4.1037 4.7236 4.7236 4.7254 4.7254 5.4778 5.4778 5.5253 5.5253 5.6006 5.6006 5.6290 5.6290 5.8047 5.8047 5.8265 5.8265 6.1029 6.1029 6.9211 6.9211 6.9696 6.9696 7.0055 7.0055 7.0536 7.0536 9.1619 9.1637 k = 0.0000 0.0000 0.0000 ( 6097 PWs) bands (ev): -14.6875 -14.6875 -14.0808 -14.0808 -13.1412 -13.1412 -13.0124 -13.0124 -10.7221 -10.7221 -10.7214 -10.7214 -10.6686 -10.6686 -10.6654 -10.6654 -6.3083 -6.3083 -6.2786 -6.2786 -3.0651 -3.0651 -2.9488 -2.9488 -2.4735 -2.4735 -2.3015 -2.3015 -2.2779 -2.2779 -1.9459 -1.9459 -1.8673 -1.8673 -1.4276 -1.4276 -1.3312 -1.3312 -1.1523 -1.1523 -0.5003 -0.5003 -0.0017 -0.0017 0.0184 0.0184 0.0229 0.0229 0.1274 0.1274 0.1329 0.1329 0.2797 0.2797 0.6525 0.6525 1.5446 1.5446 2.2623 2.2623 2.2751 2.2751 2.3639 2.3639 2.3925 2.3925 3.0325 3.0325 4.0878 4.0878 4.1042 4.1042 4.7250 4.7250 4.7265 4.7265 5.4803 5.4803 5.5279 5.5279 5.6036 5.6036 5.6317 5.6317 5.8053 5.8053 5.8272 5.8272 6.0972 6.0972 6.9215 6.9215 6.9701 6.9701 7.0067 7.0067 7.0548 7.0548 9.1620 9.1620 k = 0.0000 0.0000 0.0000 ( 6097 PWs) bands (ev): -14.6875 -14.6875 -14.0808 -14.0808 -13.1412 -13.1412 -13.0124 -13.0124 -10.7221 -10.7221 -10.7214 -10.7214 -10.6686 -10.6686 -10.6654 -10.6654 -6.3083 -6.3083 -6.2786 -6.2786 -3.0651 -3.0651 -2.9488 -2.9488 -2.4735 -2.4735 -2.3015 -2.3015 -2.2779 -2.2779 -1.9459 -1.9459 -1.8673 -1.8673 -1.4276 -1.4276 -1.3312 -1.3312 -1.1523 -1.1523 -0.5003 -0.5003 -0.0017 -0.0017 0.0184 0.0184 0.0229 0.0229 0.1274 0.1274 0.1329 0.1329 0.2797 0.2797 0.6525 0.6525 1.5446 1.5446 2.2623 2.2623 2.2751 2.2751 2.3639 2.3639 2.3925 2.3925 3.0325 3.0325 4.0878 4.0878 4.1042 4.1042 4.7250 4.7250 4.7265 4.7265 5.4803 5.4803 5.5279 5.5279 5.6036 5.6036 5.6317 5.6317 5.8053 5.8053 5.8272 5.8272 6.0972 6.0972 6.9215 6.9215 6.9701 6.9701 7.0067 7.0067 7.0548 7.0548 9.1621 9.1622 k = 0.0000 0.0000 0.0156 ( 6097 PWs) bands (ev): -14.6874 -14.6874 -14.0809 -14.0809 -13.1422 -13.1422 -13.0115 -13.0115 -10.7221 -10.7221 -10.7213 -10.7213 -10.6686 -10.6686 -10.6654 -10.6654 -6.3082 -6.3082 -6.2786 -6.2786 -3.0650 -3.0650 -2.9488 -2.9488 -2.4733 -2.4733 -2.3015 -2.3015 -2.2777 -2.2777 -1.9462 -1.9462 -1.8674 -1.8674 -1.4279 -1.4279 -1.3312 -1.3312 -1.1524 -1.1524 -0.5034 -0.5034 -0.0039 -0.0039 0.0205 0.0205 0.0216 0.0216 0.1289 0.1289 0.1351 0.1351 0.2788 0.2788 0.6532 0.6532 1.5468 1.5468 2.2616 2.2616 2.2743 2.2743 2.3657 2.3657 2.3941 2.3941 3.0311 3.0311 4.0876 4.0876 4.1040 4.1040 4.7232 4.7232 4.7248 4.7248 5.4803 5.4803 5.5279 5.5279 5.6041 5.6041 5.6321 5.6321 5.8060 5.8060 5.8280 5.8280 6.0975 6.0975 6.9216 6.9216 6.9702 6.9702 7.0064 7.0064 7.0546 7.0546 9.1593 9.1593 k = 0.0000 0.0000 0.0313 ( 6097 PWs) bands (ev): -14.6872 -14.6872 -14.0809 -14.0809 -13.1450 -13.1450 -13.0087 -13.0087 -10.7220 -10.7220 -10.7213 -10.7213 -10.6687 -10.6687 -10.6655 -10.6655 -6.3081 -6.3081 -6.2785 -6.2785 -3.0650 -3.0650 -2.9486 -2.9486 -2.4729 -2.4729 -2.3012 -2.3012 -2.2771 -2.2771 -1.9470 -1.9470 -1.8677 -1.8677 -1.4285 -1.4285 -1.3313 -1.3313 -1.1529 -1.1529 -0.5121 -0.5121 -0.0092 -0.0092 0.0139 0.0139 0.0299 0.0299 0.1333 0.1333 0.1411 0.1411 0.2764 0.2764 0.6552 0.6552 1.5535 1.5535 2.2598 2.2598 2.2721 2.2721 2.3708 2.3708 2.3989 2.3989 3.0268 3.0268 4.0869 4.0869 4.1034 4.1034 4.7178 4.7178 4.7195 4.7195 5.4803 5.4803 5.5279 5.5279 5.6056 5.6056 5.6333 5.6333 5.8082 5.8082 5.8303 5.8303 6.0984 6.0984 6.9217 6.9217 6.9703 6.9703 7.0057 7.0057 7.0538 7.0538 9.1512 9.1513 k = 0.0000 0.0000 0.0469 ( 6085 PWs) bands (ev): -14.6870 -14.6870 -14.0810 -14.0810 -13.1494 -13.1494 -13.0045 -13.0045 -10.7219 -10.7219 -10.7211 -10.7211 -10.6688 -10.6688 -10.6656 -10.6656 -6.3078 -6.3078 -6.2783 -6.2783 -3.0648 -3.0648 -2.9482 -2.9482 -2.4721 -2.4721 -2.3008 -2.3008 -2.2761 -2.2761 -1.9484 -1.9484 -1.8680 -1.8680 -1.4296 -1.4296 -1.3313 -1.3313 -1.1535 -1.1535 -0.5259 -0.5259 -0.0166 -0.0166 0.0042 0.0042 0.0420 0.0420 0.1401 0.1401 0.1499 0.1499 0.2725 0.2725 0.6586 0.6586 1.5646 1.5646 2.2572 2.2572 2.2688 2.2688 2.3788 2.3788 2.4064 2.4064 3.0196 3.0196 4.0857 4.0857 4.1025 4.1025 4.7091 4.7091 4.7109 4.7109 5.4804 5.4804 5.5278 5.5278 5.6079 5.6079 5.6352 5.6352 5.8120 5.8120 5.8341 5.8341 6.1000 6.1000 6.9220 6.9220 6.9706 6.9706 7.0045 7.0045 7.0527 7.0527 9.1379 9.1380 k = 0.0000 0.0000 0.0625 ( 6079 PWs) bands (ev): -14.6866 -14.6866 -14.0812 -14.0812 -13.1551 -13.1551 -12.9990 -12.9990 -10.7217 -10.7217 -10.7210 -10.7210 -10.6690 -10.6690 -10.6658 -10.6658 -6.3075 -6.3075 -6.2780 -6.2780 -3.0647 -3.0647 -2.9478 -2.9478 -2.4711 -2.4711 -2.3003 -2.3003 -2.2747 -2.2747 -1.9505 -1.9505 -1.8684 -1.8684 -1.4313 -1.4313 -1.3313 -1.3313 -1.1545 -1.1545 -0.5436 -0.5436 -0.0254 -0.0254 -0.0074 -0.0074 0.0567 0.0567 0.1485 0.1485 0.1603 0.1603 0.2674 0.2674 0.6631 0.6631 1.5801 1.5801 2.2539 2.2539 2.2650 2.2650 2.3891 2.3891 2.4164 2.4164 3.0095 3.0095 4.0841 4.0841 4.1011 4.1011 4.6973 4.6973 4.6994 4.6994 5.4804 5.4804 5.5277 5.5277 5.6108 5.6108 5.6374 5.6374 5.8172 5.8172 5.8393 5.8393 6.1023 6.1023 6.9223 6.9223 6.9709 6.9709 7.0028 7.0028 7.0511 7.0511 9.1200 9.1200 k = 0.0000 0.0000 0.0781 ( 6079 PWs) bands (ev): -14.6861 -14.6861 -14.0813 -14.0813 -13.1616 -13.1616 -12.9927 -12.9927 -10.7215 -10.7215 -10.7208 -10.7208 -10.6692 -10.6692 -10.6660 -10.6660 -6.3070 -6.3070 -6.2777 -6.2777 -3.0644 -3.0644 -2.9473 -2.9473 -2.4698 -2.4698 -2.2996 -2.2996 -2.2730 -2.2730 -1.9532 -1.9532 -1.8690 -1.8690 -1.4333 -1.4333 -1.3314 -1.3314 -1.1556 -1.1556 -0.5643 -0.5643 -0.0352 -0.0352 -0.0201 -0.0201 0.0729 0.0729 0.1581 0.1581 0.1716 0.1716 0.2615 0.2615 0.6685 0.6685 1.6000 1.6000 2.2503 2.2503 2.2610 2.2610 2.4013 2.4013 2.4284 2.4284 2.9963 2.9963 4.0820 4.0820 4.0994 4.0994 4.6829 4.6829 4.6851 4.6851 5.4806 5.4806 5.5276 5.5276 5.6140 5.6140 5.6399 5.6399 5.8239 5.8239 5.8460 5.8460 6.1052 6.1052 6.9228 6.9228 6.9713 6.9713 7.0007 7.0007 7.0491 7.0491 9.0977 9.0977 k = 0.0000 0.0000 0.0938 ( 6079 PWs) bands (ev): -14.6855 -14.6855 -14.0815 -14.0815 -13.1687 -13.1687 -12.9858 -12.9858 -10.7213 -10.7213 -10.7205 -10.7205 -10.6695 -10.6695 -10.6663 -10.6663 -6.3064 -6.3064 -6.2774 -6.2774 -3.0642 -3.0642 -2.9467 -2.9467 -2.4682 -2.4682 -2.2989 -2.2989 -2.2710 -2.2710 -1.9564 -1.9564 -1.8698 -1.8698 -1.4357 -1.4357 -1.3315 -1.3315 -1.1570 -1.1570 -0.5868 -0.5868 -0.0455 -0.0455 -0.0334 -0.0334 0.0893 0.0893 0.1684 0.1684 0.1831 0.1831 0.2554 0.2554 0.6747 0.6747 1.6243 1.6243 2.2467 2.2467 2.2571 2.2571 2.4149 2.4149 2.4420 2.4420 2.9800 2.9800 4.0794 4.0794 4.0973 4.0973 4.6663 4.6663 4.6686 4.6686 5.4807 5.4807 5.5274 5.5274 5.6172 5.6172 5.6424 5.6424 5.8320 5.8320 5.8541 5.8541 6.1089 6.1089 6.9233 6.9233 6.9718 6.9718 6.9981 6.9981 7.0467 7.0467 9.0718 9.0718 k = 0.0000 0.0000 0.1094 ( 6097 PWs) bands (ev): -14.6849 -14.6849 -14.0818 -14.0818 -13.1762 -13.1762 -12.9787 -12.9787 -10.7210 -10.7210 -10.7202 -10.7202 -10.6698 -10.6698 -10.6666 -10.6666 -6.3057 -6.3057 -6.2771 -6.2771 -3.0640 -3.0640 -2.9460 -2.9460 -2.4666 -2.4666 -2.2980 -2.2980 -2.2687 -2.2687 -1.9601 -1.9601 -1.8706 -1.8706 -1.4386 -1.4386 -1.3316 -1.3316 -1.1586 -1.1586 -0.6104 -0.6104 -0.0561 -0.0561 -0.0469 -0.0469 0.1047 0.1047 0.1789 0.1789 0.1945 0.1945 0.2496 0.2496 0.6814 0.6814 1.6528 1.6528 2.2432 2.2432 2.2534 2.2534 2.4297 2.4297 2.4569 2.4569 2.9605 2.9605 4.0763 4.0763 4.0949 4.0949 4.6479 4.6479 4.6503 4.6503 5.4808 5.4808 5.5273 5.5273 5.6203 5.6203 5.6448 5.6448 5.8413 5.8413 5.8634 5.8634 6.1133 6.1133 6.9239 6.9239 6.9723 6.9723 6.9952 6.9952 7.0440 7.0440 9.0428 9.0428 k = 0.0000 0.0000 0.1250 ( 6121 PWs) bands (ev): -14.6842 -14.6842 -14.0820 -14.0820 -13.1837 -13.1837 -12.9715 -12.9715 -10.7207 -10.7207 -10.7199 -10.7199 -10.6701 -10.6701 -10.6669 -10.6669 -6.3049 -6.3049 -6.2769 -6.2769 -3.0637 -3.0637 -2.9454 -2.9454 -2.4648 -2.4648 -2.2973 -2.2973 -2.2661 -2.2661 -1.9643 -1.9643 -1.8716 -1.8716 -1.4417 -1.4417 -1.3318 -1.3318 -1.1603 -1.1603 -0.6342 -0.6342 -0.0667 -0.0667 -0.0603 -0.0603 0.1180 0.1180 0.1893 0.1893 0.2057 0.2057 0.2453 0.2453 0.6885 0.6885 1.6856 1.6856 2.2400 2.2400 2.2499 2.2499 2.4454 2.4454 2.4727 2.4727 2.9378 2.9378 4.0728 4.0728 4.0920 4.0920 4.6283 4.6283 4.6307 4.6307 5.4810 5.4810 5.5271 5.5271 5.6230 5.6230 5.6468 5.6468 5.8517 5.8517 5.8736 5.8736 6.1185 6.1185 6.9245 6.9245 6.9729 6.9729 6.9920 6.9920 7.0410 7.0410 9.0114 9.0114 k = 0.0000 0.0000 0.1406 ( 6121 PWs) bands (ev): -14.6835 -14.6835 -14.0823 -14.0823 -13.1912 -13.1912 -12.9644 -12.9644 -10.7204 -10.7204 -10.7196 -10.7196 -10.6704 -10.6704 -10.6672 -10.6672 -6.3039 -6.3039 -6.2767 -6.2767 -3.0634 -3.0634 -2.9446 -2.9446 -2.4627 -2.4627 -2.2963 -2.2963 -2.2633 -2.2633 -1.9687 -1.9687 -1.8725 -1.8725 -1.4449 -1.4449 -1.3319 -1.3319 -1.1620 -1.1620 -0.6577 -0.6577 -0.0771 -0.0771 -0.0733 -0.0733 0.1283 0.1283 0.1989 0.1989 0.2165 0.2165 0.2434 0.2434 0.6957 0.6957 1.7224 1.7224 2.2370 2.2370 2.2467 2.2467 2.4617 2.4617 2.4892 2.4892 2.9118 2.9118 4.0689 4.0689 4.0888 4.0888 4.6081 4.6081 4.6104 4.6104 5.4811 5.4811 5.5269 5.5269 5.6253 5.6253 5.6485 5.6485 5.8629 5.8629 5.8846 5.8846 6.1244 6.1244 6.9253 6.9253 6.9736 6.9736 6.9885 6.9885 7.0377 7.0377 8.9783 8.9783 k = 0.0000 0.0000 0.1563 ( 6121 PWs) bands (ev): -14.6827 -14.6827 -14.0826 -14.0826 -13.1985 -13.1985 -12.9575 -12.9575 -10.7200 -10.7200 -10.7192 -10.7192 -10.6708 -10.6708 -10.6676 -10.6676 -6.3028 -6.3028 -6.2765 -6.2765 -3.0630 -3.0630 -2.9438 -2.9438 -2.4606 -2.4606 -2.2952 -2.2952 -2.2602 -2.2602 -1.9734 -1.9734 -1.8735 -1.8735 -1.4483 -1.4483 -1.3320 -1.3320 -1.1639 -1.1639 -0.6805 -0.6805 -0.0871 -0.0871 -0.0859 -0.0859 0.1346 0.1346 0.2074 0.2074 0.2266 0.2266 0.2450 0.2450 0.7029 0.7029 1.7629 1.7629 2.2343 2.2343 2.2438 2.2438 2.4783 2.4783 2.5060 2.5060 2.8824 2.8824 4.0645 4.0645 4.0853 4.0853 4.5876 4.5876 4.5897 4.5897 5.4813 5.4813 5.5267 5.5267 5.6272 5.6272 5.6498 5.6498 5.8747 5.8747 5.8961 5.8961 6.1309 6.1309 6.9261 6.9261 6.9744 6.9744 6.9849 6.9849 7.0343 7.0343 8.9442 8.9442 k = 0.0000 0.0000 0.1719 ( 6134 PWs) bands (ev): -14.6820 -14.6820 -14.0829 -14.0829 -13.2054 -13.2054 -12.9509 -12.9509 -10.7197 -10.7197 -10.7189 -10.7189 -10.6711 -10.6711 -10.6680 -10.6680 -6.3016 -6.3016 -6.2765 -6.2765 -3.0627 -3.0627 -2.9431 -2.9431 -2.4585 -2.4585 -2.2942 -2.2942 -2.2571 -2.2571 -1.9784 -1.9784 -1.8745 -1.8745 -1.4518 -1.4518 -1.3321 -1.3321 -1.1657 -1.1657 -0.7020 -0.7020 -0.0979 -0.0979 -0.0967 -0.0967 0.1368 0.1368 0.2146 0.2146 0.2362 0.2362 0.2502 0.2502 0.7099 0.7099 1.8070 1.8070 2.2319 2.2319 2.2412 2.2412 2.4949 2.4949 2.5229 2.5229 2.8497 2.8497 4.0597 4.0597 4.0815 4.0815 4.5674 4.5674 4.5692 4.5692 5.4815 5.4815 5.5266 5.5266 5.6286 5.6286 5.6507 5.6507 5.8867 5.8867 5.9077 5.9077 6.1379 6.1379 6.9269 6.9269 6.9752 6.9752 6.9811 6.9811 7.0308 7.0308 8.9098 8.9098 k = 0.0000 0.0000 0.1875 ( 6122 PWs) bands (ev): -14.6812 -14.6812 -14.0832 -14.0832 -13.2119 -13.2119 -12.9447 -12.9447 -10.7193 -10.7193 -10.7185 -10.7185 -10.6715 -10.6715 -10.6683 -10.6683 -6.3003 -6.3003 -6.2766 -6.2766 -3.0623 -3.0623 -2.9422 -2.9422 -2.4564 -2.4564 -2.2931 -2.2931 -2.2537 -2.2537 -1.9833 -1.9833 -1.8755 -1.8755 -1.4552 -1.4552 -1.3322 -1.3322 -1.1675 -1.1675 -0.7222 -0.7222 -0.1091 -0.1091 -0.1056 -0.1056 0.1356 0.1356 0.2212 0.2212 0.2450 0.2450 0.2576 0.2576 0.7166 0.7166 1.8544 1.8544 2.2298 2.2298 2.2390 2.2390 2.5113 2.5113 2.5395 2.5395 2.8138 2.8138 4.0547 4.0547 4.0775 4.0775 4.5480 4.5480 4.5494 4.5494 5.4817 5.4817 5.5264 5.5264 5.6296 5.6296 5.6513 5.6513 5.8986 5.8986 5.9193 5.9193 6.1454 6.1454 6.9279 6.9279 6.9761 6.9761 6.9773 6.9773 7.0272 7.0272 8.8759 8.8759 k = 0.0000 0.0000 0.2031 ( 6134 PWs) bands (ev): -14.6805 -14.6805 -14.0835 -14.0835 -13.2180 -13.2180 -12.9390 -12.9390 -10.7190 -10.7190 -10.7182 -10.7182 -10.6718 -10.6718 -10.6687 -10.6687 -6.2990 -6.2990 -6.2768 -6.2768 -3.0620 -3.0620 -2.9415 -2.9415 -2.4543 -2.4543 -2.2921 -2.2921 -2.2504 -2.2504 -1.9884 -1.9884 -1.8765 -1.8765 -1.4586 -1.4586 -1.3323 -1.3323 -1.1693 -1.1693 -0.7406 -0.7406 -0.1194 -0.1194 -0.1139 -0.1139 0.1321 0.1321 0.2275 0.2275 0.2530 0.2530 0.2658 0.2658 0.7228 0.7228 1.9047 1.9047 2.2280 2.2280 2.2370 2.2370 2.5271 2.5271 2.5556 2.5556 2.7746 2.7746 4.0495 4.0495 4.0734 4.0734 4.5296 4.5296 4.5305 4.5305 5.4818 5.4818 5.5262 5.5262 5.6303 5.6303 5.6516 5.6516 5.9101 5.9101 5.9304 5.9304 6.1530 6.1530 6.9289 6.9289 6.9734 6.9734 6.9770 6.9770 7.0236 7.0236 8.8432 8.8432 k = 0.0000 0.0000 0.2188 ( 6140 PWs) bands (ev): -14.6798 -14.6798 -14.0837 -14.0837 -13.2235 -13.2235 -12.9339 -12.9339 -10.7186 -10.7186 -10.7178 -10.7178 -10.6722 -10.6722 -10.6690 -10.6690 -6.2975 -6.2975 -6.2772 -6.2772 -3.0617 -3.0617 -2.9408 -2.9408 -2.4524 -2.4524 -2.2912 -2.2912 -2.2471 -2.2471 -1.9932 -1.9932 -1.8775 -1.8775 -1.4617 -1.4617 -1.3323 -1.3323 -1.1710 -1.1710 -0.7572 -0.7572 -0.1287 -0.1287 -0.1214 -0.1214 0.1274 0.1274 0.2334 0.2334 0.2602 0.2602 0.2740 0.2740 0.7286 0.7286 1.9575 1.9575 2.2265 2.2265 2.2353 2.2353 2.5420 2.5420 2.5708 2.5708 2.7324 2.7324 4.0442 4.0442 4.0691 4.0691 4.5127 4.5127 4.5131 4.5131 5.4820 5.4820 5.5261 5.5261 5.6307 5.6307 5.6517 5.6517 5.9209 5.9209 5.9409 5.9409 6.1607 6.1607 6.9299 6.9299 6.9697 6.9697 6.9779 6.9779 7.0201 7.0201 8.8123 8.8123 k = 0.0000 0.0000 0.2344 ( 6140 PWs) bands (ev): -14.6791 -14.6791 -14.0840 -14.0840 -13.2283 -13.2283 -12.9293 -12.9293 -10.7183 -10.7183 -10.7175 -10.7175 -10.6725 -10.6725 -10.6694 -10.6694 -6.2960 -6.2960 -6.2777 -6.2777 -3.0614 -3.0614 -2.9401 -2.9401 -2.4506 -2.4506 -2.2903 -2.2903 -2.2440 -2.2440 -1.9978 -1.9978 -1.8783 -1.8783 -1.4647 -1.4647 -1.3324 -1.3324 -1.1725 -1.1725 -0.7718 -0.7718 -0.1370 -0.1370 -0.1280 -0.1280 0.1221 0.1221 0.2389 0.2389 0.2665 0.2665 0.2814 0.2814 0.7336 0.7336 2.0124 2.0124 2.2252 2.2252 2.2338 2.2338 2.5556 2.5556 2.5848 2.5848 2.6874 2.6874 4.0391 4.0391 4.0650 4.0650 4.4974 4.4974 4.4976 4.4976 5.4821 5.4821 5.5259 5.5259 5.6309 5.6309 5.6516 5.6516 5.9309 5.9309 5.9505 5.9505 6.1680 6.1680 6.9310 6.9310 6.9660 6.9660 6.9789 6.9789 7.0168 7.0168 8.7840 8.7840 k = 0.0000 0.0000 0.2500 ( 6128 PWs) bands (ev): -14.6785 -14.6785 -14.0842 -14.0842 -13.2325 -13.2325 -12.9254 -12.9254 -10.7181 -10.7181 -10.7172 -10.7172 -10.6728 -10.6728 -10.6696 -10.6696 -6.2945 -6.2945 -6.2783 -6.2783 -3.0611 -3.0611 -2.9394 -2.9394 -2.4490 -2.4490 -2.2894 -2.2894 -2.2411 -2.2411 -2.0019 -2.0019 -1.8790 -1.8790 -1.4673 -1.4673 -1.3323 -1.3323 -1.1738 -1.1738 -0.7842 -0.7842 -0.1441 -0.1441 -0.1337 -0.1337 0.1171 0.1171 0.2438 0.2438 0.2718 0.2718 0.2879 0.2879 0.7380 0.7380 2.0689 2.0689 2.2242 2.2242 2.2326 2.2326 2.5670 2.5670 2.5972 2.5972 2.6403 2.6403 4.0342 4.0342 4.0611 4.0611 4.4837 4.4837 4.4844 4.4844 5.4822 5.4822 5.5258 5.5258 5.6309 5.6309 5.6514 5.6514 5.9397 5.9397 5.9589 5.9589 6.1749 6.1749 6.9321 6.9321 6.9626 6.9626 6.9799 6.9799 7.0137 7.0137 8.7588 8.7588 k = 0.0000 0.0000 0.2656 ( 6128 PWs) bands (ev): -14.6781 -14.6781 -14.0844 -14.0844 -13.2360 -13.2360 -12.9221 -12.9221 -10.7178 -10.7178 -10.7170 -10.7170 -10.6730 -10.6730 -10.6699 -10.6699 -6.2930 -6.2930 -6.2790 -6.2790 -3.0609 -3.0609 -2.9389 -2.9389 -2.4476 -2.4476 -2.2887 -2.2887 -2.2385 -2.2385 -2.0056 -2.0056 -1.8797 -1.8797 -1.4695 -1.4695 -1.3324 -1.3324 -1.1749 -1.1749 -0.7945 -0.7945 -0.1500 -0.1500 -0.1384 -0.1384 0.1125 0.1125 0.2479 0.2479 0.2763 0.2763 0.2933 0.2933 0.7417 0.7417 2.1267 2.1267 2.2234 2.2234 2.2317 2.2317 2.5709 2.5709 2.5965 2.5965 2.6079 2.6079 4.0299 4.0299 4.0576 4.0576 4.4722 4.4722 4.4734 4.4734 5.4824 5.4824 5.5257 5.5257 5.6309 5.6309 5.6512 5.6512 5.9471 5.9471 5.9661 5.9661 6.1809 6.1809 6.9333 6.9333 6.9595 6.9595 6.9808 6.9808 7.0109 7.0109 8.7373 8.7373 k = 0.0000 0.0000 0.2813 ( 6116 PWs) bands (ev): -14.6777 -14.6777 -14.0845 -14.0845 -13.2388 -13.2388 -12.9196 -12.9196 -10.7176 -10.7176 -10.7168 -10.7168 -10.6732 -10.6732 -10.6701 -10.6701 -6.2917 -6.2917 -6.2798 -6.2798 -3.0607 -3.0607 -2.9384 -2.9384 -2.4465 -2.4465 -2.2881 -2.2881 -2.2363 -2.2363 -2.0086 -2.0086 -1.8802 -1.8802 -1.4712 -1.4712 -1.3323 -1.3323 -1.1759 -1.1759 -0.8025 -0.8025 -0.1547 -0.1547 -0.1422 -0.1422 0.1087 0.1087 0.2512 0.2512 0.2797 0.2797 0.2975 0.2975 0.7446 0.7446 2.1851 2.1851 2.2228 2.2228 2.2309 2.2309 2.5324 2.5324 2.5910 2.5910 2.6165 2.6165 4.0263 4.0263 4.0547 4.0547 4.4631 4.4631 4.4648 4.4648 5.4825 5.4825 5.5256 5.5256 5.6308 5.6308 5.6511 5.6511 5.9531 5.9531 5.9718 5.9718 6.1859 6.1859 6.9344 6.9344 6.9569 6.9569 6.9817 6.9817 7.0085 7.0085 8.7201 8.7201 k = 0.0000 0.0000 0.2969 ( 6134 PWs) bands (ev): -14.6774 -14.6774 -14.0846 -14.0846 -13.2407 -13.2407 -12.9177 -12.9177 -10.7175 -10.7175 -10.7166 -10.7166 -10.6734 -10.6734 -10.6702 -10.6702 -6.2905 -6.2905 -6.2805 -6.2805 -3.0607 -3.0607 -2.9382 -2.9382 -2.4458 -2.4458 -2.2878 -2.2878 -2.2348 -2.2348 -2.0108 -2.0108 -1.8807 -1.8807 -1.4726 -1.4726 -1.3324 -1.3324 -1.1766 -1.1766 -0.8083 -0.8083 -0.1581 -0.1581 -0.1449 -0.1449 0.1059 0.1059 0.2536 0.2536 0.2822 0.2822 0.3005 0.3005 0.7467 0.7467 2.2223 2.2223 2.2302 2.2302 2.2437 2.2437 2.4795 2.4795 2.5959 2.5959 2.6228 2.6228 4.0235 4.0235 4.0525 4.0525 4.4565 4.4565 4.4585 4.4585 5.4825 5.4825 5.5255 5.5255 5.6307 5.6307 5.6509 5.6509 5.9575 5.9575 5.9760 5.9760 6.1896 6.1896 6.9353 6.9353 6.9547 6.9547 6.9825 6.9825 7.0067 7.0067 8.7075 8.7075 k = 0.0000 0.0000 0.3125 ( 6134 PWs) bands (ev): -14.6772 -14.6772 -14.0847 -14.0847 -13.2419 -13.2419 -12.9166 -12.9166 -10.7174 -10.7174 -10.7165 -10.7165 -10.6735 -10.6735 -10.6703 -10.6703 -6.2897 -6.2897 -6.2811 -6.2811 -3.0606 -3.0606 -2.9380 -2.9380 -2.4453 -2.4453 -2.2876 -2.2876 -2.2338 -2.2338 -2.0122 -2.0122 -1.8809 -1.8809 -1.4734 -1.4734 -1.3324 -1.3324 -1.1770 -1.1770 -0.8118 -0.8118 -0.1601 -0.1601 -0.1465 -0.1465 0.1042 0.1042 0.2550 0.2550 0.2837 0.2837 0.3023 0.3023 0.7479 0.7479 2.2221 2.2221 2.2300 2.2300 2.3006 2.3006 2.4255 2.4255 2.5994 2.5994 2.6266 2.6266 4.0218 4.0218 4.0511 4.0511 4.4525 4.4525 4.4548 4.4548 5.4825 5.4825 5.5254 5.5254 5.6307 5.6307 5.6508 5.6508 5.9601 5.9601 5.9785 5.9785 6.1919 6.1919 6.9360 6.9360 6.9533 6.9533 6.9830 6.9830 7.0055 7.0055 8.6998 8.6998 k = 0.0000 0.0000 0.3281 ( 6140 PWs) bands (ev): -14.6772 -14.6772 -14.0847 -14.0847 -13.2423 -13.2423 -12.9162 -12.9162 -10.7174 -10.7174 -10.7165 -10.7165 -10.6735 -10.6735 -10.6704 -10.6704 -6.2893 -6.2893 -6.2813 -6.2813 -3.0606 -3.0606 -2.9380 -2.9380 -2.4451 -2.4451 -2.2875 -2.2875 -2.2336 -2.2336 -2.0127 -2.0127 -1.8810 -1.8810 -1.4737 -1.4737 -1.3325 -1.3325 -1.1771 -1.1771 -0.8129 -0.8129 -0.1608 -0.1608 -0.1470 -0.1470 0.1036 0.1036 0.2555 0.2555 0.2842 0.2842 0.3029 0.3029 0.7483 0.7483 2.2220 2.2220 2.2299 2.2299 2.3406 2.3406 2.3864 2.3864 2.6006 2.6006 2.6279 2.6279 4.0212 4.0212 4.0506 4.0506 4.4512 4.4512 4.4535 4.4535 5.4826 5.4826 5.5254 5.5254 5.6306 5.6306 5.6507 5.6507 5.9610 5.9610 5.9794 5.9794 6.1927 6.1927 6.9363 6.9363 6.9528 6.9528 6.9832 6.9832 7.0051 7.0051 8.6972 8.6972 k = 0.0000 0.0000 0.3281 ( 6140 PWs) bands (ev): -14.6772 -14.6772 -14.0847 -14.0847 -13.2423 -13.2423 -12.9162 -12.9162 -10.7174 -10.7174 -10.7165 -10.7165 -10.6735 -10.6735 -10.6704 -10.6704 -6.2893 -6.2893 -6.2813 -6.2813 -3.0606 -3.0606 -2.9380 -2.9380 -2.4451 -2.4451 -2.2875 -2.2875 -2.2336 -2.2336 -2.0127 -2.0127 -1.8810 -1.8810 -1.4737 -1.4737 -1.3325 -1.3325 -1.1771 -1.1771 -0.8129 -0.8129 -0.1608 -0.1608 -0.1470 -0.1470 0.1036 0.1036 0.2555 0.2555 0.2842 0.2842 0.3029 0.3029 0.7483 0.7483 2.2220 2.2220 2.2299 2.2299 2.3406 2.3406 2.3864 2.3864 2.6006 2.6006 2.6279 2.6279 4.0212 4.0212 4.0506 4.0506 4.4512 4.4512 4.4535 4.4535 5.4826 5.4826 5.5254 5.5254 5.6306 5.6306 5.6507 5.6507 5.9610 5.9610 5.9794 5.9794 6.1927 6.1927 6.9363 6.9363 6.9528 6.9528 6.9832 6.9832 7.0051 7.0051 8.6972 8.6972 k = 0.0135 0.0078 0.3281 ( 6132 PWs) bands (ev): -14.6769 -14.6769 -14.0849 -14.0849 -13.2420 -13.2420 -12.9161 -12.9161 -10.7177 -10.7177 -10.7167 -10.7167 -10.6739 -10.6739 -10.6707 -10.6707 -6.2898 -6.2898 -6.2817 -6.2817 -3.0603 -3.0603 -2.9380 -2.9380 -2.4447 -2.4447 -2.2874 -2.2874 -2.2335 -2.2335 -2.0125 -2.0125 -1.8809 -1.8809 -1.4732 -1.4732 -1.3324 -1.3324 -1.1775 -1.1775 -0.8127 -0.8127 -0.1602 -0.1602 -0.1466 -0.1466 0.1019 0.1019 0.2496 0.2496 0.2757 0.2757 0.3227 0.3227 0.7499 0.7499 2.2208 2.2208 2.2288 2.2288 2.3411 2.3411 2.3844 2.3844 2.6034 2.6034 2.6307 2.6307 4.0199 4.0199 4.0493 4.0493 4.4512 4.4512 4.4538 4.4538 5.4809 5.4809 5.5220 5.5220 5.6301 5.6301 5.6502 5.6502 5.9576 5.9576 5.9764 5.9764 6.1982 6.1982 6.9356 6.9356 6.9514 6.9514 6.9828 6.9828 7.0040 7.0040 8.6984 8.6984 k = 0.0270 0.0156 0.3281 ( 6132 PWs) bands (ev): -14.6760 -14.6760 -14.0853 -14.0853 -13.2410 -13.2410 -12.9158 -12.9158 -10.7189 -10.7189 -10.7170 -10.7170 -10.6754 -10.6754 -10.6715 -10.6715 -6.2911 -6.2911 -6.2830 -6.2830 -3.0596 -3.0596 -2.9378 -2.9378 -2.4438 -2.4438 -2.2871 -2.2871 -2.2336 -2.2336 -2.0117 -2.0117 -1.8809 -1.8809 -1.4716 -1.4716 -1.3325 -1.3325 -1.1787 -1.1787 -0.8120 -0.8120 -0.1583 -0.1583 -0.1453 -0.1453 0.0969 0.0969 0.2349 0.2349 0.2739 0.2739 0.3552 0.3552 0.7545 0.7545 2.2171 2.2171 2.2253 2.2253 2.3428 2.3428 2.3792 2.3792 2.6107 2.6107 2.6394 2.6394 4.0158 4.0158 4.0455 4.0455 4.4504 4.4504 4.4554 4.4554 5.4757 5.4757 5.5124 5.5124 5.6271 5.6271 5.6495 5.6495 5.9448 5.9448 5.9713 5.9713 6.2134 6.2134 6.9333 6.9333 6.9466 6.9466 6.9816 6.9816 7.0015 7.0015 8.7017 8.7017 k = 0.0405 0.0234 0.3281 ( 6116 PWs) bands (ev): -14.6745 -14.6745 -14.0860 -14.0860 -13.2394 -13.2394 -12.9151 -12.9151 -10.7212 -10.7212 -10.7173 -10.7173 -10.6783 -10.6783 -10.6722 -10.6722 -6.2933 -6.2933 -6.2850 -6.2850 -3.0585 -3.0585 -2.9376 -2.9376 -2.4422 -2.4422 -2.2866 -2.2866 -2.2336 -2.2336 -2.0104 -2.0104 -1.8808 -1.8808 -1.4689 -1.4689 -1.3324 -1.3324 -1.1807 -1.1807 -0.8108 -0.8108 -0.1554 -0.1554 -0.1430 -0.1430 0.0894 0.0894 0.2200 0.2200 0.2772 0.2772 0.3925 0.3925 0.7622 0.7622 2.2112 2.2112 2.2197 2.2197 2.3449 2.3449 2.3730 2.3730 2.6201 2.6201 2.6546 2.6546 4.0087 4.0087 4.0397 4.0397 4.4484 4.4484 4.4587 4.4587 5.4664 5.4664 5.4977 5.4977 5.6193 5.6193 5.6503 5.6503 5.9224 5.9224 5.9673 5.9673 6.2356 6.2356 6.9278 6.9278 6.9381 6.9381 6.9798 6.9798 6.9996 6.9996 8.7071 8.7071 k = 0.0541 0.0312 0.3281 ( 6120 PWs) bands (ev): -14.6724 -14.6724 -14.0869 -14.0869 -13.2371 -13.2371 -12.9143 -12.9143 -10.7244 -10.7244 -10.7177 -10.7177 -10.6828 -10.6828 -10.6729 -10.6729 -6.2962 -6.2962 -6.2879 -6.2879 -3.0570 -3.0570 -2.9373 -2.9373 -2.4401 -2.4401 -2.2860 -2.2860 -2.2337 -2.2337 -2.0087 -2.0087 -1.8808 -1.8808 -1.4654 -1.4654 -1.3325 -1.3325 -1.1834 -1.1834 -0.8089 -0.8089 -0.1514 -0.1514 -0.1399 -0.1399 0.0805 0.0805 0.2076 0.2076 0.2830 0.2830 0.4335 0.4335 0.7728 0.7728 2.2030 2.2030 2.2121 2.2121 2.3461 2.3461 2.3689 2.3689 2.6305 2.6305 2.6751 2.6751 3.9982 3.9982 4.0325 4.0325 4.4453 4.4453 4.4633 4.4633 5.4520 5.4520 5.4799 5.4799 5.6064 5.6064 5.6524 5.6524 5.8934 5.8934 5.9636 5.9636 6.2624 6.2624 6.9144 6.9144 6.9289 6.9289 6.9774 6.9774 7.0002 7.0002 8.7143 8.7143 k = 0.0676 0.0390 0.3281 ( 6114 PWs) bands (ev): -14.6697 -14.6697 -14.0882 -14.0882 -13.2341 -13.2341 -12.9132 -12.9132 -10.7286 -10.7286 -10.7182 -10.7182 -10.6886 -10.6886 -10.6736 -10.6736 -6.3000 -6.3000 -6.2916 -6.2916 -3.0551 -3.0551 -2.9370 -2.9370 -2.4374 -2.4374 -2.2852 -2.2852 -2.2339 -2.2339 -2.0066 -2.0066 -1.8808 -1.8808 -1.4609 -1.4609 -1.3326 -1.3326 -1.1867 -1.1867 -0.8063 -0.8063 -0.1465 -0.1465 -0.1358 -0.1358 0.0714 0.0714 0.1973 0.1973 0.2908 0.2908 0.4775 0.4775 0.7863 0.7863 2.1928 2.1928 2.2030 2.2030 2.3446 2.3446 2.3701 2.3701 2.6419 2.6419 2.6994 2.6994 3.9841 3.9841 4.0245 4.0245 4.4412 4.4412 4.4689 4.4689 5.4314 5.4314 5.4602 5.4602 5.5888 5.5888 5.6550 5.6550 5.8599 5.8599 5.9599 5.9599 6.2922 6.2922 6.8920 6.8920 6.9194 6.9194 6.9754 6.9754 7.0032 7.0032 8.7229 8.7229 k = 0.0811 0.0468 0.3281 ( 6102 PWs) bands (ev): -14.6665 -14.6665 -14.0897 -14.0897 -13.2305 -13.2305 -12.9119 -12.9119 -10.7336 -10.7336 -10.7187 -10.7187 -10.6957 -10.6957 -10.6744 -10.6744 -6.3046 -6.3046 -6.2960 -6.2960 -3.0527 -3.0527 -2.9366 -2.9366 -2.4340 -2.4340 -2.2842 -2.2842 -2.2341 -2.2341 -2.0041 -2.0041 -1.8808 -1.8808 -1.4555 -1.4555 -1.3329 -1.3329 -1.1904 -1.1904 -0.8029 -0.8029 -0.1411 -0.1411 -0.1306 -0.1306 0.0633 0.0633 0.1886 0.1886 0.3004 0.3004 0.5240 0.5240 0.8027 0.8027 2.1812 2.1812 2.1929 2.1929 2.3415 2.3415 2.3759 2.3759 2.6543 2.6543 2.7259 2.7259 3.9665 3.9665 4.0160 4.0160 4.4360 4.4360 4.4755 4.4755 5.4048 5.4048 5.4389 5.4389 5.5668 5.5668 5.6577 5.6577 5.8231 5.8231 5.9563 5.9563 6.3239 6.3239 6.8632 6.8632 6.9077 6.9077 6.9747 6.9747 7.0078 7.0078 8.7328 8.7328 k = 0.0946 0.0546 0.3281 ( 6104 PWs) bands (ev): -14.6627 -14.6627 -14.0915 -14.0915 -13.2263 -13.2263 -12.9104 -12.9104 -10.7394 -10.7394 -10.7193 -10.7193 -10.7040 -10.7040 -10.6754 -10.6754 -6.3099 -6.3099 -6.3011 -6.3011 -3.0500 -3.0500 -2.9361 -2.9361 -2.4302 -2.4302 -2.2831 -2.2831 -2.2343 -2.2343 -2.0014 -2.0014 -1.8810 -1.8810 -1.4495 -1.4495 -1.3333 -1.3333 -1.1945 -1.1945 -0.7986 -0.7986 -0.1352 -0.1352 -0.1244 -0.1244 0.0570 0.0570 0.1809 0.1809 0.3118 0.3118 0.5724 0.5724 0.8220 0.8220 2.1687 2.1687 2.1823 2.1823 2.3385 2.3385 2.3846 2.3846 2.6674 2.6674 2.7538 2.7538 3.9457 3.9457 4.0070 4.0070 4.4296 4.4296 4.4829 4.4829 5.3732 5.3732 5.4150 5.4150 5.5407 5.5407 5.6605 5.6605 5.7834 5.7834 5.9530 5.9530 6.3564 6.3564 6.8295 6.8295 6.8936 6.8936 6.9753 6.9753 7.0134 7.0134 8.7434 8.7434 k = 0.1081 0.0624 0.3281 ( 6112 PWs) bands (ev): -14.6583 -14.6583 -14.0936 -14.0936 -13.2214 -13.2214 -12.9088 -12.9088 -10.7460 -10.7460 -10.7200 -10.7200 -10.7135 -10.7135 -10.6764 -10.6764 -6.3159 -6.3159 -6.3068 -6.3068 -3.0470 -3.0470 -2.9357 -2.9357 -2.4258 -2.4258 -2.2819 -2.2819 -2.2347 -2.2347 -1.9985 -1.9985 -1.8814 -1.8814 -1.4429 -1.4429 -1.3338 -1.3338 -1.1988 -1.1988 -0.7932 -0.7932 -0.1292 -0.1292 -0.1172 -0.1172 0.0534 0.0534 0.1737 0.1737 0.3250 0.3250 0.6220 0.6220 0.8441 0.8441 2.1562 2.1562 2.1715 2.1715 2.3366 2.3366 2.3953 2.3953 2.6812 2.6812 2.7823 2.7823 3.9222 3.9222 3.9976 3.9976 4.4219 4.4219 4.4908 4.4908 5.3378 5.3378 5.3878 5.3878 5.5106 5.5106 5.6635 5.6635 5.7412 5.7412 5.9500 5.9500 6.3888 6.3888 6.7917 6.7917 6.8777 6.8777 6.9769 6.9769 7.0195 7.0195 8.7544 8.7544 k = 0.1216 0.0702 0.3281 ( 6118 PWs) bands (ev): -14.6534 -14.6534 -14.0961 -14.0961 -13.2159 -13.2159 -12.9069 -12.9069 -10.7534 -10.7534 -10.7241 -10.7241 -10.7208 -10.7208 -10.6776 -10.6776 -6.3224 -6.3224 -6.3132 -6.3132 -3.0438 -3.0438 -2.9353 -2.9353 -2.4210 -2.4210 -2.2805 -2.2805 -2.2350 -2.2350 -1.9955 -1.9955 -1.8819 -1.8819 -1.4358 -1.4358 -1.3346 -1.3346 -1.2031 -1.2031 -0.7868 -0.7868 -0.1230 -0.1230 -0.1092 -0.1092 0.0530 0.0530 0.1668 0.1668 0.3400 0.3400 0.6721 0.6721 0.8693 0.8693 2.1443 2.1443 2.1608 2.1608 2.3357 2.3357 2.4077 2.4077 2.6952 2.6952 2.8111 2.8111 3.8964 3.8964 3.9879 3.9879 4.4131 4.4131 4.4991 4.4991 5.2992 5.2992 5.3571 5.3571 5.4766 5.4766 5.6664 5.6664 5.6971 5.6971 5.9475 5.9475 6.4195 6.4195 6.7510 6.7510 6.8614 6.8614 6.9792 6.9792 7.0259 7.0259 8.7656 8.7656 k = 0.1351 0.0780 0.3281 ( 6120 PWs) bands (ev): -14.6480 -14.6480 -14.0988 -14.0988 -13.2097 -13.2097 -12.9049 -12.9049 -10.7615 -10.7615 -10.7358 -10.7358 -10.7217 -10.7217 -10.6789 -10.6789 -6.3295 -6.3295 -6.3201 -6.3201 -3.0402 -3.0402 -2.9348 -2.9348 -2.4157 -2.4157 -2.2790 -2.2790 -2.2354 -2.2354 -1.9925 -1.9925 -1.8825 -1.8825 -1.4284 -1.4284 -1.3355 -1.3355 -1.2071 -1.2071 -0.7793 -0.7793 -0.1165 -0.1165 -0.1008 -0.1008 0.0562 0.0562 0.1600 0.1600 0.3566 0.3566 0.7216 0.7216 0.8982 0.8982 2.1337 2.1337 2.1504 2.1504 2.3358 2.3358 2.4215 2.4215 2.7094 2.7094 2.8396 2.8396 3.8687 3.8687 3.9778 3.9778 4.4029 4.4029 4.5076 4.5076 5.2577 5.2577 5.3228 5.3228 5.4389 5.4389 5.6499 5.6499 5.6711 5.6711 5.9455 5.9455 6.4462 6.4462 6.7087 6.7087 6.8461 6.8461 6.9820 6.9820 7.0322 7.0322 8.7765 8.7765 k = 0.1486 0.0858 0.3281 ( 6114 PWs) bands (ev): -14.6421 -14.6421 -14.1019 -14.1019 -13.2029 -13.2029 -12.9027 -12.9027 -10.7702 -10.7702 -10.7484 -10.7484 -10.7226 -10.7226 -10.6802 -10.6802 -6.3372 -6.3372 -6.3275 -6.3275 -3.0363 -3.0363 -2.9343 -2.9343 -2.4099 -2.4099 -2.2774 -2.2774 -2.2359 -2.2359 -1.9896 -1.9896 -1.8833 -1.8833 -1.4208 -1.4208 -1.3364 -1.3364 -1.2108 -1.2108 -0.7708 -0.7708 -0.1100 -0.1100 -0.0922 -0.0922 0.0631 0.0631 0.1534 0.1534 0.3749 0.3749 0.7692 0.7692 0.9313 0.9313 2.1249 2.1249 2.1408 2.1408 2.3370 2.3370 2.4367 2.4367 2.7234 2.7234 2.8678 2.8678 3.8394 3.8394 3.9675 3.9675 4.3914 4.3914 4.5161 4.5161 5.2138 5.2138 5.2853 5.2853 5.3975 5.3975 5.6026 5.6026 5.6747 5.6747 5.9440 5.9440 6.4648 6.4648 6.6665 6.6665 6.8344 6.8344 6.9851 6.9851 7.0384 7.0384 8.7869 8.7869 k = 0.1622 0.0936 0.3281 ( 6116 PWs) bands (ev): -14.6357 -14.6357 -14.1053 -14.1053 -13.1956 -13.1956 -12.9004 -12.9004 -10.7795 -10.7795 -10.7619 -10.7619 -10.7236 -10.7236 -10.6817 -10.6817 -6.3452 -6.3452 -6.3354 -6.3354 -3.0323 -3.0323 -2.9339 -2.9339 -2.4038 -2.4038 -2.2757 -2.2757 -2.2364 -2.2364 -1.9868 -1.9868 -1.8843 -1.8843 -1.4134 -1.4134 -1.3372 -1.3372 -1.2141 -1.2141 -0.7612 -0.7612 -0.1033 -0.1033 -0.0837 -0.0837 0.0739 0.0739 0.1472 0.1472 0.3948 0.3948 0.8137 0.8137 0.9694 0.9694 2.1180 2.1180 2.1320 2.1320 2.3392 2.3392 2.4530 2.4530 2.7371 2.7371 2.8954 2.8954 3.8090 3.8090 3.9571 3.9571 4.3785 4.3785 4.5245 4.5245 5.1677 5.1677 5.2450 5.2450 5.3527 5.3527 5.5535 5.5535 5.6791 5.6791 5.9430 5.9430 6.4697 6.4697 6.6272 6.6272 6.8296 6.8296 6.9883 6.9883 7.0444 7.0444 8.7966 8.7966 k = 0.1757 0.1014 0.3281 ( 6122 PWs) bands (ev): -14.6288 -14.6288 -14.1091 -14.1091 -13.1876 -13.1876 -12.8981 -12.8981 -10.7893 -10.7893 -10.7762 -10.7762 -10.7246 -10.7246 -10.6832 -10.6832 -6.3536 -6.3536 -6.3436 -6.3436 -3.0281 -3.0281 -2.9335 -2.9335 -2.3975 -2.3975 -2.2739 -2.2739 -2.2369 -2.2369 -1.9844 -1.9844 -1.8855 -1.8855 -1.4065 -1.4065 -1.3376 -1.3376 -1.2169 -1.2169 -0.7506 -0.7506 -0.0964 -0.0964 -0.0754 -0.0754 0.0876 0.0876 0.1420 0.1420 0.4163 0.4163 0.8541 0.8541 1.0129 1.0129 2.1132 2.1132 2.1245 2.1245 2.3424 2.3424 2.4705 2.4705 2.7502 2.7502 2.9222 2.9222 3.7777 3.7777 3.9467 3.9467 4.3644 4.3644 4.5324 4.5324 5.1198 5.1198 5.2023 5.2023 5.3048 5.3048 5.5034 5.5034 5.6840 5.6840 5.9425 5.9425 6.4553 6.4553 6.5936 6.5936 6.8348 6.8348 6.9915 6.9915 7.0500 7.0500 8.8055 8.8055 k = 0.1892 0.1092 0.3281 ( 6130 PWs) bands (ev): -14.6215 -14.6215 -14.1132 -14.1132 -13.1791 -13.1791 -12.8957 -12.8957 -10.7997 -10.7997 -10.7911 -10.7911 -10.7256 -10.7256 -10.6848 -10.6848 -6.3623 -6.3623 -6.3520 -6.3520 -3.0238 -3.0238 -2.9331 -2.9331 -2.3908 -2.3908 -2.2721 -2.2721 -2.2376 -2.2376 -1.9824 -1.9824 -1.8867 -1.8867 -1.4003 -1.4003 -1.3374 -1.3374 -1.2191 -1.2191 -0.7391 -0.7391 -0.0895 -0.0895 -0.0673 -0.0673 0.1014 0.1014 0.1410 0.1410 0.4393 0.4393 0.8904 0.8904 1.0612 1.0612 2.1099 2.1099 2.1190 2.1190 2.3467 2.3467 2.4889 2.4889 2.7626 2.7626 2.9482 2.9482 3.7460 3.7460 3.9363 3.9363 4.3490 4.3490 4.5396 4.5396 5.0703 5.0703 5.1579 5.1579 5.2542 5.2542 5.4526 5.4526 5.6893 5.6893 5.9423 5.9423 6.4219 6.4219 6.5640 6.5640 6.8516 6.8516 6.9946 6.9946 7.0552 7.0552 8.8134 8.8134 k = 0.2027 0.1170 0.3281 ( 6126 PWs) bands (ev): -14.6137 -14.6137 -14.1177 -14.1177 -13.1701 -13.1701 -12.8932 -12.8932 -10.8108 -10.8108 -10.8064 -10.8064 -10.7267 -10.7267 -10.6865 -10.6865 -6.3712 -6.3712 -6.3607 -6.3607 -3.0193 -3.0193 -2.9327 -2.9327 -2.3839 -2.3839 -2.2701 -2.2701 -2.2382 -2.2382 -1.9809 -1.9809 -1.8878 -1.8878 -1.3952 -1.3952 -1.3363 -1.3363 -1.2207 -1.2207 -0.7267 -0.7267 -0.0825 -0.0825 -0.0594 -0.0594 0.1074 0.1074 0.1516 0.1516 0.4636 0.4636 0.9231 0.9231 1.1134 1.1134 2.1069 2.1069 2.1169 2.1169 2.3522 2.3522 2.5082 2.5082 2.7741 2.7741 2.9731 2.9731 3.7141 3.7141 3.9261 3.9261 4.3325 4.3325 4.5459 4.5459 5.0196 5.0196 5.1123 5.1123 5.2013 5.2013 5.4011 5.4011 5.6952 5.6952 5.9425 5.9425 6.3757 6.3757 6.5337 6.5337 6.8785 6.8785 6.9974 6.9974 7.0599 7.0599 8.8201 8.8201 k = 0.2162 0.1248 0.3281 ( 6118 PWs) bands (ev): -14.6056 -14.6056 -14.1224 -14.1224 -13.1605 -13.1605 -12.8908 -12.8908 -10.8243 -10.8243 -10.8200 -10.8200 -10.7279 -10.7279 -10.6882 -10.6882 -6.3802 -6.3802 -6.3696 -6.3696 -3.0148 -3.0148 -2.9324 -2.9324 -2.3768 -2.3768 -2.2681 -2.2681 -2.2388 -2.2388 -1.9800 -1.9800 -1.8889 -1.8889 -1.3913 -1.3913 -1.3339 -1.3339 -1.2218 -1.2218 -0.7136 -0.7136 -0.0755 -0.0755 -0.0517 -0.0517 0.1045 0.1045 0.1749 0.1749 0.4892 0.4892 0.9530 0.9530 1.1680 1.1680 2.1039 2.1039 2.1183 2.1183 2.3592 2.3592 2.5281 2.5281 2.7846 2.7846 2.9969 2.9969 3.6826 3.6826 3.9161 3.9161 4.3148 4.3148 4.5508 4.5508 4.9678 4.9678 5.0664 5.0664 5.1466 5.1466 5.3493 5.3493 5.7014 5.7014 5.9429 5.9429 6.3222 6.3222 6.5000 6.5000 6.9130 6.9130 7.0000 7.0000 7.0641 7.0641 8.8258 8.8258 k = 0.2297 0.1326 0.3281 ( 6118 PWs) bands (ev): -14.5971 -14.5971 -14.1276 -14.1276 -13.1505 -13.1505 -12.8884 -12.8884 -10.8404 -10.8404 -10.8316 -10.8316 -10.7290 -10.7290 -10.6899 -10.6899 -6.3894 -6.3894 -6.3785 -6.3785 -3.0103 -3.0103 -2.9321 -2.9321 -2.3697 -2.3697 -2.2661 -2.2661 -2.2395 -2.2395 -1.9798 -1.9798 -1.8899 -1.8899 -1.3889 -1.3889 -1.3302 -1.3302 -1.2224 -1.2224 -0.6998 -0.6998 -0.0685 -0.0685 -0.0442 -0.0442 0.0983 0.0983 0.2050 0.2050 0.5160 0.5160 0.9809 0.9809 1.2239 1.2239 2.1016 2.1016 2.1222 2.1222 2.3679 2.3679 2.5486 2.5486 2.7939 2.7939 3.0194 3.0194 3.6517 3.6517 3.9064 3.9064 4.2963 4.2963 4.5539 4.5539 4.9154 4.9154 5.0210 5.0210 5.0907 5.0907 5.2974 5.2974 5.7079 5.7079 5.9435 5.9435 6.2643 6.2643 6.4624 6.4624 6.9525 6.9525 7.0024 7.0024 7.0678 7.0678 8.8303 8.8303 k = 0.2432 0.1404 0.3281 ( 6106 PWs) bands (ev): -14.5882 -14.5882 -14.1330 -14.1330 -13.1401 -13.1401 -12.8861 -12.8861 -10.8573 -10.8573 -10.8431 -10.8431 -10.7301 -10.7301 -10.6917 -10.6917 -6.3985 -6.3985 -6.3874 -6.3874 -3.0057 -3.0057 -2.9318 -2.9318 -2.3625 -2.3625 -2.2640 -2.2640 -2.2402 -2.2402 -1.9804 -1.9804 -1.8905 -1.8905 -1.3877 -1.3877 -1.3254 -1.3254 -1.2224 -1.2224 -0.6855 -0.6855 -0.0616 -0.0616 -0.0370 -0.0370 0.0908 0.0908 0.2397 0.2397 0.5437 0.5437 1.0074 1.0074 1.2800 1.2800 2.1008 2.1008 2.1276 2.1276 2.3783 2.3783 2.5694 2.5694 2.8018 2.8018 3.0405 3.0405 3.6219 3.6219 3.8970 3.8970 4.2769 4.2769 4.5546 4.5546 4.8626 4.8626 4.9770 4.9770 5.0341 5.0341 5.2455 5.2455 5.7149 5.7149 5.9443 5.9443 6.2037 6.2037 6.4216 6.4216 6.9936 6.9936 7.0060 7.0060 7.0710 7.0710 8.8336 8.8336 k = 0.2568 0.1482 0.3281 ( 6106 PWs) bands (ev): -14.5791 -14.5791 -14.1388 -14.1388 -13.1293 -13.1293 -12.8838 -12.8838 -10.8744 -10.8744 -10.8545 -10.8545 -10.7313 -10.7313 -10.6935 -10.6935 -6.4077 -6.4077 -6.3963 -6.3963 -3.0012 -3.0012 -2.9317 -2.9317 -2.3554 -2.3554 -2.2618 -2.2618 -2.2409 -2.2409 -1.9818 -1.9818 -1.8909 -1.8909 -1.3873 -1.3873 -1.3200 -1.3200 -1.2221 -1.2221 -0.6707 -0.6707 -0.0548 -0.0548 -0.0300 -0.0300 0.0829 0.0829 0.2780 0.2780 0.5723 0.5723 1.0327 1.0327 1.3356 1.3356 2.1015 2.1015 2.1340 2.1340 2.3908 2.3908 2.5903 2.5903 2.8081 2.8081 3.0601 3.0601 3.5937 3.5937 3.8880 3.8880 4.2570 4.2570 4.5520 4.5520 4.8096 4.8096 4.9357 4.9357 4.9774 4.9774 5.1940 5.1940 5.7220 5.7220 5.9450 5.9450 6.1411 6.1411 6.3781 6.3781 7.0046 7.0046 7.0410 7.0410 7.0738 7.0738 8.8358 8.8358 k = 0.2703 0.1560 0.3281 ( 6106 PWs) bands (ev): -14.5697 -14.5697 -14.1449 -14.1449 -13.1181 -13.1181 -12.8818 -12.8818 -10.8917 -10.8917 -10.8659 -10.8659 -10.7324 -10.7324 -10.6952 -10.6952 -6.4167 -6.4167 -6.4051 -6.4051 -2.9969 -2.9969 -2.9315 -2.9315 -2.3485 -2.3485 -2.2597 -2.2597 -2.2416 -2.2416 -1.9840 -1.9840 -1.8911 -1.8911 -1.3874 -1.3874 -1.3143 -1.3143 -1.2213 -1.2213 -0.6555 -0.6555 -0.0482 -0.0482 -0.0232 -0.0232 0.0747 0.0747 0.3194 0.3194 0.6014 0.6014 1.0572 1.0572 1.3899 1.3899 2.1040 2.1040 2.1408 2.1408 2.4052 2.4052 2.6112 2.6112 2.8129 2.8129 3.0780 3.0780 3.5677 3.5677 3.8796 3.8796 4.2369 4.2369 4.5453 4.5453 4.7569 4.7569 4.8981 4.8981 4.9211 4.9211 5.1431 5.1431 5.7294 5.7294 5.9457 5.9457 6.0772 6.0772 6.3325 6.3325 7.0061 7.0061 7.0755 7.0755 7.0866 7.0866 8.8370 8.8370 k = 0.2838 0.1638 0.3281 ( 6096 PWs) bands (ev): -14.5601 -14.5601 -14.1513 -14.1513 -13.1067 -13.1067 -12.8799 -12.8799 -10.9089 -10.9089 -10.8771 -10.8771 -10.7335 -10.7335 -10.6970 -10.6970 -6.4256 -6.4256 -6.4136 -6.4136 -2.9926 -2.9926 -2.9313 -2.9313 -2.3416 -2.3416 -2.2575 -2.2575 -2.2422 -2.2422 -1.9868 -1.9868 -1.8909 -1.8909 -1.3878 -1.3878 -1.3085 -1.3085 -1.2200 -1.2200 -0.6401 -0.6401 -0.0418 -0.0418 -0.0168 -0.0168 0.0666 0.0666 0.3634 0.3634 0.6310 0.6310 1.0811 1.0811 1.4424 1.4424 2.1083 2.1083 2.1475 2.1475 2.4214 2.4214 2.6318 2.6318 2.8160 2.8160 3.0939 3.0939 3.5443 3.5443 3.8716 3.8716 4.2169 4.2169 4.5336 4.5336 4.7046 4.7046 4.8648 4.8648 4.8667 4.8667 5.0932 5.0932 5.7369 5.7369 5.9460 5.9460 6.0127 6.0127 6.2853 6.2853 7.0069 7.0069 7.0776 7.0776 7.1319 7.1319 8.8371 8.8371 k = 0.2973 0.1716 0.3281 ( 6080 PWs) bands (ev): -14.5503 -14.5503 -14.1580 -14.1580 -13.0951 -13.0951 -12.8782 -12.8782 -10.9259 -10.9259 -10.8882 -10.8882 -10.7346 -10.7346 -10.6987 -10.6987 -6.4342 -6.4342 -6.4219 -6.4219 -2.9884 -2.9884 -2.9312 -2.9312 -2.3350 -2.3350 -2.2554 -2.2554 -2.2428 -2.2428 -1.9903 -1.9903 -1.8904 -1.8904 -1.3882 -1.3882 -1.3029 -1.3029 -1.2183 -1.2183 -0.6246 -0.6246 -0.0359 -0.0359 -0.0109 -0.0109 0.0588 0.0588 0.4098 0.4098 0.6608 0.6608 1.1045 1.1045 1.4923 1.4923 2.1144 2.1144 2.1540 2.1540 2.4390 2.4390 2.6521 2.6521 2.8172 2.8172 3.1075 3.1075 3.5242 3.5242 3.8643 3.8643 4.1974 4.1974 4.5164 4.5164 4.6532 4.6532 4.8113 4.8113 4.8394 4.8394 5.0447 5.0447 5.7446 5.7446 5.9375 5.9375 5.9562 5.9562 6.2370 6.2370 7.0074 7.0074 7.0790 7.0790 7.1771 7.1771 8.8364 8.8364 k = 0.3108 0.1794 0.3281 ( 6080 PWs) bands (ev): -14.5403 -14.5403 -14.1649 -14.1649 -13.0833 -13.0833 -12.8768 -12.8768 -10.9427 -10.9427 -10.8991 -10.8991 -10.7357 -10.7357 -10.7004 -10.7004 -6.4426 -6.4426 -6.4300 -6.4300 -2.9845 -2.9845 -2.9312 -2.9312 -2.3287 -2.3287 -2.2534 -2.2534 -2.2432 -2.2432 -1.9943 -1.9943 -1.8898 -1.8898 -1.3887 -1.3887 -1.2978 -1.2978 -1.2162 -1.2162 -0.6090 -0.6090 -0.0305 -0.0305 -0.0055 -0.0055 0.0514 0.0514 0.4580 0.4580 0.6905 0.6905 1.1277 1.1277 1.5390 1.5390 2.1222 2.1222 2.1603 2.1603 2.4574 2.4574 2.6719 2.6719 2.8165 2.8165 3.1185 3.1185 3.5083 3.5083 3.8575 3.8575 4.1788 4.1788 4.4936 4.4936 4.6031 4.6031 4.7585 4.7585 4.8192 4.8192 4.9980 4.9980 5.7523 5.7523 5.8781 5.8781 5.9502 5.9502 6.1880 6.1880 7.0075 7.0075 7.0801 7.0801 7.2214 7.2214 8.8348 8.8348 k = 0.3243 0.1872 0.3281 ( 6084 PWs) bands (ev): -14.5303 -14.5303 -14.1720 -14.1720 -13.0715 -13.0715 -12.8757 -12.8757 -10.9590 -10.9590 -10.9096 -10.9096 -10.7367 -10.7367 -10.7020 -10.7020 -6.4506 -6.4506 -6.4376 -6.4376 -2.9808 -2.9808 -2.9311 -2.9311 -2.3228 -2.3228 -2.2517 -2.2517 -2.2434 -2.2434 -1.9986 -1.9986 -1.8891 -1.8891 -1.3891 -1.3891 -1.2932 -1.2932 -1.2139 -1.2139 -0.5934 -0.5934 -0.0258 -0.0258 -0.0009 -0.0009 0.0448 0.0448 0.5078 0.5078 0.7200 0.7200 1.1505 1.1505 1.5820 1.5820 2.1319 2.1319 2.1662 2.1662 2.4755 2.4755 2.6912 2.6912 2.8138 2.8138 3.1264 3.1264 3.4971 3.4971 3.8515 3.8515 4.1617 4.1617 4.4660 4.4660 4.5545 4.5545 4.7074 4.7074 4.8048 4.8048 4.9537 4.9537 5.7599 5.7599 5.8125 5.8125 5.9503 5.9503 6.1387 6.1387 7.0073 7.0073 7.0808 7.0808 7.2644 7.2644 8.8323 8.8323 k = 0.3378 0.1951 0.3281 ( 6094 PWs) bands (ev): -14.5203 -14.5203 -14.1793 -14.1793 -13.0597 -13.0597 -12.8750 -12.8750 -10.9748 -10.9748 -10.9197 -10.9197 -10.7376 -10.7376 -10.7036 -10.7036 -6.4583 -6.4583 -6.4449 -6.4449 -2.9774 -2.9774 -2.9311 -2.9311 -2.3173 -2.3173 -2.2505 -2.2505 -2.2431 -2.2431 -2.0031 -2.0031 -1.8883 -1.8883 -1.3894 -1.3894 -1.2892 -1.2892 -1.2112 -1.2112 -0.5781 -0.5781 -0.0223 -0.0223 0.0029 0.0029 0.0396 0.0396 0.5585 0.5585 0.7489 0.7489 1.1732 1.1732 1.6208 1.6208 2.1433 2.1433 2.1722 2.1722 2.4923 2.4923 2.7102 2.7102 2.8091 2.8091 3.1310 3.1310 3.4913 3.4913 3.8461 3.8461 4.1464 4.1464 4.4349 4.4349 4.5080 4.5080 4.6580 4.6580 4.7952 4.7952 4.9121 4.9121 5.7460 5.7460 5.7683 5.7683 5.9506 5.9506 6.0897 6.0897 7.0069 7.0069 7.0812 7.0812 7.3058 7.3058 8.8289 8.8289 k = 0.3514 0.2029 0.3281 ( 6098 PWs) bands (ev): -14.5104 -14.5104 -14.1866 -14.1866 -13.0479 -13.0479 -12.8746 -12.8746 -10.9899 -10.9899 -10.9293 -10.9293 -10.7385 -10.7385 -10.7050 -10.7050 -6.4656 -6.4656 -6.4517 -6.4517 -2.9743 -2.9743 -2.9310 -2.9310 -2.3123 -2.3123 -2.2498 -2.2498 -2.2421 -2.2421 -2.0077 -2.0077 -1.8875 -1.8875 -1.3895 -1.3895 -1.2858 -1.2858 -1.2082 -1.2082 -0.5631 -0.5631 -0.0204 -0.0204 0.0058 0.0058 0.0363 0.0363 0.6097 0.6097 0.7769 0.7769 1.1956 1.1956 1.6547 1.6547 2.1561 2.1561 2.1784 2.1784 2.5066 2.5066 2.7292 2.7292 2.8024 2.8024 3.1320 3.1320 3.4914 3.4914 3.8415 3.8415 4.1333 4.1333 4.4016 4.4016 4.4639 4.4639 4.6105 4.6105 4.7892 4.7892 4.8738 4.8738 5.6813 5.6813 5.7753 5.7753 5.9508 5.9508 6.0414 6.0414 7.0062 7.0062 7.0814 7.0814 7.3452 7.3452 8.8240 8.8241 k = 0.3649 0.2107 0.3281 ( 6106 PWs) bands (ev): -14.5005 -14.5005 -14.1941 -14.1941 -13.0364 -13.0364 -12.8746 -12.8746 -11.0042 -11.0042 -10.9383 -10.9383 -10.7394 -10.7394 -10.7064 -10.7064 -6.4723 -6.4723 -6.4581 -6.4581 -2.9714 -2.9714 -2.9310 -2.9310 -2.3077 -2.3077 -2.2498 -2.2498 -2.2405 -2.2405 -2.0123 -2.0123 -1.8867 -1.8867 -1.3896 -1.3896 -1.2830 -1.2830 -1.2051 -1.2051 -0.5485 -0.5485 -0.0207 -0.0207 0.0083 0.0083 0.0349 0.0349 0.6608 0.6608 0.8039 0.8039 1.2176 1.2176 1.6835 1.6835 2.1703 2.1703 2.1854 2.1854 2.5173 2.5173 2.7485 2.7485 2.7939 2.7939 3.1295 3.1295 3.4974 3.4974 3.8376 3.8376 4.1226 4.1226 4.3674 4.3674 4.4228 4.4228 4.5651 4.5651 4.7857 4.7857 4.8391 4.8391 5.6174 5.6174 5.7825 5.7825 5.9505 5.9505 5.9947 5.9947 7.0054 7.0054 7.0814 7.0814 7.3823 7.3823 8.8151 8.8153 k = 0.3784 0.2185 0.3281 ( 6102 PWs) bands (ev): -14.4909 -14.4909 -14.2014 -14.2014 -13.0251 -13.0251 -12.8750 -12.8750 -11.0176 -11.0176 -10.9467 -10.9467 -10.7402 -10.7402 -10.7077 -10.7077 -6.4786 -6.4786 -6.4639 -6.4639 -2.9688 -2.9688 -2.9309 -2.9309 -2.3035 -2.3035 -2.2500 -2.2500 -2.2386 -2.2386 -2.0167 -2.0167 -1.8858 -1.8858 -1.3894 -1.3894 -1.2806 -1.2806 -1.2019 -1.2019 -0.5346 -0.5346 -0.0232 -0.0232 0.0108 0.0108 0.0353 0.0353 0.7113 0.7113 0.8294 0.8294 1.2392 1.2392 1.7069 1.7069 2.1847 2.1847 2.1938 2.1938 2.5237 2.5237 2.7682 2.7682 2.7840 2.7840 3.1238 3.1238 3.5091 3.5091 3.8345 3.8345 4.1140 4.1140 4.3333 4.3333 4.3850 4.3850 4.5222 4.5222 4.7837 4.7837 4.8085 4.8085 5.5553 5.5553 5.7894 5.7894 5.9434 5.9434 5.9565 5.9565 7.0045 7.0045 7.0812 7.0812 7.4169 7.4169 8.7980 8.7982 k = 0.3919 0.2263 0.3281 ( 6100 PWs) bands (ev): -14.4816 -14.4816 -14.2087 -14.2087 -13.0142 -13.0142 -12.8758 -12.8758 -11.0299 -11.0299 -10.9544 -10.9544 -10.7409 -10.7409 -10.7089 -10.7089 -6.4843 -6.4843 -6.4692 -6.4692 -2.9664 -2.9664 -2.9307 -2.9307 -2.2998 -2.2998 -2.2503 -2.2503 -2.2366 -2.2366 -2.0209 -2.0209 -1.8851 -1.8851 -1.3893 -1.3893 -1.2788 -1.2788 -1.1987 -1.1987 -0.5214 -0.5214 -0.0272 -0.0272 0.0134 0.0134 0.0365 0.0365 0.7602 0.7602 0.8532 0.8532 1.2600 1.2600 1.7249 1.7249 2.1969 2.1969 2.2062 2.2062 2.5255 2.5255 2.7709 2.7709 2.7904 2.7904 3.1153 3.1153 3.5259 3.5259 3.8321 3.8321 4.1069 4.1069 4.3001 4.3001 4.3508 4.3508 4.4826 4.4826 4.7778 4.7778 4.7868 4.7868 5.4957 5.4957 5.7960 5.7960 5.9042 5.9042 5.9524 5.9524 7.0036 7.0036 7.0810 7.0810 7.4487 7.4487 8.7771 8.7775 k = 0.4054 0.2341 0.3281 ( 6102 PWs) bands (ev): -14.4728 -14.4728 -14.2157 -14.2157 -13.0038 -13.0038 -12.8770 -12.8770 -11.0411 -11.0411 -10.9614 -10.9614 -10.7415 -10.7415 -10.7100 -10.7100 -6.4894 -6.4894 -6.4740 -6.4740 -2.9645 -2.9645 -2.9305 -2.9305 -2.2967 -2.2967 -2.2506 -2.2506 -2.2347 -2.2347 -2.0248 -2.0248 -1.8844 -1.8844 -1.3890 -1.3890 -1.2773 -1.2773 -1.1957 -1.1957 -0.5092 -0.5092 -0.0321 -0.0321 0.0161 0.0161 0.0381 0.0381 0.8069 0.8069 0.8750 0.8750 1.2800 1.2800 1.7379 1.7379 2.2064 2.2064 2.2224 2.2224 2.5230 2.5230 2.7582 2.7582 2.8115 2.8115 3.1045 3.1045 3.5470 3.5470 3.8305 3.8305 4.1005 4.1005 4.2686 4.2686 4.3204 4.3204 4.4472 4.4472 4.7566 4.7566 4.7849 4.7849 5.4394 5.4394 5.8019 5.8019 5.8644 5.8644 5.9519 5.9519 7.0026 7.0026 7.0806 7.0806 7.4773 7.4773 8.7567 8.7567 k = 0.4189 0.2419 0.3281 ( 6114 PWs) bands (ev): -14.4646 -14.4646 -14.2223 -14.2223 -12.9941 -12.9941 -12.8786 -12.8786 -11.0510 -11.0510 -10.9676 -10.9676 -10.7421 -10.7421 -10.7110 -10.7110 -6.4939 -6.4939 -6.4781 -6.4781 -2.9628 -2.9628 -2.9304 -2.9304 -2.2941 -2.2941 -2.2509 -2.2509 -2.2329 -2.2329 -2.0284 -2.0284 -1.8839 -1.8839 -1.3888 -1.3888 -1.2762 -1.2762 -1.1929 -1.1929 -0.4981 -0.4981 -0.0373 -0.0373 0.0187 0.0187 0.0398 0.0398 0.8504 0.8504 0.8946 0.8946 1.2986 1.2986 1.7465 1.7465 2.2152 2.2152 2.2394 2.2394 2.5172 2.5172 2.7445 2.7445 2.8334 2.8334 3.0920 3.0920 3.5712 3.5712 3.8294 3.8294 4.0932 4.0932 4.2397 4.2397 4.2939 4.2939 4.4174 4.4174 4.7370 4.7370 4.7853 4.7853 5.3872 5.3872 5.8068 5.8068 5.8284 5.8284 5.9516 5.9516 7.0017 7.0017 7.0802 7.0802 7.5027 7.5027 8.7383 8.7385 k = 0.4324 0.2497 0.3281 ( 6118 PWs) bands (ev): -14.4572 -14.4572 -14.2284 -14.2284 -12.9851 -12.9851 -12.8805 -12.8805 -11.0596 -11.0596 -10.9728 -10.9728 -10.7426 -10.7426 -10.7118 -10.7118 -6.4978 -6.4978 -6.4817 -6.4817 -2.9615 -2.9615 -2.9302 -2.9302 -2.2919 -2.2919 -2.2513 -2.2513 -2.2313 -2.2313 -2.0315 -2.0315 -1.8834 -1.8834 -1.3886 -1.3886 -1.2754 -1.2754 -1.1905 -1.1905 -0.4883 -0.4883 -0.0422 -0.0422 0.0211 0.0211 0.0414 0.0414 0.8898 0.8898 0.9117 0.9117 1.3155 1.3155 1.7513 1.7513 2.2237 2.2237 2.2562 2.2562 2.5090 2.5090 2.7306 2.7306 2.8551 2.8551 3.0781 3.0781 3.5974 3.5974 3.8290 3.8290 4.0837 4.0837 4.2139 4.2139 4.2714 4.2714 4.3944 4.3944 4.7204 4.7204 4.7861 4.7861 5.3403 5.3403 5.7937 5.7937 5.8138 5.8138 5.9512 5.9512 7.0008 7.0008 7.0799 7.0799 7.5246 7.5246 8.7222 8.7222 k = 0.4459 0.2575 0.3281 ( 6116 PWs) bands (ev): -14.4506 -14.4506 -14.2338 -14.2338 -12.9772 -12.9772 -12.8825 -12.8825 -11.0667 -11.0667 -10.9772 -10.9772 -10.7430 -10.7430 -10.7124 -10.7124 -6.5010 -6.5010 -6.4846 -6.4846 -2.9604 -2.9604 -2.9299 -2.9299 -2.2901 -2.2901 -2.2515 -2.2515 -2.2298 -2.2298 -2.0340 -2.0340 -1.8830 -1.8830 -1.3883 -1.3883 -1.2747 -1.2747 -1.1883 -1.1883 -0.4800 -0.4800 -0.0466 -0.0466 0.0232 0.0232 0.0427 0.0427 0.9235 0.9235 0.9265 0.9265 1.3303 1.3303 1.7533 1.7533 2.2313 2.2313 2.2719 2.2719 2.4999 2.4999 2.7173 2.7173 2.8763 2.8763 3.0633 3.0633 3.6240 3.6240 3.8289 3.8289 4.0715 4.0715 4.1918 4.1918 4.2529 4.2529 4.3789 4.3789 4.7066 4.7066 4.7870 4.7870 5.2998 5.2998 5.7666 5.7666 5.8173 5.8173 5.9509 5.9509 7.0000 7.0000 7.0795 7.0795 7.5428 7.5428 8.7088 8.7088 k = 0.4595 0.2653 0.3281 ( 6120 PWs) bands (ev): -14.4453 -14.4453 -14.2383 -14.2383 -12.9705 -12.9705 -12.8845 -12.8845 -11.0723 -11.0723 -10.9807 -10.9807 -10.7433 -10.7433 -10.7130 -10.7130 -6.5035 -6.5035 -6.4869 -6.4869 -2.9596 -2.9596 -2.9298 -2.9298 -2.2887 -2.2887 -2.2517 -2.2517 -2.2287 -2.2287 -2.0361 -2.0361 -1.8827 -1.8827 -1.3881 -1.3881 -1.2743 -1.2743 -1.1866 -1.1866 -0.4733 -0.4733 -0.0503 -0.0503 0.0248 0.0248 0.0437 0.0437 0.9372 0.9372 0.9522 0.9522 1.3425 1.3425 1.7535 1.7535 2.2378 2.2378 2.2855 2.2855 2.4911 2.4911 2.7055 2.7055 2.8963 2.8963 3.0485 3.0485 3.6492 3.6492 3.8291 3.8291 4.0571 4.0571 4.1740 4.1740 4.2385 4.2385 4.3701 4.3701 4.6955 4.6955 4.7877 4.7877 5.2667 5.2667 5.7444 5.7444 5.8206 5.8206 5.9506 5.9506 6.9994 6.9994 7.0792 7.0792 7.5571 7.5571 8.6981 8.6982 k = 0.4730 0.2731 0.3281 ( 6122 PWs) bands (ev): -14.4413 -14.4413 -14.2417 -14.2417 -12.9654 -12.9654 -12.8862 -12.8862 -11.0763 -11.0763 -10.9832 -10.9832 -10.7435 -10.7435 -10.7134 -10.7134 -6.5053 -6.5053 -6.4885 -6.4885 -2.9590 -2.9590 -2.9296 -2.9296 -2.2878 -2.2878 -2.2518 -2.2518 -2.2278 -2.2278 -2.0376 -2.0376 -1.8824 -1.8824 -1.3880 -1.3880 -1.2739 -1.2739 -1.1854 -1.1854 -0.4684 -0.4684 -0.0531 -0.0531 0.0261 0.0261 0.0444 0.0444 0.9455 0.9455 0.9730 0.9730 1.3516 1.3516 1.7528 1.7528 2.2427 2.2427 2.2963 2.2963 2.4838 2.4838 2.6961 2.6961 2.9139 2.9139 3.0345 3.0345 3.6705 3.6705 3.8294 3.8294 4.0430 4.0430 4.1608 4.1608 4.2282 4.2282 4.3662 4.3662 4.6873 4.6873 4.7883 4.7883 5.2422 5.2422 5.7280 5.7280 5.8230 5.8230 5.9503 5.9503 6.9990 6.9990 7.0790 7.0790 7.5675 7.5675 8.6905 8.6905 k = 0.4865 0.2809 0.3281 ( 6118 PWs) bands (ev): -14.4388 -14.4388 -14.2438 -14.2438 -12.9622 -12.9622 -12.8874 -12.8874 -11.0788 -11.0788 -10.9847 -10.9847 -10.7437 -10.7437 -10.7136 -10.7136 -6.5064 -6.5064 -6.4895 -6.4895 -2.9586 -2.9586 -2.9295 -2.9295 -2.2872 -2.2872 -2.2519 -2.2519 -2.2273 -2.2273 -2.0385 -2.0385 -1.8823 -1.8823 -1.3878 -1.3878 -1.2738 -1.2738 -1.1846 -1.1846 -0.4654 -0.4654 -0.0548 -0.0548 0.0268 0.0268 0.0449 0.0449 0.9505 0.9505 0.9859 0.9859 1.3573 1.3573 1.7520 1.7520 2.2458 2.2458 2.3031 2.3031 2.4790 2.4790 2.6900 2.6900 2.9270 2.9270 3.0236 3.0236 3.6850 3.6850 3.8297 3.8297 4.0324 4.0324 4.1528 4.1528 4.2220 4.2220 4.3652 4.3652 4.6822 4.6822 4.7887 4.7887 5.2271 5.2271 5.7180 5.7180 5.8244 5.8244 5.9501 5.9501 6.9987 6.9987 7.0789 7.0789 7.5737 7.5737 8.6858 8.6858 k = 0.5000 0.2887 0.3281 ( 6116 PWs) bands (ev): -14.4380 -14.4380 -14.2445 -14.2445 -12.9611 -12.9611 -12.8878 -12.8878 -11.0796 -11.0796 -10.9852 -10.9852 -10.7437 -10.7437 -10.7137 -10.7137 -6.5067 -6.5067 -6.4898 -6.4898 -2.9585 -2.9585 -2.9295 -2.9295 -2.2870 -2.2870 -2.2519 -2.2519 -2.2271 -2.2271 -2.0388 -2.0388 -1.8822 -1.8822 -1.3878 -1.3878 -1.2737 -1.2737 -1.1844 -1.1844 -0.4644 -0.4644 -0.0554 -0.0554 0.0271 0.0271 0.0450 0.0450 0.9522 0.9522 0.9902 0.9902 1.3592 1.3592 1.7517 1.7517 2.2468 2.2468 2.3055 2.3055 2.4774 2.4774 2.6878 2.6878 2.9321 2.9321 3.0192 3.0192 3.6902 3.6902 3.8298 3.8298 4.0285 4.0285 4.1501 4.1501 4.2200 4.2200 4.3650 4.3650 4.6804 4.6804 4.7888 4.7888 5.2221 5.2221 5.7146 5.7146 5.8249 5.8249 5.9501 5.9501 6.9986 6.9986 7.0788 7.0788 7.5758 7.5758 8.6843 8.6843 k = 0.5000 0.2887 0.3281 ( 6116 PWs) bands (ev): -14.4380 -14.4380 -14.2445 -14.2445 -12.9611 -12.9611 -12.8878 -12.8878 -11.0796 -11.0796 -10.9852 -10.9852 -10.7437 -10.7437 -10.7137 -10.7137 -6.5067 -6.5067 -6.4898 -6.4898 -2.9585 -2.9585 -2.9295 -2.9295 -2.2870 -2.2870 -2.2519 -2.2519 -2.2271 -2.2271 -2.0388 -2.0388 -1.8822 -1.8822 -1.3878 -1.3878 -1.2737 -1.2737 -1.1844 -1.1844 -0.4644 -0.4644 -0.0554 -0.0554 0.0271 0.0271 0.0450 0.0450 0.9522 0.9522 0.9902 0.9902 1.3592 1.3592 1.7517 1.7517 2.2468 2.2468 2.3055 2.3055 2.4774 2.4774 2.6878 2.6878 2.9321 2.9321 3.0192 3.0192 3.6902 3.6902 3.8298 3.8298 4.0285 4.0285 4.1501 4.1501 4.2200 4.2200 4.3650 4.3650 4.6804 4.6804 4.7888 4.7888 5.2221 5.2221 5.7146 5.7146 5.8249 5.8249 5.9501 5.9501 6.9986 6.9986 7.0788 7.0788 7.5758 7.5758 8.6843 8.6843 k = 0.4921 0.3024 0.3281 ( 6120 PWs) bands (ev): -14.4377 -14.4377 -14.2447 -14.2447 -12.9609 -12.9609 -12.8878 -12.8878 -11.0796 -11.0796 -10.9851 -10.9851 -10.7439 -10.7439 -10.7140 -10.7140 -6.5067 -6.5067 -6.4899 -6.4899 -2.9585 -2.9585 -2.9295 -2.9295 -2.2870 -2.2870 -2.2520 -2.2520 -2.2272 -2.2272 -2.0385 -2.0385 -1.8824 -1.8824 -1.3878 -1.3878 -1.2741 -1.2741 -1.1846 -1.1846 -0.4631 -0.4631 -0.0561 -0.0561 0.0129 0.0129 0.0608 0.0608 0.9438 0.9438 0.9999 0.9999 1.3609 1.3609 1.7514 1.7514 2.2461 2.2461 2.3010 2.3010 2.4817 2.4817 2.6871 2.6871 2.9328 2.9328 3.0199 3.0199 3.6829 3.6829 3.8361 3.8361 4.0281 4.0281 4.1484 4.1484 4.2194 4.2194 4.3638 4.3638 4.6790 4.6790 4.7875 4.7875 5.2259 5.2259 5.7151 5.7151 5.8265 5.8265 5.9499 5.9499 6.9968 6.9968 7.0760 7.0760 7.5761 7.5761 8.6846 8.6846 k = 0.4841 0.3162 0.3281 ( 6116 PWs) bands (ev): -14.4369 -14.4369 -14.2453 -14.2453 -12.9603 -12.9603 -12.8876 -12.8876 -11.0797 -11.0797 -10.9851 -10.9851 -10.7446 -10.7446 -10.7151 -10.7151 -6.5067 -6.5067 -6.4902 -6.4902 -2.9583 -2.9583 -2.9297 -2.9297 -2.2867 -2.2867 -2.2521 -2.2521 -2.2275 -2.2275 -2.0377 -2.0377 -1.8829 -1.8829 -1.3875 -1.3875 -1.2751 -1.2751 -1.1853 -1.1853 -0.4593 -0.4593 -0.0586 -0.0586 -0.0057 -0.0057 0.0845 0.0845 0.9286 0.9286 1.0191 1.0191 1.3658 1.3658 1.7506 1.7506 2.2439 2.2439 2.2887 2.2887 2.4937 2.4937 2.6850 2.6850 2.9350 2.9350 3.0220 3.0220 3.6642 3.6642 3.8519 3.8519 4.0270 4.0270 4.1435 4.1435 4.2179 4.2179 4.3601 4.3601 4.6745 4.6745 4.7836 4.7836 5.2373 5.2373 5.7168 5.7168 5.8313 5.8313 5.9496 5.9496 6.9915 6.9915 7.0673 7.0673 7.5771 7.5771 8.6854 8.6854 k = 0.4762 0.3299 0.3281 ( 6116 PWs) bands (ev): -14.4357 -14.4357 -14.2464 -14.2464 -12.9594 -12.9594 -12.8874 -12.8874 -11.0799 -11.0799 -10.9849 -10.9849 -10.7457 -10.7457 -10.7168 -10.7168 -6.5068 -6.5068 -6.4905 -6.4905 -2.9580 -2.9580 -2.9300 -2.9300 -2.2864 -2.2864 -2.2524 -2.2524 -2.2281 -2.2281 -2.0363 -2.0363 -1.8837 -1.8837 -1.3872 -1.3872 -1.2768 -1.2768 -1.1864 -1.1864 -0.4530 -0.4530 -0.0636 -0.0636 -0.0218 -0.0218 0.1102 0.1102 0.9131 0.9131 1.0412 1.0412 1.3738 1.3738 1.7493 1.7493 2.2401 2.2401 2.2709 2.2709 2.5110 2.5110 2.6819 2.6819 2.9387 2.9387 3.0252 3.0252 3.6390 3.6390 3.8720 3.8720 4.0251 4.0251 4.1359 4.1359 4.2154 4.2154 4.3541 4.3541 4.6663 4.6663 4.7780 4.7780 5.2557 5.2557 5.7195 5.7195 5.8392 5.8392 5.9491 5.9491 6.9828 6.9828 7.0531 7.0531 7.5786 7.5786 8.6868 8.6868 k = 0.4683 0.3437 0.3281 ( 6106 PWs) bands (ev): -14.4339 -14.4339 -14.2479 -14.2479 -12.9581 -12.9581 -12.8870 -12.8870 -11.0802 -11.0802 -10.9847 -10.9847 -10.7471 -10.7471 -10.7192 -10.7192 -6.5068 -6.5068 -6.4911 -6.4911 -2.9576 -2.9576 -2.9303 -2.9303 -2.2859 -2.2859 -2.2528 -2.2528 -2.2287 -2.2287 -2.0344 -2.0344 -1.8849 -1.8849 -1.3867 -1.3867 -1.2792 -1.2792 -1.1878 -1.1878 -0.4445 -0.4445 -0.0724 -0.0724 -0.0339 -0.0339 0.1376 0.1376 0.8987 0.8987 1.0644 1.0644 1.3850 1.3850 1.7477 1.7477 2.2342 2.2342 2.2500 2.2500 2.5315 2.5315 2.6780 2.6780 2.9440 2.9440 3.0291 3.0291 3.6105 3.6105 3.8933 3.8933 4.0220 4.0220 4.1266 4.1266 4.2120 4.2120 4.3462 4.3462 4.6535 4.6535 4.7715 4.7715 5.2804 5.2804 5.7235 5.7235 5.8498 5.8498 5.9486 5.9486 6.9707 6.9707 7.0334 7.0334 7.5805 7.5805 8.6887 8.6887 k = 0.4603 0.3574 0.3281 ( 6106 PWs) bands (ev): -14.4316 -14.4316 -14.2498 -14.2498 -12.9564 -12.9564 -12.8866 -12.8866 -11.0806 -11.0806 -10.9845 -10.9845 -10.7490 -10.7490 -10.7221 -10.7221 -6.5068 -6.5068 -6.4917 -6.4917 -2.9571 -2.9571 -2.9308 -2.9308 -2.2853 -2.2853 -2.2532 -2.2532 -2.2296 -2.2296 -2.0320 -2.0320 -1.8864 -1.8864 -1.3861 -1.3861 -1.2822 -1.2822 -1.1893 -1.1893 -0.4340 -0.4340 -0.0849 -0.0849 -0.0418 -0.0418 0.1666 0.1666 0.8858 0.8858 1.0881 1.0881 1.3990 1.3990 1.7458 1.7458 2.2211 2.2211 2.2324 2.2324 2.5539 2.5539 2.6738 2.6738 2.9510 2.9510 3.0334 3.0334 3.5804 3.5804 3.9138 3.9138 4.0176 4.0176 4.1165 4.1165 4.2078 4.2078 4.3370 4.3370 4.6359 4.6359 4.7644 4.7644 5.3107 5.3107 5.7287 5.7287 5.8631 5.8631 5.9482 5.9482 6.9553 6.9553 7.0086 7.0086 7.5828 7.5828 8.6910 8.6910 k = 0.4524 0.3712 0.3281 ( 6104 PWs) bands (ev): -14.4288 -14.4288 -14.2521 -14.2521 -12.9544 -12.9544 -12.8861 -12.8861 -11.0810 -11.0810 -10.9842 -10.9842 -10.7511 -10.7511 -10.7255 -10.7255 -6.5069 -6.5069 -6.4925 -6.4925 -2.9566 -2.9566 -2.9314 -2.9314 -2.2845 -2.2845 -2.2538 -2.2538 -2.2306 -2.2306 -2.0292 -2.0292 -1.8883 -1.8883 -1.3853 -1.3853 -1.2858 -1.2858 -1.1909 -1.1909 -0.4218 -0.4218 -0.0996 -0.0996 -0.0473 -0.0473 0.1972 0.1972 0.8744 0.8744 1.1117 1.1117 1.4156 1.4156 1.7440 1.7440 2.1969 2.1969 2.2227 2.2227 2.5773 2.5773 2.6699 2.6699 2.9599 2.9599 3.0376 3.0376 3.5498 3.5498 3.9323 3.9323 4.0116 4.0116 4.1068 4.1068 4.2024 4.2024 4.3273 4.3273 4.6136 4.6136 4.7567 4.7567 5.3458 5.3458 5.7352 5.7352 5.8787 5.8787 5.9482 5.9482 6.9367 6.9367 6.9787 6.9787 7.5854 7.5854 8.6939 8.6939 k = 0.4444 0.3849 0.3281 ( 6100 PWs) bands (ev): -14.4256 -14.4256 -14.2549 -14.2549 -12.9521 -12.9521 -12.8856 -12.8856 -11.0816 -11.0816 -10.9839 -10.9839 -10.7535 -10.7535 -10.7294 -10.7294 -6.5070 -6.5070 -6.4934 -6.4934 -2.9559 -2.9559 -2.9321 -2.9321 -2.2836 -2.2836 -2.2544 -2.2544 -2.2317 -2.2317 -2.0260 -2.0260 -1.8906 -1.8906 -1.3843 -1.3843 -1.2899 -1.2899 -1.1926 -1.1926 -0.4081 -0.4081 -0.1147 -0.1147 -0.0519 -0.0519 0.2296 0.2296 0.8645 0.8645 1.1347 1.1347 1.4346 1.4346 1.7426 1.7426 2.1697 2.1697 2.2130 2.2130 2.6010 2.6010 2.6668 2.6668 2.9708 2.9708 3.0411 3.0411 3.5193 3.5193 3.9481 3.9481 4.0039 4.0039 4.0982 4.0982 4.1956 4.1956 4.3184 4.3184 4.5870 4.5870 4.7478 4.7478 5.3849 5.3849 5.7428 5.7428 5.8963 5.8963 5.9488 5.9488 6.9151 6.9151 6.9443 6.9443 7.5881 7.5881 8.6971 8.6972 k = 0.4365 0.3986 0.3281 ( 6104 PWs) bands (ev): -14.4218 -14.4218 -14.2581 -14.2581 -12.9494 -12.9494 -12.8851 -12.8851 -11.0824 -11.0824 -10.9837 -10.9837 -10.7562 -10.7562 -10.7336 -10.7336 -6.5072 -6.5072 -6.4945 -6.4945 -2.9552 -2.9552 -2.9328 -2.9328 -2.2827 -2.2827 -2.2551 -2.2551 -2.2329 -2.2329 -2.0224 -2.0224 -1.8933 -1.8933 -1.3832 -1.3832 -1.2944 -1.2944 -1.1941 -1.1941 -0.3933 -0.3933 -0.1297 -0.1297 -0.0563 -0.0563 0.2637 0.2637 0.8562 0.8562 1.1565 1.1565 1.4558 1.4558 1.7417 1.7417 2.1413 2.1413 2.2022 2.2022 2.6244 2.6244 2.6650 2.6650 2.9840 2.9840 3.0435 3.0435 3.4895 3.4895 3.9607 3.9607 3.9947 3.9947 4.0913 4.0913 4.1865 4.1865 4.3119 4.3119 4.5568 4.5568 4.7373 4.7373 5.4273 5.4273 5.7516 5.7516 5.9154 5.9154 5.9506 5.9506 6.8905 6.8905 6.9056 6.9056 7.5909 7.5909 8.7007 8.7007 k = 0.4286 0.4124 0.3281 ( 6096 PWs) bands (ev): -14.4176 -14.4176 -14.2617 -14.2617 -12.9465 -12.9465 -12.8846 -12.8846 -11.0832 -11.0832 -10.9834 -10.9834 -10.7589 -10.7589 -10.7381 -10.7381 -6.5073 -6.5073 -6.4956 -6.4956 -2.9544 -2.9544 -2.9336 -2.9336 -2.2816 -2.2816 -2.2558 -2.2558 -2.2341 -2.2341 -2.0184 -2.0184 -1.8962 -1.8962 -1.3819 -1.3819 -1.2991 -1.2991 -1.1955 -1.1955 -0.3777 -0.3777 -0.1440 -0.1440 -0.0609 -0.0609 0.2995 0.2995 0.8492 0.8492 1.1764 1.1764 1.4787 1.4787 1.7420 1.7420 2.1119 2.1119 2.1901 2.1901 2.6460 2.6460 2.6659 2.6659 2.9996 2.9996 3.0442 3.0442 3.4609 3.4609 3.9697 3.9697 3.9845 3.9845 4.0861 4.0861 4.1742 4.1742 4.3093 4.3093 4.5236 4.5236 4.7248 4.7248 5.4723 5.4723 5.7615 5.7615 5.9341 5.9341 5.9552 5.9552 6.8606 6.8606 6.8657 6.8657 7.5937 7.5937 8.7045 8.7045 k = 0.4206 0.4261 0.3281 ( 6096 PWs) bands (ev): -14.4130 -14.4130 -14.2657 -14.2657 -12.9433 -12.9433 -12.8843 -12.8843 -11.0842 -11.0842 -10.9832 -10.9832 -10.7617 -10.7617 -10.7427 -10.7427 -6.5075 -6.5075 -6.4968 -6.4968 -2.9535 -2.9535 -2.9345 -2.9345 -2.2805 -2.2805 -2.2565 -2.2565 -2.2354 -2.2354 -2.0142 -2.0142 -1.8996 -1.8996 -1.3804 -1.3804 -1.3041 -1.3041 -1.1967 -1.1967 -0.3616 -0.3616 -0.1576 -0.1576 -0.0658 -0.0658 0.3370 0.3370 0.8434 0.8434 1.1939 1.1939 1.5031 1.5031 1.7435 1.7435 2.0818 2.0818 2.1768 2.1768 2.6598 2.6598 2.6754 2.6754 3.0176 3.0176 3.0427 3.0427 3.4340 3.4340 3.9740 3.9740 3.9755 3.9755 4.0825 4.0825 4.1586 4.1586 4.3111 4.3111 4.4879 4.4879 4.7100 4.7100 5.5193 5.5193 5.7723 5.7723 5.9470 5.9470 5.9683 5.9683 6.8153 6.8153 6.8352 6.8352 7.5965 7.5965 8.7087 8.7087 k = 0.4127 0.4399 0.3281 ( 6096 PWs) bands (ev): -14.4079 -14.4079 -14.2701 -14.2701 -12.9399 -12.9399 -12.8840 -12.8840 -11.0854 -11.0854 -10.9830 -10.9830 -10.7646 -10.7646 -10.7473 -10.7473 -6.5077 -6.5077 -6.4981 -6.4981 -2.9527 -2.9527 -2.9353 -2.9353 -2.2794 -2.2794 -2.2573 -2.2573 -2.2366 -2.2366 -2.0097 -2.0097 -1.9032 -1.9032 -1.3788 -1.3788 -1.3091 -1.3091 -1.1978 -1.1978 -0.3451 -0.3451 -0.1701 -0.1701 -0.0712 -0.0712 0.3760 0.3760 0.8385 0.8385 1.2086 1.2086 1.5287 1.5287 1.7468 1.7468 2.0514 2.0514 2.1624 2.1624 2.6653 2.6653 2.6939 2.6939 3.0362 3.0362 3.0406 3.0406 3.4092 3.4092 3.9642 3.9642 3.9779 3.9779 4.0799 4.0799 4.1401 4.1401 4.3174 4.3174 4.4502 4.4502 4.6930 4.6930 5.5676 5.5676 5.7838 5.7838 5.9541 5.9541 5.9896 5.9896 6.7653 6.7653 6.8041 6.8041 7.5993 7.5993 8.7130 8.7131 k = 0.4048 0.4536 0.3281 ( 6096 PWs) bands (ev): -14.4024 -14.4024 -14.2750 -14.2750 -12.9362 -12.9362 -12.8840 -12.8840 -11.0866 -11.0866 -10.9830 -10.9830 -10.7673 -10.7673 -10.7519 -10.7519 -6.5080 -6.5080 -6.4994 -6.4994 -2.9517 -2.9517 -2.9362 -2.9362 -2.2782 -2.2782 -2.2580 -2.2580 -2.2378 -2.2378 -2.0050 -2.0050 -1.9071 -1.9071 -1.3770 -1.3770 -1.3141 -1.3141 -1.1987 -1.1987 -0.3286 -0.3286 -0.1816 -0.1816 -0.0772 -0.0772 0.4163 0.4163 0.8342 0.8342 1.2202 1.2202 1.5550 1.5550 1.7519 1.7519 2.0208 2.0208 2.1470 2.1470 2.6713 2.6713 2.7128 2.7128 3.0307 3.0307 3.0617 3.0617 3.3870 3.3870 3.9554 3.9554 3.9778 3.9778 4.0782 4.0782 4.1197 4.1197 4.3273 4.3273 4.4111 4.4111 4.6738 4.6738 5.6165 5.6165 5.7960 5.7960 5.9610 5.9610 6.0135 6.0135 6.7122 6.7122 6.7716 6.7716 7.6020 7.6020 8.7175 8.7176 k = 0.3968 0.4674 0.3281 ( 6088 PWs) bands (ev): -14.3965 -14.3965 -14.2803 -14.2803 -12.9324 -12.9324 -12.8841 -12.8841 -11.0880 -11.0880 -10.9829 -10.9829 -10.7699 -10.7699 -10.7563 -10.7563 -6.5082 -6.5082 -6.5007 -6.5007 -2.9508 -2.9508 -2.9370 -2.9370 -2.2770 -2.2770 -2.2586 -2.2586 -2.2389 -2.2389 -2.0002 -2.0002 -1.9113 -1.9113 -1.3750 -1.3750 -1.3190 -1.3190 -1.1993 -1.1993 -0.3123 -0.3123 -0.1919 -0.1919 -0.0838 -0.0838 0.4575 0.4575 0.8301 0.8301 1.2285 1.2285 1.5818 1.5818 1.7586 1.7586 1.9905 1.9905 2.1308 2.1308 2.6794 2.6794 2.7303 2.7303 3.0200 3.0200 3.0869 3.0869 3.3675 3.3675 3.9484 3.9484 3.9756 3.9756 4.0769 4.0769 4.0985 4.0985 4.3395 4.3395 4.3715 4.3715 4.6526 4.6526 5.6651 5.6651 5.8086 5.8086 5.9694 5.9694 6.0382 6.0382 6.6565 6.6565 6.7382 6.7382 7.6046 7.6046 8.7222 8.7224 k = 0.3889 0.4811 0.3281 ( 6092 PWs) bands (ev): -14.3902 -14.3902 -14.2860 -14.2860 -12.9284 -12.9284 -12.8845 -12.8845 -11.0895 -11.0895 -10.9830 -10.9830 -10.7722 -10.7722 -10.7604 -10.7604 -6.5085 -6.5085 -6.5020 -6.5020 -2.9498 -2.9498 -2.9379 -2.9379 -2.2760 -2.2760 -2.2591 -2.2591 -2.2400 -2.2400 -1.9954 -1.9954 -1.9157 -1.9157 -1.3729 -1.3729 -1.3238 -1.3238 -1.1998 -1.1998 -0.2965 -0.2965 -0.2007 -0.2007 -0.0910 -0.0910 0.4994 0.4994 0.8257 0.8257 1.2337 1.2337 1.6088 1.6088 1.7668 1.7668 1.9609 1.9609 2.1141 2.1141 2.6898 2.6898 2.7461 2.7461 3.0057 3.0057 3.1138 3.1138 3.3509 3.3509 3.9434 3.9434 3.9718 3.9718 4.0740 4.0740 4.0795 4.0795 4.3285 4.3285 4.3565 4.3565 4.6298 4.6298 5.7125 5.7125 5.8215 5.8215 5.9803 5.9803 6.0630 6.0630 6.5985 6.5985 6.7045 6.7045 7.6071 7.6071 8.7269 8.7270 k = 0.3810 0.4949 0.3281 ( 6096 PWs) bands (ev): -14.3835 -14.3835 -14.2921 -14.2921 -12.9243 -12.9243 -12.8853 -12.8853 -11.0910 -11.0910 -10.9832 -10.9832 -10.7743 -10.7743 -10.7643 -10.7643 -6.5088 -6.5088 -6.5033 -6.5033 -2.9489 -2.9489 -2.9388 -2.9388 -2.2750 -2.2750 -2.2596 -2.2596 -2.2410 -2.2410 -1.9906 -1.9906 -1.9201 -1.9201 -1.3705 -1.3705 -1.3284 -1.3284 -1.2002 -1.2002 -0.2816 -0.2816 -0.2079 -0.2079 -0.0989 -0.0989 0.5412 0.5412 0.8206 0.8206 1.2363 1.2363 1.6355 1.6355 1.7756 1.7756 1.9325 1.9325 2.0972 2.0972 2.7026 2.7026 2.7601 2.7601 2.9882 2.9882 3.1418 3.1418 3.3369 3.3369 3.9410 3.9410 3.9668 3.9668 4.0573 4.0573 4.0754 4.0754 4.2889 4.2889 4.3717 4.3717 4.6059 4.6059 5.7575 5.7575 5.8344 5.8344 5.9945 5.9945 6.0870 6.0870 6.5388 6.5388 6.6713 6.6713 7.6095 7.6095 8.7316 8.7320 k = 0.3730 0.5086 0.3281 ( 6100 PWs) bands (ev): -14.3765 -14.3765 -14.2986 -14.2986 -12.9201 -12.9201 -12.8864 -12.8864 -11.0925 -11.0925 -10.9834 -10.9834 -10.7760 -10.7760 -10.7677 -10.7677 -6.5090 -6.5090 -6.5046 -6.5046 -2.9480 -2.9480 -2.9397 -2.9397 -2.2742 -2.2742 -2.2598 -2.2598 -2.2419 -2.2419 -1.9860 -1.9860 -1.9246 -1.9246 -1.3681 -1.3681 -1.3327 -1.3327 -1.2005 -1.2005 -0.2683 -0.2683 -0.2127 -0.2127 -0.1074 -0.1074 0.5823 0.5823 0.8143 0.8143 1.2369 1.2369 1.6617 1.6617 1.7842 1.7842 1.9059 1.9059 2.0806 2.0806 2.7176 2.7176 2.7723 2.7723 2.9678 2.9678 3.1699 3.1699 3.3251 3.3251 3.9414 3.9414 3.9610 3.9610 4.0407 4.0407 4.0733 4.0733 4.2500 4.2500 4.3883 4.3883 4.5813 4.5813 5.7984 5.7984 5.8472 5.8472 6.0129 6.0129 6.1095 6.1095 6.4780 6.4780 6.6396 6.6396 7.6117 7.6117 8.7365 8.7370 k = 0.3651 0.5224 0.3281 ( 6092 PWs) bands (ev): -14.3691 -14.3691 -14.3055 -14.3055 -12.9158 -12.9158 -12.8879 -12.8879 -11.0939 -11.0939 -10.9837 -10.9837 -10.7773 -10.7773 -10.7707 -10.7707 -6.5092 -6.5092 -6.5058 -6.5058 -2.9470 -2.9470 -2.9404 -2.9404 -2.2735 -2.2735 -2.2599 -2.2599 -2.2426 -2.2426 -1.9815 -1.9815 -1.9289 -1.9289 -1.3654 -1.3654 -1.3368 -1.3368 -1.2006 -1.2006 -0.2579 -0.2579 -0.2139 -0.2139 -0.1165 -0.1165 0.6220 0.6220 0.8061 0.8061 1.2363 1.2363 1.6870 1.6870 1.7913 1.7913 1.8820 1.8820 2.0650 2.0650 2.7348 2.7348 2.7827 2.7827 2.9454 2.9454 3.1971 3.1971 3.3149 3.3149 3.9446 3.9446 3.9548 3.9548 4.0277 4.0277 4.0698 4.0698 4.2137 4.2137 4.4053 4.4053 4.5566 4.5566 5.8336 5.8336 5.8595 5.8595 6.0367 6.0367 6.1295 6.1295 6.4169 6.4169 6.6106 6.6106 7.6137 7.6137 8.7412 8.7419 k = 0.3571 0.5361 0.3281 ( 6092 PWs) bands (ev): -14.3614 -14.3614 -14.3128 -14.3128 -12.9116 -12.9116 -12.8899 -12.8899 -11.0952 -11.0952 -10.9840 -10.9840 -10.7782 -10.7782 -10.7731 -10.7731 -6.5093 -6.5093 -6.5068 -6.5068 -2.9462 -2.9462 -2.9412 -2.9412 -2.2730 -2.2730 -2.2600 -2.2600 -2.2432 -2.2432 -1.9776 -1.9776 -1.9327 -1.9327 -1.3628 -1.3628 -1.3405 -1.3405 -1.2006 -1.2006 -0.2520 -0.2520 -0.2103 -0.2103 -0.1259 -0.1259 0.6592 0.6592 0.7956 0.7956 1.2350 1.2350 1.7113 1.7113 1.7953 1.7953 1.8615 1.8615 2.0515 2.0515 2.7534 2.7534 2.7914 2.7914 2.9217 2.9217 3.2224 3.2224 3.3056 3.3056 3.9470 3.9470 3.9526 3.9526 4.0189 4.0189 4.0631 4.0631 4.1825 4.1825 4.4224 4.4224 4.5325 4.5325 5.8616 5.8616 5.8710 5.8710 6.0661 6.0661 6.1462 6.1462 6.3566 6.3566 6.5859 6.5859 7.6154 7.6154 8.7462 8.7510 k = 0.3492 0.5499 0.3281 ( 6098 PWs) bands (ev): -14.3535 -14.3535 -14.3204 -14.3204 -12.9074 -12.9074 -12.8924 -12.8924 -11.0962 -11.0962 -10.9842 -10.9842 -10.7787 -10.7787 -10.7751 -10.7751 -6.5093 -6.5093 -6.5077 -6.5077 -2.9454 -2.9454 -2.9419 -2.9419 -2.2727 -2.2727 -2.2600 -2.2600 -2.2436 -2.2436 -1.9744 -1.9744 -1.9360 -1.9360 -1.3603 -1.3603 -1.3438 -1.3438 -1.2006 -1.2006 -0.2500 -0.2500 -0.2029 -0.2029 -0.1352 -0.1352 0.6929 0.6929 0.7825 0.7825 1.2338 1.2338 1.7339 1.7339 1.7948 1.7948 1.8453 1.8453 2.0410 2.0410 2.7722 2.7722 2.7987 2.7987 2.8982 2.8982 3.2445 3.2445 3.2967 3.2967 3.9422 3.9422 3.9615 3.9615 4.0147 4.0147 4.0517 4.0517 4.1591 4.1591 4.4392 4.4392 4.5097 4.5097 5.8803 5.8803 5.8826 5.8826 6.1000 6.1000 6.1588 6.1588 6.2988 6.2988 6.5669 6.5669 7.6167 7.6167 8.7509 8.7596 k = 0.3413 0.5636 0.3281 ( 6094 PWs) bands (ev): -14.3453 -14.3453 -14.3285 -14.3285 -12.9033 -12.9033 -12.8955 -12.8955 -11.0969 -11.0969 -10.9845 -10.9845 -10.7788 -10.7788 -10.7764 -10.7764 -6.5092 -6.5092 -6.5084 -6.5084 -2.9448 -2.9448 -2.9424 -2.9424 -2.2725 -2.2725 -2.2599 -2.2599 -2.2438 -2.2438 -1.9722 -1.9722 -1.9382 -1.9382 -1.3581 -1.3581 -1.3463 -1.3463 -1.2006 -1.2006 -0.2498 -0.2498 -0.1951 -0.1951 -0.1431 -0.1431 0.7218 0.7218 0.7668 0.7668 1.2330 1.2330 1.7544 1.7544 1.7885 1.7885 1.8346 1.8346 2.0345 2.0345 2.7873 2.7873 2.8054 2.8054 2.8778 2.8778 3.2622 3.2622 3.2878 3.2878 3.9386 3.9386 3.9726 3.9726 4.0149 4.0149 4.0358 4.0358 4.1455 4.1455 4.4556 4.4556 4.4891 4.4891 5.8892 5.8892 5.8937 5.8937 6.1333 6.1333 6.1689 6.1689 6.2472 6.2472 6.5551 6.5551 7.6177 7.6177 8.7551 8.7646 k = 0.3333 0.5774 0.3281 ( 6096 PWs) bands (ev): -14.3370 -14.3370 -14.3367 -14.3367 -12.8997 -12.8997 -12.8987 -12.8987 -11.0971 -11.0971 -10.9845 -10.9845 -10.7788 -10.7788 -10.7769 -10.7769 -6.5089 -6.5089 -6.5089 -6.5089 -2.9445 -2.9445 -2.9427 -2.9427 -2.2724 -2.2724 -2.2599 -2.2599 -2.2439 -2.2439 -1.9715 -1.9715 -1.9389 -1.9389 -1.3572 -1.3572 -1.3474 -1.3474 -1.2006 -1.2006 -0.2500 -0.2500 -0.1914 -0.1914 -0.1467 -0.1467 0.7399 0.7399 0.7533 0.7533 1.2327 1.2327 1.7679 1.7679 1.7801 1.7801 1.8307 1.8307 2.0324 2.0324 2.7929 2.7929 2.8099 2.8099 2.8683 2.8683 3.2715 3.2715 3.2816 3.2816 3.9373 3.9373 3.9795 3.9795 4.0172 4.0172 4.0247 4.0247 4.1412 4.1412 4.4703 4.4703 4.4728 4.4728 5.8943 5.8943 5.8959 5.8959 6.1480 6.1480 6.1806 6.1806 6.2173 6.2173 6.5512 6.5512 7.6180 7.6180 8.7579 8.7585 k = 0.3333 0.5774 0.3281 ( 6096 PWs) bands (ev): -14.3370 -14.3370 -14.3367 -14.3367 -12.8997 -12.8997 -12.8987 -12.8987 -11.0971 -11.0971 -10.9845 -10.9845 -10.7788 -10.7788 -10.7769 -10.7769 -6.5089 -6.5089 -6.5089 -6.5089 -2.9445 -2.9445 -2.9427 -2.9427 -2.2724 -2.2724 -2.2599 -2.2599 -2.2439 -2.2439 -1.9715 -1.9715 -1.9389 -1.9389 -1.3572 -1.3572 -1.3474 -1.3474 -1.2006 -1.2006 -0.2500 -0.2500 -0.1914 -0.1914 -0.1467 -0.1467 0.7399 0.7399 0.7533 0.7533 1.2327 1.2327 1.7679 1.7679 1.7801 1.7801 1.8307 1.8307 2.0324 2.0324 2.7929 2.7929 2.8099 2.8099 2.8683 2.8683 3.2715 3.2715 3.2816 3.2816 3.9373 3.9373 3.9795 3.9795 4.0172 4.0172 4.0247 4.0247 4.1412 4.1412 4.4703 4.4703 4.4728 4.4728 5.8943 5.8943 5.8959 5.8959 6.1480 6.1480 6.1806 6.1806 6.2173 6.2173 6.5512 6.5512 7.6180 7.6180 8.7584 8.7615 k = 0.3254 0.5636 0.3281 ( 6092 PWs) bands (ev): -14.3456 -14.3456 -14.3282 -14.3282 -12.9035 -12.9035 -12.8952 -12.8952 -11.0969 -11.0969 -10.9844 -10.9844 -10.7788 -10.7788 -10.7764 -10.7764 -6.5092 -6.5092 -6.5084 -6.5084 -2.9448 -2.9448 -2.9424 -2.9424 -2.2725 -2.2725 -2.2599 -2.2599 -2.2439 -2.2439 -1.9721 -1.9721 -1.9382 -1.9382 -1.3581 -1.3581 -1.3464 -1.3464 -1.2006 -1.2006 -0.2497 -0.2497 -0.1955 -0.1955 -0.1429 -0.1429 0.7234 0.7234 0.7651 0.7651 1.2329 1.2329 1.7531 1.7531 1.7897 1.7897 1.8351 1.8351 2.0343 2.0343 2.7870 2.7870 2.8057 2.8057 2.8779 2.8779 3.2641 3.2641 3.2858 3.2858 3.9385 3.9385 3.9695 3.9695 4.0212 4.0212 4.0329 4.0329 4.1453 4.1453 4.4581 4.4581 4.4869 4.4869 5.8843 5.8843 5.8974 5.8974 6.1376 6.1376 6.1692 6.1692 6.2441 6.2441 6.5549 6.5549 7.6176 7.6176 8.7555 8.7616 k = 0.3175 0.5499 0.3281 ( 6088 PWs) bands (ev): -14.3546 -14.3546 -14.3194 -14.3194 -12.9085 -12.9085 -12.8915 -12.8915 -11.0959 -11.0959 -10.9841 -10.9841 -10.7787 -10.7787 -10.7752 -10.7752 -6.5092 -6.5092 -6.5077 -6.5077 -2.9453 -2.9453 -2.9419 -2.9419 -2.2727 -2.2727 -2.2600 -2.2600 -2.2437 -2.2437 -1.9739 -1.9739 -1.9363 -1.9363 -1.3601 -1.3601 -1.3440 -1.3440 -1.2007 -1.2007 -0.2488 -0.2488 -0.2056 -0.2056 -0.1338 -0.1338 0.6991 0.6991 0.7748 0.7748 1.2332 1.2332 1.7281 1.7281 1.7996 1.7996 1.8485 1.8485 2.0393 2.0393 2.7706 2.7706 2.7991 2.7991 2.8986 2.8986 3.2523 3.2523 3.2882 3.2882 3.9409 3.9409 3.9502 3.9502 4.0317 4.0317 4.0492 4.0492 4.1579 4.1579 4.4499 4.4499 4.5015 4.5015 5.8595 5.8595 5.8951 5.8951 6.1215 6.1215 6.1609 6.1609 6.2864 6.2864 6.5651 6.5651 7.6163 7.6163 8.7521 8.7532 k = 0.3095 0.5361 0.3281 ( 6096 PWs) bands (ev): -14.3639 -14.3639 -14.3104 -14.3104 -12.9141 -12.9141 -12.8880 -12.8880 -11.0943 -11.0943 -10.9834 -10.9834 -10.7783 -10.7783 -10.7734 -10.7734 -6.5088 -6.5088 -6.5067 -6.5067 -2.9461 -2.9461 -2.9414 -2.9414 -2.2730 -2.2730 -2.2601 -2.2601 -2.2435 -2.2435 -1.9763 -1.9763 -1.9337 -1.9337 -1.3626 -1.3626 -1.3411 -1.3411 -1.2009 -1.2009 -0.2471 -0.2471 -0.2187 -0.2187 -0.1224 -0.1224 0.6720 0.6720 0.7777 0.7777 1.2332 1.2332 1.6983 1.6983 1.8069 1.8069 1.8691 1.8691 2.0464 2.0464 2.7503 2.7503 2.7909 2.7909 2.9229 2.9229 3.2394 3.2394 3.2865 3.2865 3.9246 3.9246 3.9498 3.9498 4.0407 4.0407 4.0724 4.0724 4.1787 4.1787 4.4480 4.4480 4.5154 4.5154 5.8223 5.8223 5.8877 5.8877 6.1137 6.1137 6.1561 6.1561 6.3306 6.3306 6.5805 6.5805 7.6139 7.6139 8.7478 8.7536 k = 0.3016 0.5224 0.3281 ( 6096 PWs) bands (ev): -14.3736 -14.3736 -14.3013 -14.3013 -12.9204 -12.9204 -12.8847 -12.8847 -11.0918 -11.0918 -10.9823 -10.9823 -10.7775 -10.7775 -10.7712 -10.7712 -6.5081 -6.5081 -6.5054 -6.5054 -2.9470 -2.9470 -2.9408 -2.9408 -2.2736 -2.2736 -2.2601 -2.2601 -2.2432 -2.2432 -1.9789 -1.9789 -1.9308 -1.9308 -1.3650 -1.3650 -1.3380 -1.3380 -1.2013 -1.2013 -0.2455 -0.2455 -0.2327 -0.2327 -0.1103 -0.1103 0.6429 0.6429 0.7735 0.7735 1.2321 1.2321 1.6651 1.6651 1.8123 1.8123 1.8953 1.8953 2.0549 2.0549 2.7298 2.7298 2.7797 2.7797 2.9478 2.9478 3.2260 3.2260 3.2813 3.2813 3.9022 3.9022 3.9578 3.9578 4.0467 4.0467 4.1022 4.1022 4.2060 4.2060 4.4536 4.4536 4.5285 4.5285 5.7767 5.7767 5.8750 5.8750 6.1143 6.1143 6.1544 6.1544 6.3749 6.3749 6.5995 6.5995 7.6102 7.6102 8.7457 8.7480 k = 0.2937 0.5086 0.3281 ( 6084 PWs) bands (ev): -14.3834 -14.3834 -14.2920 -14.2920 -12.9274 -12.9274 -12.8817 -12.8817 -11.0885 -11.0885 -10.9808 -10.9808 -10.7764 -10.7764 -10.7687 -10.7687 -6.5071 -6.5071 -6.5037 -6.5037 -2.9479 -2.9479 -2.9402 -2.9402 -2.2743 -2.2743 -2.2600 -2.2600 -2.2430 -2.2430 -1.9815 -1.9815 -1.9276 -1.9276 -1.3674 -1.3674 -1.3348 -1.3348 -1.2018 -1.2018 -0.2528 -0.2528 -0.2380 -0.2380 -0.0979 -0.0979 0.6121 0.6121 0.7628 0.7628 1.2291 1.2291 1.6296 1.6296 1.8153 1.8153 1.9263 1.9263 2.0640 2.0640 2.7102 2.7102 2.7648 2.7648 2.9720 2.9720 3.2128 3.2128 3.2739 3.2739 3.8799 3.8799 3.9681 3.9681 4.0509 4.0509 4.1386 4.1386 4.2363 4.2363 4.4682 4.4682 4.5410 4.5410 5.7270 5.7270 5.8575 5.8575 6.1208 6.1208 6.1561 6.1561 6.4186 6.4186 6.6210 6.6210 7.6050 7.6050 8.7435 8.7468 k = 0.2857 0.4949 0.3281 ( 6086 PWs) bands (ev): -14.3936 -14.3936 -14.2828 -14.2828 -12.9351 -12.9351 -12.8789 -12.8789 -11.0842 -11.0842 -10.9788 -10.9788 -10.7749 -10.7749 -10.7658 -10.7658 -6.5056 -6.5056 -6.5017 -6.5017 -2.9490 -2.9490 -2.9397 -2.9397 -2.2754 -2.2754 -2.2598 -2.2598 -2.2429 -2.2429 -1.9839 -1.9839 -1.9246 -1.9246 -1.3698 -1.3698 -1.3316 -1.3316 -1.2026 -1.2026 -0.2693 -0.2693 -0.2344 -0.2344 -0.0855 -0.0855 0.5801 0.5801 0.7464 0.7464 1.2234 1.2234 1.5931 1.5931 1.8154 1.8154 1.9611 1.9611 2.0733 2.0733 2.6919 2.6919 2.7465 2.7465 2.9941 2.9941 3.2012 3.2012 3.2654 3.2654 3.8580 3.8580 3.9806 3.9806 4.0547 4.0547 4.1809 4.1809 4.2663 4.2663 4.4929 4.4929 4.5529 4.5529 5.6760 5.6760 5.8363 5.8363 6.1308 6.1308 6.1611 6.1611 6.4612 6.4612 6.6441 6.6441 7.5979 7.5979 8.7438 8.7458 k = 0.2778 0.4811 0.3281 ( 6078 PWs) bands (ev): -14.4039 -14.4039 -14.2734 -14.2734 -12.9434 -12.9434 -12.8765 -12.8765 -11.0790 -11.0790 -10.9762 -10.9762 -10.7732 -10.7732 -10.7627 -10.7627 -6.5037 -6.5037 -6.4993 -6.4993 -2.9502 -2.9502 -2.9391 -2.9391 -2.2768 -2.2768 -2.2594 -2.2594 -2.2428 -2.2428 -1.9859 -1.9859 -1.9216 -1.9216 -1.3720 -1.3720 -1.3284 -1.3284 -1.2036 -1.2036 -0.2873 -0.2873 -0.2291 -0.2291 -0.0732 -0.0732 0.5471 0.5471 0.7249 0.7249 1.2139 1.2139 1.5567 1.5567 1.8119 1.8119 1.9987 1.9987 2.0826 2.0826 2.6751 2.6751 2.7249 2.7249 3.0125 3.0125 3.1929 3.1929 3.2565 3.2565 3.8366 3.8366 3.9953 3.9953 4.0592 4.0592 4.2285 4.2285 4.2938 4.2938 4.5280 4.5280 4.5645 4.5645 5.6257 5.6257 5.8127 5.8127 6.1433 6.1433 6.1690 6.1690 6.5025 6.5025 6.6680 6.6680 7.5887 7.5887 8.7446 8.7455 k = 0.2698 0.4674 0.3281 ( 6082 PWs) bands (ev): -14.4145 -14.4145 -14.2641 -14.2641 -12.9523 -12.9523 -12.8744 -12.8744 -11.0727 -11.0727 -10.9730 -10.9730 -10.7713 -10.7713 -10.7593 -10.7593 -6.5013 -6.5013 -6.4964 -6.4964 -2.9517 -2.9517 -2.9385 -2.9385 -2.2786 -2.2786 -2.2589 -2.2589 -2.2430 -2.2430 -1.9875 -1.9875 -1.9188 -1.9188 -1.3742 -1.3742 -1.3254 -1.3254 -1.2050 -1.2050 -0.3063 -0.3063 -0.2229 -0.2229 -0.0612 -0.0612 0.5136 0.5136 0.6994 0.6994 1.1997 1.1997 1.5216 1.5216 1.8047 1.8047 2.0375 2.0375 2.0915 2.0915 2.6595 2.6595 2.7007 2.7007 3.0249 3.0249 3.1900 3.1900 3.2479 3.2479 3.8159 3.8159 4.0125 4.0125 4.0652 4.0652 4.2805 4.2805 4.3184 4.3184 4.5705 4.5705 4.5780 4.5780 5.5774 5.5774 5.7879 5.7879 6.1572 6.1572 6.1792 6.1792 6.5423 6.5423 6.6922 6.6922 7.5773 7.5773 8.7482 8.7492 k = 0.2619 0.4536 0.3281 ( 6082 PWs) bands (ev): -14.4252 -14.4252 -14.2548 -14.2548 -12.9619 -12.9619 -12.8727 -12.8727 -11.0653 -11.0653 -10.9692 -10.9692 -10.7692 -10.7692 -10.7557 -10.7557 -6.4985 -6.4985 -6.4931 -6.4931 -2.9533 -2.9533 -2.9380 -2.9380 -2.2808 -2.2808 -2.2582 -2.2582 -2.2432 -2.2432 -1.9887 -1.9887 -1.9162 -1.9162 -1.3763 -1.3763 -1.3224 -1.3224 -1.2066 -1.2066 -0.3259 -0.3259 -0.2159 -0.2159 -0.0494 -0.0494 0.4797 0.4797 0.6706 0.6706 1.1799 1.1799 1.4888 1.4888 1.7935 1.7935 2.0757 2.0757 2.1003 2.1003 2.6446 2.6446 2.6752 2.6752 3.0299 3.0299 3.1944 3.1944 3.2400 3.2400 3.7963 3.7963 4.0324 4.0324 4.0731 4.0731 4.3333 4.3333 4.3430 4.3430 4.5874 4.5874 4.6254 4.6254 5.5320 5.5320 5.7629 5.7629 6.1722 6.1722 6.1913 6.1913 6.5804 6.5804 6.7164 6.7164 7.5633 7.5633 8.7536 8.7547 k = 0.2540 0.4399 0.3281 ( 6082 PWs) bands (ev): -14.4360 -14.4360 -14.2455 -14.2455 -12.9720 -12.9720 -12.8713 -12.8713 -11.0570 -11.0570 -10.9648 -10.9648 -10.7669 -10.7669 -10.7520 -10.7520 -6.4952 -6.4952 -6.4894 -6.4894 -2.9552 -2.9552 -2.9374 -2.9374 -2.2834 -2.2834 -2.2573 -2.2573 -2.2437 -2.2437 -1.9895 -1.9895 -1.9138 -1.9138 -1.3782 -1.3782 -1.3195 -1.3195 -1.2085 -1.2085 -0.3462 -0.3462 -0.2083 -0.2083 -0.0380 -0.0380 0.4458 0.4458 0.6393 0.6393 1.1540 1.1540 1.4590 1.4590 1.7781 1.7781 2.1041 2.1041 2.1165 2.1165 2.6291 2.6291 2.6505 2.6505 3.0274 3.0274 3.2058 3.2058 3.2329 3.2329 3.7785 3.7785 4.0551 4.0551 4.0833 4.0833 4.3598 4.3598 4.3938 4.3938 4.6015 4.6015 4.6826 4.6826 5.4901 5.4901 5.7385 5.7385 6.1877 6.1877 6.2051 6.2051 6.6168 6.6168 6.7402 6.7402 7.5466 7.5466 8.7616 8.7639 k = 0.2460 0.4261 0.3281 ( 6086 PWs) bands (ev): -14.4470 -14.4470 -14.2363 -14.2363 -12.9826 -12.9826 -12.8703 -12.8703 -11.0476 -11.0476 -10.9597 -10.9597 -10.7645 -10.7645 -10.7481 -10.7481 -6.4914 -6.4914 -6.4851 -6.4851 -2.9573 -2.9573 -2.9368 -2.9368 -2.2864 -2.2864 -2.2565 -2.2565 -2.2442 -2.2442 -1.9898 -1.9898 -1.9116 -1.9116 -1.3800 -1.3800 -1.3168 -1.3168 -1.2108 -1.2108 -0.3671 -0.3671 -0.2001 -0.2001 -0.0269 -0.0269 0.4120 0.4120 0.6061 0.6061 1.1222 1.1222 1.4324 1.4324 1.7585 1.7585 2.1127 2.1127 2.1483 2.1483 2.6100 2.6100 2.6303 2.6303 3.0194 3.0194 3.2178 3.2178 3.2316 3.2316 3.7630 3.7630 4.0805 4.0805 4.0963 4.0963 4.3803 4.3803 4.4483 4.4483 4.6203 4.6203 4.7435 4.7435 5.4523 5.4523 5.7153 5.7153 6.2036 6.2036 6.2204 6.2204 6.6512 6.6512 6.7635 6.7635 7.5271 7.5271 8.7725 8.7746 k = 0.2381 0.4124 0.3281 ( 6090 PWs) bands (ev): -14.4580 -14.4580 -14.2272 -14.2272 -12.9936 -12.9936 -12.8696 -12.8696 -11.0372 -11.0372 -10.9539 -10.9539 -10.7620 -10.7620 -10.7442 -10.7442 -6.4871 -6.4871 -6.4804 -6.4804 -2.9596 -2.9596 -2.9363 -2.9363 -2.2899 -2.2899 -2.2555 -2.2555 -2.2449 -2.2449 -1.9897 -1.9897 -1.9096 -1.9096 -1.3816 -1.3816 -1.3144 -1.3144 -1.2133 -1.2133 -0.3884 -0.3884 -0.1915 -0.1915 -0.0161 -0.0161 0.3786 0.3786 0.5715 0.5715 1.0852 1.0852 1.4086 1.4086 1.7347 1.7347 2.1188 2.1188 2.1767 2.1767 2.5875 2.5875 2.6152 2.6152 3.0080 3.0080 3.2142 3.2142 3.2498 3.2498 3.7503 3.7503 4.1057 4.1057 4.1150 4.1150 4.4007 4.4007 4.4957 4.4957 4.6486 4.6486 4.8065 4.8065 5.4190 5.4190 5.6936 5.6936 6.2195 6.2195 6.2370 6.2370 6.6836 6.6836 6.7859 6.7859 7.5047 7.5047 8.7936 8.8147 k = 0.2302 0.3986 0.3281 ( 6094 PWs) bands (ev): -14.4691 -14.4691 -14.2183 -14.2183 -13.0051 -13.0051 -12.8693 -12.8693 -11.0258 -11.0258 -10.9474 -10.9474 -10.7595 -10.7595 -10.7402 -10.7402 -6.4823 -6.4823 -6.4751 -6.4751 -2.9622 -2.9622 -2.9357 -2.9357 -2.2937 -2.2937 -2.2546 -2.2546 -2.2457 -2.2457 -1.9891 -1.9891 -1.9079 -1.9079 -1.3831 -1.3831 -1.3121 -1.3121 -1.2161 -1.2161 -0.4102 -0.4102 -0.1825 -0.1825 -0.0057 -0.0057 0.3457 0.3457 0.5361 0.5361 1.0441 1.0441 1.3868 1.3868 1.7069 1.7069 2.1238 2.1238 2.1990 2.1990 2.5657 2.5657 2.6021 2.6021 2.9949 2.9949 3.2065 3.2065 3.2744 3.2744 3.7410 3.7410 4.1252 4.1252 4.1449 4.1449 4.4219 4.4219 4.5301 4.5301 4.6916 4.6916 4.8703 4.8703 5.3906 5.3906 5.6738 5.6738 6.2356 6.2356 6.2548 6.2548 6.7139 6.7139 6.8075 6.8075 7.4794 7.4794 8.8008 8.8052 k = 0.2222 0.3849 0.3281 ( 6106 PWs) bands (ev): -14.4802 -14.4802 -14.2095 -14.2095 -13.0168 -13.0168 -12.8693 -12.8693 -11.0135 -11.0135 -10.9403 -10.9403 -10.7569 -10.7569 -10.7362 -10.7362 -6.4769 -6.4769 -6.4694 -6.4694 -2.9650 -2.9650 -2.9352 -2.9352 -2.2980 -2.2980 -2.2539 -2.2539 -2.2465 -2.2465 -1.9882 -1.9882 -1.9064 -1.9064 -1.3844 -1.3844 -1.3102 -1.3102 -1.2192 -1.2192 -0.4324 -0.4324 -0.1734 -0.1734 0.0043 0.0043 0.3134 0.3134 0.5002 0.5002 1.0001 1.0001 1.3661 1.3661 1.6752 1.6752 2.1279 2.1279 2.2137 2.2137 2.5469 2.5469 2.5894 2.5894 2.9811 2.9811 3.1976 3.1976 3.3012 3.3012 3.7352 3.7352 4.1448 4.1448 4.1802 4.1802 4.4445 4.4445 4.5520 4.5520 4.7486 4.7486 4.9339 4.9339 5.3675 5.3675 5.6561 5.6561 6.2517 6.2517 6.2737 6.2737 6.7420 6.7420 6.8281 6.8281 7.4513 7.4513 8.8234 8.8249 k = 0.2143 0.3712 0.3281 ( 6098 PWs) bands (ev): -14.4913 -14.4913 -14.2008 -14.2008 -13.0288 -13.0288 -12.8697 -12.8697 -11.0004 -11.0004 -10.9326 -10.9326 -10.7543 -10.7543 -10.7321 -10.7321 -6.4711 -6.4711 -6.4632 -6.4632 -2.9680 -2.9680 -2.9346 -2.9346 -2.3026 -2.3026 -2.2533 -2.2533 -2.2470 -2.2470 -1.9868 -1.9868 -1.9049 -1.9049 -1.3854 -1.3854 -1.3086 -1.3086 -1.2224 -1.2224 -0.4548 -0.4548 -0.1642 -0.1642 0.0140 0.0140 0.2819 0.2819 0.4642 0.4642 0.9544 0.9544 1.3459 1.3459 1.6398 1.6398 2.1310 2.1310 2.2205 2.2205 2.5318 2.5318 2.5766 2.5766 2.9671 2.9671 3.1875 3.1875 3.3295 3.3295 3.7331 3.7331 4.1659 4.1659 4.2189 4.2189 4.4689 4.4689 4.5659 4.5659 4.8146 4.8146 4.9963 4.9963 5.3500 5.3500 5.6406 5.6406 6.2680 6.2680 6.2935 6.2935 6.7678 6.7678 6.8475 6.8475 7.4205 7.4205 8.8291 8.8293 k = 0.2063 0.3574 0.3281 ( 6098 PWs) bands (ev): -14.5023 -14.5023 -14.1924 -14.1924 -13.0410 -13.0410 -12.8704 -12.8704 -10.9865 -10.9865 -10.9243 -10.9243 -10.7518 -10.7518 -10.7281 -10.7281 -6.4648 -6.4648 -6.4565 -6.4565 -2.9713 -2.9713 -2.9341 -2.9341 -2.3077 -2.3077 -2.2532 -2.2532 -2.2472 -2.2472 -1.9853 -1.9853 -1.9037 -1.9037 -1.3862 -1.3862 -1.3075 -1.3075 -1.2256 -1.2256 -0.4774 -0.4774 -0.1551 -0.1551 0.0233 0.0233 0.2513 0.2513 0.4284 0.4284 0.9077 0.9077 1.3255 1.3255 1.6010 1.6010 2.1333 2.1333 2.2195 2.2195 2.5204 2.5204 2.5633 2.5633 2.9533 2.9533 3.1763 3.1763 3.3590 3.3590 3.7347 3.7347 4.1884 4.1884 4.2603 4.2603 4.4957 4.4957 4.5759 4.5759 4.8853 4.8853 5.0562 5.0562 5.3386 5.3386 5.6274 5.6274 6.2847 6.2847 6.3142 6.3142 6.7912 6.7912 6.8658 6.8658 7.3874 7.3874 8.8327 8.8327 k = 0.1984 0.3437 0.3281 ( 6106 PWs) bands (ev): -14.5133 -14.5133 -14.1842 -14.1842 -13.0533 -13.0533 -12.8714 -12.8714 -10.9719 -10.9719 -10.9154 -10.9154 -10.7492 -10.7492 -10.7242 -10.7242 -6.4580 -6.4580 -6.4494 -6.4494 -2.9748 -2.9748 -2.9337 -2.9337 -2.3132 -2.3132 -2.2538 -2.2538 -2.2469 -2.2469 -1.9836 -1.9836 -1.9026 -1.9026 -1.3868 -1.3868 -1.3069 -1.3069 -1.2287 -1.2287 -0.5002 -0.5002 -0.1464 -0.1464 0.0323 0.0323 0.2216 0.2216 0.3931 0.3931 0.8609 0.8609 1.3045 1.3045 1.5591 1.5591 2.1347 2.1347 2.2122 2.2122 2.5118 2.5118 2.5497 2.5497 2.9398 2.9398 3.1638 3.1638 3.3894 3.3894 3.7396 3.7396 4.2116 4.2116 4.3039 4.3039 4.5257 4.5257 4.5844 4.5844 4.9582 4.9582 5.1122 5.1122 5.3344 5.3344 5.6166 5.6166 6.3018 6.3018 6.3357 6.3357 6.8120 6.8120 6.8829 6.8829 7.3522 7.3522 8.8357 8.8357 k = 0.1905 0.3299 0.3281 ( 6098 PWs) bands (ev): -14.5242 -14.5242 -14.1763 -14.1763 -13.0656 -13.0656 -12.8727 -12.8727 -10.9568 -10.9568 -10.9060 -10.9060 -10.7467 -10.7467 -10.7203 -10.7203 -6.4508 -6.4508 -6.4419 -6.4419 -2.9785 -2.9785 -2.9332 -2.9332 -2.3190 -2.3190 -2.2548 -2.2548 -2.2462 -2.2462 -1.9818 -1.9818 -1.9014 -1.9014 -1.3872 -1.3872 -1.3069 -1.3069 -1.2316 -1.2316 -0.5230 -0.5230 -0.1381 -0.1381 0.0410 0.0410 0.1930 0.1930 0.3584 0.3584 0.8147 0.8147 1.2826 1.2826 1.5145 1.5145 2.1354 2.1354 2.2001 2.2001 2.5046 2.5046 2.5358 2.5358 2.9266 2.9266 3.1502 3.1502 3.4205 3.4205 3.7474 3.7474 4.2350 4.2350 4.3485 4.3485 4.5594 4.5594 4.5933 4.5933 5.0317 5.0317 5.1621 5.1621 5.3389 5.3389 5.6082 5.6082 6.3194 6.3194 6.3580 6.3580 6.8300 6.8300 6.8986 6.8986 7.3154 7.3154 8.8381 8.8381 k = 0.1825 0.3162 0.3281 ( 6098 PWs) bands (ev): -14.5349 -14.5349 -14.1686 -14.1686 -13.0779 -13.0779 -12.8742 -12.8742 -10.9410 -10.9410 -10.8963 -10.8963 -10.7443 -10.7443 -10.7165 -10.7165 -6.4432 -6.4432 -6.4340 -6.4340 -2.9824 -2.9824 -2.9329 -2.9329 -2.3252 -2.3252 -2.2561 -2.2561 -2.2454 -2.2454 -1.9800 -1.9800 -1.9004 -1.9004 -1.3874 -1.3874 -1.3077 -1.3077 -1.2341 -1.2341 -0.5457 -0.5457 -0.1305 -0.1305 0.0494 0.0494 0.1655 0.1655 0.3247 0.3247 0.7694 0.7694 1.2596 1.2596 1.4674 1.4674 2.1354 2.1354 2.1852 2.1852 2.4976 2.4976 2.5218 2.5218 2.9135 2.9135 3.1353 3.1353 3.4523 3.4523 3.7578 3.7578 4.2576 4.2576 4.3926 4.3926 4.5972 4.5972 4.6044 4.6044 5.1047 5.1047 5.2033 5.2033 5.3540 5.3540 5.6023 5.6023 6.3378 6.3378 6.3810 6.3810 6.8450 6.8450 6.9131 6.9131 7.2776 7.2776 8.8399 8.8399 k = 0.1746 0.3024 0.3281 ( 6102 PWs) bands (ev): -14.5454 -14.5454 -14.1612 -14.1612 -13.0901 -13.0901 -12.8760 -12.8760 -10.9249 -10.9249 -10.8861 -10.8861 -10.7419 -10.7419 -10.7128 -10.7128 -6.4352 -6.4352 -6.4258 -6.4258 -2.9865 -2.9865 -2.9326 -2.9326 -2.3318 -2.3318 -2.2576 -2.2576 -2.2444 -2.2444 -1.9784 -1.9784 -1.8993 -1.8993 -1.3875 -1.3875 -1.3094 -1.3094 -1.2360 -1.2360 -0.5683 -0.5683 -0.1237 -0.1237 0.0574 0.0574 0.1393 0.1393 0.2921 0.2921 0.7256 0.7256 1.2355 1.2355 1.4181 1.4181 2.1350 2.1350 2.1689 2.1689 2.4900 2.4900 2.5081 2.5081 2.9005 2.9005 3.1193 3.1193 3.4847 3.4847 3.7701 3.7701 4.2789 4.2789 4.4333 4.4333 4.6204 4.6204 4.6397 4.6397 5.1759 5.1759 5.2344 5.2344 5.3804 5.3804 5.5993 5.5993 6.3570 6.3570 6.4046 6.4046 6.8566 6.8566 6.9262 6.9262 7.2395 7.2395 8.8410 8.8410 k = 0.1667 0.2887 0.3281 ( 6098 PWs) bands (ev): -14.5557 -14.5557 -14.1542 -14.1542 -13.1021 -13.1021 -12.8780 -12.8780 -10.9085 -10.9085 -10.8756 -10.8756 -10.7397 -10.7397 -10.7092 -10.7092 -6.4268 -6.4268 -6.4172 -6.4172 -2.9908 -2.9908 -2.9324 -2.9324 -2.3386 -2.3386 -2.2592 -2.2592 -2.2435 -2.2435 -1.9770 -1.9770 -1.8981 -1.8981 -1.3875 -1.3875 -1.3118 -1.3118 -1.2372 -1.2372 -0.5905 -0.5905 -0.1178 -0.1178 0.0649 0.0649 0.1147 0.1147 0.2609 0.2609 0.6834 0.6834 1.2100 1.2100 1.3670 1.3670 2.1340 2.1340 2.1529 2.1529 2.4812 2.4812 2.4950 2.4950 2.8874 2.8874 3.1022 3.1022 3.5175 3.5175 3.7842 3.7842 4.2985 4.2985 4.4669 4.4669 4.6450 4.6450 4.6866 4.6866 5.2441 5.2441 5.2582 5.2582 5.4153 5.4153 5.5994 5.5994 6.3772 6.3772 6.4288 6.4288 6.8643 6.8643 6.9379 6.9379 7.2022 7.2022 8.8413 8.8413 k = 0.1587 0.2749 0.3281 ( 6104 PWs) bands (ev): -14.5658 -14.5658 -14.1474 -14.1474 -13.1139 -13.1139 -12.8801 -12.8801 -10.8919 -10.8919 -10.8649 -10.8649 -10.7375 -10.7375 -10.7057 -10.7057 -6.4182 -6.4182 -6.4085 -6.4085 -2.9952 -2.9952 -2.9322 -2.9322 -2.3456 -2.3456 -2.2609 -2.2609 -2.2425 -2.2425 -1.9761 -1.9761 -1.8969 -1.8969 -1.3875 -1.3875 -1.3151 -1.3151 -1.2377 -1.2377 -0.6123 -0.6123 -0.1130 -0.1130 0.0699 0.0699 0.0936 0.0936 0.2313 0.2313 0.6430 0.6430 1.1834 1.1834 1.3143 1.3143 2.1309 2.1309 2.1396 2.1396 2.4711 2.4711 2.4827 2.4827 2.8741 2.8741 3.0839 3.0839 3.5507 3.5507 3.7994 3.7994 4.3162 4.3162 4.4909 4.4909 4.6805 4.6805 4.7376 4.7376 5.2775 5.2775 5.3086 5.3086 5.4540 5.4540 5.6034 5.6034 6.3988 6.3988 6.4534 6.4534 6.8673 6.8673 6.9483 6.9483 7.1668 7.1668 8.8408 8.8408 k = 0.1508 0.2612 0.3281 ( 6102 PWs) bands (ev): -14.5756 -14.5756 -14.1410 -14.1410 -13.1254 -13.1254 -12.8824 -12.8824 -10.8751 -10.8751 -10.8540 -10.8540 -10.7354 -10.7354 -10.7024 -10.7024 -6.4094 -6.4094 -6.3995 -6.3995 -2.9997 -2.9997 -2.9321 -2.9321 -2.3528 -2.3528 -2.2626 -2.2626 -2.2416 -2.2416 -1.9755 -1.9755 -1.8955 -1.8955 -1.3877 -1.3877 -1.3189 -1.3189 -1.2374 -1.2374 -0.6336 -0.6336 -0.1093 -0.1093 0.0609 0.0609 0.0874 0.0874 0.2034 0.2034 0.6048 0.6048 1.1556 1.1556 1.2602 1.2602 2.1208 2.1208 2.1352 2.1352 2.4599 2.4599 2.4710 2.4710 2.8604 2.8604 3.0644 3.0644 3.5841 3.5841 3.8156 3.8156 4.3319 4.3319 4.5056 4.5056 4.7260 4.7260 4.7920 4.7920 5.2968 5.2968 5.3661 5.3661 5.4931 5.4931 5.6126 5.6126 6.4219 6.4219 6.4779 6.4779 6.8648 6.8648 6.9573 6.9573 7.1348 7.1348 8.8393 8.8393 k = 0.1429 0.2474 0.3281 ( 6106 PWs) bands (ev): -14.5851 -14.5851 -14.1349 -14.1349 -13.1366 -13.1366 -12.8848 -12.8848 -10.8584 -10.8584 -10.8431 -10.8431 -10.7334 -10.7334 -10.6992 -10.6992 -6.4004 -6.4004 -6.3904 -6.3904 -3.0042 -3.0042 -2.9322 -2.9322 -2.3601 -2.3601 -2.2645 -2.2645 -2.2407 -2.2407 -1.9755 -1.9755 -1.8940 -1.8940 -1.3884 -1.3884 -1.3230 -1.3230 -1.2364 -1.2364 -0.6541 -0.6541 -0.1068 -0.1068 0.0413 0.0413 0.0929 0.0929 0.1776 0.1776 0.5687 0.5687 1.1267 1.1267 1.2051 1.2051 2.1096 2.1096 2.1343 2.1343 2.4485 2.4485 2.4596 2.4596 2.8463 2.8463 3.0439 3.0439 3.6176 3.6176 3.8325 3.8325 4.3458 4.3458 4.5137 4.5137 4.7787 4.7787 4.8491 4.8491 5.3171 5.3171 5.4150 5.4150 5.5307 5.5307 5.6285 5.6285 6.4467 6.4467 6.5018 6.5018 6.8564 6.8564 6.9650 6.9650 7.1076 7.1076 8.8369 8.8369 k = 0.1349 0.2337 0.3281 ( 6100 PWs) bands (ev): -14.5943 -14.5943 -14.1292 -14.1292 -13.1474 -13.1474 -12.8873 -12.8873 -10.8418 -10.8418 -10.8321 -10.8321 -10.7315 -10.7315 -10.6962 -10.6962 -6.3913 -6.3913 -6.3813 -6.3813 -3.0088 -3.0088 -2.9323 -2.9323 -2.3674 -2.3674 -2.2663 -2.2663 -2.2399 -2.2399 -1.9761 -1.9761 -1.8924 -1.8924 -1.3897 -1.3897 -1.3269 -1.3269 -1.2347 -1.2347 -0.6737 -0.6737 -0.1054 -0.1054 0.0212 0.0212 0.0996 0.0996 0.1543 0.1543 0.5348 0.5348 1.0965 1.0965 1.1494 1.1494 2.1006 2.1006 2.1344 2.1344 2.4373 2.4373 2.4483 2.4483 2.8318 2.8318 3.0222 3.0222 3.6510 3.6510 3.8497 3.8497 4.3582 4.3582 4.5175 4.5175 4.8357 4.8357 4.9079 4.9079 5.3390 5.3390 5.4532 5.4532 5.5658 5.5658 5.6525 5.6525 6.4736 6.4736 6.5242 6.5242 6.8424 6.8424 6.9714 6.9714 7.0860 7.0860 8.8333 8.8333 k = 0.1270 0.2199 0.3281 ( 6108 PWs) bands (ev): -14.6031 -14.6031 -14.1239 -14.1239 -13.1577 -13.1577 -12.8899 -12.8899 -10.8256 -10.8256 -10.8211 -10.8211 -10.7297 -10.7297 -10.6934 -10.6934 -6.3822 -6.3822 -6.3722 -6.3722 -3.0134 -3.0134 -2.9325 -2.9325 -2.3747 -2.3747 -2.2682 -2.2682 -2.2391 -2.2391 -1.9771 -1.9771 -1.8908 -1.8908 -1.3920 -1.3920 -1.3304 -1.3304 -1.2324 -1.2324 -0.6923 -0.6923 -0.1052 -0.1052 0.0018 0.0018 0.1050 0.1050 0.1350 0.1350 0.5032 0.5032 1.0641 1.0641 1.0945 1.0945 2.0944 2.0944 2.1352 2.1352 2.4265 2.4265 2.4371 2.4371 2.8168 2.8168 2.9994 2.9994 3.6842 3.6842 3.8671 3.8671 4.3691 4.3691 4.5185 4.5185 4.8951 4.8951 4.9674 4.9674 5.3631 5.3631 5.4807 5.4807 5.5979 5.5979 5.6839 5.6839 6.5023 6.5023 6.5436 6.5436 6.8249 6.8249 6.9766 6.9766 7.0697 7.0697 8.8286 8.8286 k = 0.1190 0.2062 0.3281 ( 6118 PWs) bands (ev): -14.6116 -14.6116 -14.1189 -14.1189 -13.1676 -13.1676 -12.8924 -12.8924 -10.8112 -10.8112 -10.8088 -10.8088 -10.7281 -10.7281 -10.6907 -10.6907 -6.3731 -6.3731 -6.3631 -6.3631 -3.0181 -3.0181 -2.9328 -2.9328 -2.3820 -2.3820 -2.2701 -2.2701 -2.2384 -2.2384 -1.9787 -1.9787 -1.8892 -1.8892 -1.3955 -1.3955 -1.3330 -1.3330 -1.2296 -1.2296 -0.7097 -0.7097 -0.1060 -0.1060 -0.0165 -0.0165 0.1024 0.1024 0.1259 0.1259 0.4738 0.4738 1.0233 1.0233 1.0472 1.0472 2.0913 2.0913 2.1369 2.1369 2.4163 2.4163 2.4262 2.4262 2.8013 2.8013 2.9755 2.9755 3.7171 3.7171 3.8844 3.8844 4.3789 4.3789 4.5176 4.5176 4.9554 4.9554 5.0265 5.0265 5.3893 5.3893 5.5000 5.5000 5.6268 5.6268 5.7197 5.7197 6.5324 6.5324 6.5583 6.5583 6.8074 6.8074 6.9805 6.9805 7.0579 7.0579 8.8229 8.8229 k = 0.1111 0.1925 0.3281 ( 6126 PWs) bands (ev): -14.6196 -14.6196 -14.1143 -14.1143 -13.1769 -13.1769 -12.8950 -12.8950 -10.8003 -10.8003 -10.7936 -10.7936 -10.7265 -10.7265 -10.6882 -10.6882 -6.3641 -6.3641 -6.3542 -6.3542 -3.0227 -3.0227 -2.9331 -2.9331 -2.3891 -2.3891 -2.2719 -2.2719 -2.2378 -2.2378 -1.9808 -1.9808 -1.8876 -1.8876 -1.4002 -1.4002 -1.3348 -1.3348 -1.2263 -1.2263 -0.7259 -0.7259 -0.1076 -0.1076 -0.0337 -0.0337 0.0899 0.0899 0.1294 0.1294 0.4466 0.4466 0.9700 0.9700 1.0121 1.0121 2.0913 2.0913 2.1395 2.1395 2.4064 2.4064 2.4159 2.4159 2.7853 2.7853 2.9506 2.9506 3.7495 3.7495 3.9015 3.9015 4.3877 4.3877 4.5154 4.5154 5.0157 5.0157 5.0843 5.0843 5.4178 5.4178 5.5139 5.5139 5.6527 5.6527 5.7566 5.7566 6.5543 6.5543 6.5743 6.5743 6.7948 6.7948 6.9832 6.9832 7.0491 7.0491 8.8159 8.8160 k = 0.1032 0.1787 0.3281 ( 6118 PWs) bands (ev): -14.6272 -14.6272 -14.1100 -14.1100 -13.1857 -13.1857 -12.8975 -12.8975 -10.7901 -10.7901 -10.7787 -10.7787 -10.7251 -10.7251 -10.6859 -10.6859 -6.3553 -6.3553 -6.3455 -6.3455 -3.0271 -3.0271 -2.9334 -2.9334 -2.3959 -2.3959 -2.2737 -2.2737 -2.2371 -2.2371 -1.9831 -1.9831 -1.8861 -1.8861 -1.4060 -1.4060 -1.3356 -1.3356 -1.2226 -1.2226 -0.7406 -0.7406 -0.1101 -0.1101 -0.0499 -0.0499 0.0769 0.0769 0.1360 0.1360 0.4216 0.4216 0.9131 0.9131 0.9808 0.9808 2.0944 2.0944 2.1431 2.1431 2.3970 2.3970 2.4064 2.4064 2.7690 2.7690 2.9248 2.9248 3.7812 3.7812 3.9183 3.9183 4.3958 4.3958 4.5121 4.5121 5.0750 5.0750 5.1398 5.1398 5.4483 5.4483 5.5248 5.5248 5.6759 5.6759 5.7922 5.7922 6.5503 6.5503 6.6066 6.6066 6.7910 6.7910 6.9850 6.9850 7.0422 7.0422 8.8080 8.8080 k = 0.0952 0.1650 0.3281 ( 6108 PWs) bands (ev): -14.6343 -14.6343 -14.1061 -14.1061 -13.1940 -13.1940 -12.8999 -12.8999 -10.7804 -10.7804 -10.7644 -10.7644 -10.7237 -10.7237 -10.6838 -10.6838 -6.3468 -6.3468 -6.3371 -6.3371 -3.0314 -3.0314 -2.9338 -2.9338 -2.4025 -2.4025 -2.2754 -2.2754 -2.2365 -2.2365 -1.9858 -1.9858 -1.8847 -1.8847 -1.4126 -1.4126 -1.3357 -1.3357 -1.2184 -1.2184 -0.7538 -0.7538 -0.1133 -0.1133 -0.0649 -0.0649 0.0660 0.0660 0.1433 0.1433 0.3986 0.3986 0.8557 0.8557 0.9509 0.9509 2.1005 2.1005 2.1478 2.1478 2.3879 2.3879 2.3978 2.3978 2.7525 2.7525 2.8980 2.8980 3.8120 3.8120 3.9345 3.9345 4.4032 4.4032 4.5080 4.5080 5.1328 5.1328 5.1922 5.1922 5.4805 5.4805 5.5342 5.5342 5.6968 5.6968 5.8249 5.8249 6.5319 6.5319 6.6436 6.6436 6.7968 6.7968 6.9858 6.9858 7.0362 7.0362 8.7990 8.7990 k = 0.0873 0.1512 0.3281 ( 6098 PWs) bands (ev): -14.6409 -14.6409 -14.1025 -14.1025 -13.2016 -13.2016 -12.9023 -12.9023 -10.7711 -10.7711 -10.7509 -10.7509 -10.7224 -10.7224 -10.6818 -10.6818 -6.3386 -6.3386 -6.3290 -6.3290 -3.0355 -3.0355 -2.9342 -2.9342 -2.4087 -2.4087 -2.2770 -2.2770 -2.2359 -2.2359 -1.9887 -1.9887 -1.8836 -1.8836 -1.4198 -1.4198 -1.3354 -1.3354 -1.2140 -1.2140 -0.7655 -0.7655 -0.1170 -0.1170 -0.0788 -0.0788 0.0580 0.0580 0.1506 0.1506 0.3777 0.3777 0.7985 0.7985 0.9222 0.9222 2.1094 2.1094 2.1534 2.1534 2.3794 2.3794 2.3902 2.3902 2.7358 2.7358 2.8705 2.8705 3.8418 3.8418 3.9500 3.9500 4.4101 4.4101 4.5032 4.5032 5.1883 5.1883 5.2410 5.2410 5.5132 5.5132 5.5432 5.5432 5.7161 5.7161 5.8541 5.8541 6.5045 6.5045 6.6821 6.6821 6.8097 6.8097 6.9857 6.9857 7.0307 7.0307 8.7891 8.7891 k = 0.0794 0.1375 0.3281 ( 6102 PWs) bands (ev): -14.6470 -14.6470 -14.0993 -14.0993 -13.2086 -13.2086 -12.9045 -12.9045 -10.7623 -10.7623 -10.7384 -10.7384 -10.7210 -10.7210 -10.6800 -10.6800 -6.3308 -6.3308 -6.3214 -6.3214 -3.0394 -3.0394 -2.9347 -2.9347 -2.4146 -2.4146 -2.2787 -2.2787 -2.2355 -2.2355 -1.9918 -1.9918 -1.8826 -1.8826 -1.4273 -1.4273 -1.3349 -1.3349 -1.2094 -1.2094 -0.7757 -0.7757 -0.1212 -0.1212 -0.0915 -0.0915 0.0529 0.0529 0.1579 0.1579 0.3587 0.3587 0.7420 0.7420 0.8948 0.8948 2.1206 2.1206 2.1600 2.1600 2.3717 2.3717 2.3833 2.3833 2.7192 2.7192 2.8423 2.8423 3.8702 3.8702 3.9647 3.9647 4.4165 4.4165 4.4979 4.4979 5.2407 5.2407 5.2857 5.2857 5.5423 5.5423 5.5552 5.5552 5.7350 5.7350 5.8794 5.8794 6.4718 6.4718 6.7214 6.7214 6.8267 6.8267 6.9850 6.9850 7.0254 7.0254 8.7785 8.7785 k = 0.0714 0.1237 0.3281 ( 6106 PWs) bands (ev): -14.6526 -14.6526 -14.0965 -14.0965 -13.2149 -13.2149 -12.9066 -12.9066 -10.7542 -10.7542 -10.7275 -10.7275 -10.7191 -10.7191 -10.6784 -10.6784 -6.3235 -6.3235 -6.3143 -6.3143 -3.0432 -3.0432 -2.9352 -2.9352 -2.4202 -2.4202 -2.2802 -2.2802 -2.2351 -2.2351 -1.9949 -1.9949 -1.8819 -1.8819 -1.4348 -1.4348 -1.3343 -1.3343 -1.2046 -1.2046 -0.7844 -0.7844 -0.1258 -0.1258 -0.1031 -0.1031 0.0509 0.0509 0.1651 0.1651 0.3416 0.3416 0.6866 0.6866 0.8691 0.8691 2.1337 2.1337 2.1675 2.1675 2.3651 2.3651 2.3772 2.3772 2.7028 2.7028 2.8137 2.8137 3.8971 3.8971 3.9784 3.9784 4.4225 4.4225 4.4922 4.4922 5.2894 5.2894 5.3264 5.3264 5.5565 5.5565 5.5799 5.5799 5.7549 5.7549 5.9009 5.9009 6.4364 6.4364 6.7604 6.7604 6.8454 6.8454 6.9838 6.9838 7.0200 7.0200 8.7674 8.7674 k = 0.0635 0.1100 0.3281 ( 6114 PWs) bands (ev): -14.6577 -14.6577 -14.0940 -14.0940 -13.2207 -13.2207 -12.9085 -12.9085 -10.7467 -10.7467 -10.7216 -10.7216 -10.7134 -10.7134 -10.6770 -10.6770 -6.3167 -6.3167 -6.3077 -6.3077 -3.0466 -3.0466 -2.9357 -2.9357 -2.4252 -2.4252 -2.2817 -2.2817 -2.2347 -2.2347 -1.9981 -1.9981 -1.8814 -1.8814 -1.4420 -1.4420 -1.3337 -1.3337 -1.1999 -1.1999 -0.7917 -0.7917 -0.1306 -0.1306 -0.1133 -0.1133 0.0520 0.0520 0.1723 0.1723 0.3263 0.3263 0.6325 0.6325 0.8452 0.8452 2.1481 2.1481 2.1757 2.1757 2.3599 2.3599 2.3718 2.3718 2.6868 2.6868 2.7849 2.7849 3.9223 3.9223 3.9911 3.9911 4.4281 4.4281 4.4862 4.4862 5.3334 5.3334 5.3633 5.3633 5.5662 5.5662 5.6051 5.6051 5.7772 5.7772 5.9188 5.9188 6.4001 6.4001 6.7983 6.7983 6.8643 6.8643 6.9822 6.9822 7.0147 7.0147 8.7560 8.7560 k = 0.0556 0.0962 0.3281 ( 6106 PWs) bands (ev): -14.6622 -14.6622 -14.0917 -14.0917 -13.2257 -13.2257 -12.9102 -12.9102 -10.7400 -10.7400 -10.7199 -10.7199 -10.7046 -10.7046 -10.6758 -10.6758 -6.3106 -6.3106 -6.3017 -6.3017 -3.0497 -3.0497 -2.9361 -2.9361 -2.4297 -2.4297 -2.2829 -2.2829 -2.2344 -2.2344 -2.0011 -2.0011 -1.8811 -1.8811 -1.4488 -1.4488 -1.3332 -1.3332 -1.1953 -1.1953 -0.7976 -0.7976 -0.1357 -0.1357 -0.1221 -0.1221 0.0559 0.0559 0.1798 0.1798 0.3129 0.3129 0.5801 0.5801 0.8235 0.8235 2.1631 2.1631 2.1845 2.1845 2.3561 2.3561 2.3673 2.3673 2.6714 2.6714 2.7562 2.7562 3.9453 3.9453 4.0028 4.0028 4.4333 4.4333 4.4801 4.4801 5.3722 5.3722 5.3966 5.3966 5.5762 5.5762 5.6247 5.6247 5.8031 5.8031 5.9334 5.9334 6.3640 6.3640 6.8341 6.8341 6.8821 6.8821 6.9807 6.9807 7.0097 7.0097 8.7447 8.7447 k = 0.0476 0.0825 0.3281 ( 6108 PWs) bands (ev): -14.6661 -14.6661 -14.0899 -14.0899 -13.2301 -13.2301 -12.9118 -12.9118 -10.7340 -10.7340 -10.7189 -10.7189 -10.6963 -10.6963 -10.6747 -10.6747 -6.3051 -6.3051 -6.2965 -6.2965 -3.0525 -3.0525 -2.9365 -2.9365 -2.4337 -2.4337 -2.2841 -2.2841 -2.2341 -2.2341 -2.0038 -2.0038 -1.8809 -1.8809 -1.4550 -1.4550 -1.3329 -1.3329 -1.1910 -1.1910 -0.8023 -0.8023 -0.1410 -0.1410 -0.1294 -0.1294 0.0623 0.0623 0.1877 0.1877 0.3012 0.3012 0.5298 0.5298 0.8042 0.8042 2.1777 2.1777 2.1936 2.1936 2.3535 2.3535 2.3641 2.3641 2.6570 2.6570 2.7281 2.7281 3.9657 3.9657 4.0135 4.0135 4.4379 4.4379 4.4740 4.4740 5.4050 5.4050 5.4266 5.4266 5.5870 5.5870 5.6379 5.6379 5.8322 5.8322 5.9450 5.9450 6.3290 6.3290 6.8668 6.8668 6.8981 6.8981 6.9795 6.9795 7.0051 7.0051 8.7339 8.7339 k = 0.0397 0.0687 0.3281 ( 6104 PWs) bands (ev): -14.6695 -14.6695 -14.0883 -14.0883 -13.2338 -13.2338 -12.9131 -12.9131 -10.7289 -10.7289 -10.7183 -10.7183 -10.6891 -10.6891 -10.6737 -10.6737 -6.3004 -6.3004 -6.2919 -6.2919 -3.0548 -3.0548 -2.9369 -2.9369 -2.4371 -2.4371 -2.2851 -2.2851 -2.2339 -2.2339 -2.0064 -2.0064 -1.8807 -1.8807 -1.4604 -1.4604 -1.3326 -1.3326 -1.1870 -1.1870 -0.8060 -0.8060 -0.1463 -0.1463 -0.1352 -0.1352 0.0706 0.0706 0.1965 0.1965 0.2914 0.2914 0.4818 0.4818 0.7875 0.7875 2.1910 2.1910 2.2028 2.2028 2.3511 2.3511 2.3636 2.3636 2.6437 2.6437 2.7012 2.7012 3.9833 3.9833 4.0231 4.0231 4.4421 4.4421 4.4683 4.4683 5.4314 5.4314 5.4533 5.4533 5.5986 5.5986 5.6453 5.6453 5.8631 5.8631 5.9540 5.9540 6.2957 6.2957 6.8953 6.8953 6.9117 6.9117 6.9789 6.9789 7.0014 7.0014 8.7238 8.7238 k = 0.0317 0.0550 0.3281 ( 6110 PWs) bands (ev): -14.6722 -14.6722 -14.0870 -14.0870 -13.2369 -13.2369 -12.9142 -12.9142 -10.7247 -10.7247 -10.7178 -10.7178 -10.6831 -10.6831 -10.6729 -10.6729 -6.2965 -6.2965 -6.2881 -6.2881 -3.0568 -3.0568 -2.9372 -2.9372 -2.4399 -2.4399 -2.2859 -2.2859 -2.2337 -2.2337 -2.0085 -2.0085 -1.8808 -1.8808 -1.4651 -1.4651 -1.3325 -1.3325 -1.1836 -1.1836 -0.8087 -0.8087 -0.1511 -0.1511 -0.1396 -0.1396 0.0798 0.0798 0.2068 0.2068 0.2834 0.2834 0.4366 0.4366 0.7736 0.7736 2.2021 2.2021 2.2116 2.2116 2.3483 2.3483 2.3666 2.3666 2.6316 2.6316 2.6765 2.6765 3.9976 3.9976 4.0318 4.0318 4.4456 4.4456 4.4631 4.4631 5.4515 5.4515 5.4767 5.4767 5.6100 5.6100 5.6485 5.6485 5.8937 5.8937 5.9610 5.9610 6.2647 6.2647 6.9179 6.9179 6.9227 6.9227 6.9792 6.9792 6.9993 6.9993 8.7148 8.7148 k = 0.0238 0.0412 0.3281 ( 6110 PWs) bands (ev): -14.6744 -14.6744 -14.0860 -14.0860 -13.2393 -13.2393 -12.9151 -12.9151 -10.7213 -10.7213 -10.7174 -10.7174 -10.6785 -10.6785 -10.6722 -10.6722 -6.2934 -6.2934 -6.2852 -6.2852 -3.0584 -3.0584 -2.9375 -2.9375 -2.4421 -2.4421 -2.2866 -2.2866 -2.2336 -2.2336 -2.0103 -2.0103 -1.8808 -1.8808 -1.4688 -1.4688 -1.3324 -1.3324 -1.1808 -1.1808 -0.8107 -0.8107 -0.1552 -0.1552 -0.1429 -0.1429 0.0890 0.0890 0.2193 0.2193 0.2774 0.2774 0.3946 0.3946 0.7626 0.7626 2.2108 2.2108 2.2193 2.2193 2.3454 2.3454 2.3723 2.3723 2.6207 2.6207 2.6554 2.6554 4.0083 4.0083 4.0393 4.0393 4.4484 4.4484 4.4587 4.4587 5.4659 5.4659 5.4965 5.4965 5.6201 5.6201 5.6492 5.6492 5.9217 5.9217 5.9664 5.9664 6.2370 6.2370 6.9287 6.9287 6.9361 6.9361 6.9803 6.9803 6.9993 6.9993 8.7074 8.7074 k = 0.0159 0.0275 0.3281 ( 6126 PWs) bands (ev): -14.6759 -14.6759 -14.0853 -14.0853 -13.2410 -13.2410 -12.9157 -12.9157 -10.7190 -10.7190 -10.7170 -10.7170 -10.6754 -10.6754 -10.6715 -10.6715 -6.2911 -6.2911 -6.2830 -6.2830 -3.0596 -3.0596 -2.9378 -2.9378 -2.4437 -2.4437 -2.2871 -2.2871 -2.2336 -2.2336 -2.0116 -2.0116 -1.8809 -1.8809 -1.4715 -1.4715 -1.3324 -1.3324 -1.1788 -1.1788 -0.8120 -0.8120 -0.1583 -0.1583 -0.1452 -0.1452 0.0967 0.0967 0.2343 0.2343 0.2740 0.2740 0.3564 0.3564 0.7547 0.7547 2.2170 2.2170 2.2252 2.2252 2.3429 2.3429 2.3789 2.3789 2.6110 2.6110 2.6398 2.6398 4.0156 4.0156 4.0453 4.0453 4.4504 4.4504 4.4555 4.4555 5.4755 5.4755 5.5119 5.5119 5.6271 5.6271 5.6494 5.6494 5.9443 5.9443 5.9711 5.9711 6.2141 6.2141 6.9333 6.9333 6.9463 6.9463 6.9816 6.9816 7.0014 7.0014 8.7018 8.7018 k = 0.0079 0.0137 0.3281 ( 6132 PWs) bands (ev): -14.6768 -14.6768 -14.0849 -14.0849 -13.2420 -13.2420 -12.9161 -12.9161 -10.7177 -10.7177 -10.7167 -10.7167 -10.6739 -10.6739 -10.6707 -10.6707 -6.2898 -6.2898 -6.2817 -6.2817 -3.0603 -3.0603 -2.9380 -2.9380 -2.4447 -2.4447 -2.2874 -2.2874 -2.2336 -2.2336 -2.0125 -2.0125 -1.8809 -1.8809 -1.4732 -1.4732 -1.3324 -1.3324 -1.1775 -1.1775 -0.8127 -0.8127 -0.1601 -0.1601 -0.1466 -0.1466 0.1018 0.1018 0.2494 0.2494 0.2756 0.2756 0.3232 0.3232 0.7499 0.7499 2.2207 2.2207 2.2287 2.2287 2.3412 2.3412 2.3843 2.3843 2.6035 2.6035 2.6308 2.6308 4.0198 4.0198 4.0492 4.0492 4.4512 4.4512 4.4538 4.4538 5.4808 5.4808 5.5219 5.5219 5.6301 5.6301 5.6502 5.6502 5.9574 5.9574 5.9763 5.9763 6.1984 6.1984 6.9356 6.9356 6.9513 6.9513 6.9828 6.9828 7.0040 7.0040 8.6984 8.6984 k = 0.0000 0.0000 0.3281 ( 6140 PWs) bands (ev): -14.6772 -14.6772 -14.0847 -14.0847 -13.2423 -13.2423 -12.9162 -12.9162 -10.7174 -10.7174 -10.7165 -10.7165 -10.6735 -10.6735 -10.6704 -10.6704 -6.2893 -6.2893 -6.2813 -6.2813 -3.0606 -3.0606 -2.9380 -2.9380 -2.4451 -2.4451 -2.2875 -2.2875 -2.2336 -2.2336 -2.0127 -2.0127 -1.8810 -1.8810 -1.4737 -1.4737 -1.3325 -1.3325 -1.1771 -1.1771 -0.8129 -0.8129 -0.1608 -0.1608 -0.1470 -0.1470 0.1036 0.1036 0.2555 0.2555 0.2842 0.2842 0.3029 0.3029 0.7483 0.7483 2.2220 2.2220 2.2299 2.2299 2.3406 2.3406 2.3864 2.3864 2.6006 2.6006 2.6279 2.6279 4.0212 4.0212 4.0506 4.0506 4.4512 4.4512 4.4535 4.4535 5.4826 5.4826 5.5254 5.5254 5.6306 5.6306 5.6507 5.6507 5.9610 5.9610 5.9794 5.9794 6.1927 6.1927 6.9363 6.9363 6.9528 6.9528 6.9832 6.9832 7.0051 7.0051 8.6972 8.6972 k = 0.5000 0.2887 0.3281 ( 6116 PWs) bands (ev): -14.4380 -14.4380 -14.2445 -14.2445 -12.9611 -12.9611 -12.8878 -12.8878 -11.0796 -11.0796 -10.9852 -10.9852 -10.7437 -10.7437 -10.7137 -10.7137 -6.5067 -6.5067 -6.4898 -6.4898 -2.9585 -2.9585 -2.9295 -2.9295 -2.2870 -2.2870 -2.2519 -2.2519 -2.2271 -2.2271 -2.0388 -2.0388 -1.8822 -1.8822 -1.3878 -1.3878 -1.2737 -1.2737 -1.1844 -1.1844 -0.4644 -0.4644 -0.0554 -0.0554 0.0271 0.0271 0.0450 0.0450 0.9522 0.9522 0.9902 0.9902 1.3592 1.3592 1.7517 1.7517 2.2468 2.2468 2.3055 2.3055 2.4774 2.4774 2.6878 2.6878 2.9321 2.9321 3.0192 3.0192 3.6902 3.6902 3.8298 3.8298 4.0285 4.0285 4.1501 4.1501 4.2200 4.2200 4.3650 4.3650 4.6804 4.6804 4.7888 4.7888 5.2221 5.2221 5.7146 5.7146 5.8249 5.8249 5.9501 5.9501 6.9986 6.9986 7.0788 7.0788 7.5758 7.5758 8.6843 8.6843 k = 0.5000 0.2887 0.3125 ( 6122 PWs) bands (ev): -14.4380 -14.4380 -14.2445 -14.2445 -12.9611 -12.9611 -12.8877 -12.8877 -11.0797 -11.0797 -10.9851 -10.9851 -10.7437 -10.7437 -10.7137 -10.7137 -6.5068 -6.5068 -6.4899 -6.4899 -2.9585 -2.9585 -2.9295 -2.9295 -2.2871 -2.2871 -2.2520 -2.2520 -2.2272 -2.2272 -2.0388 -2.0388 -1.8821 -1.8821 -1.3879 -1.3879 -1.2735 -1.2735 -1.1844 -1.1844 -0.4625 -0.4625 -0.0557 -0.0557 0.0265 0.0265 0.0455 0.0455 0.9527 0.9527 0.9892 0.9892 1.3596 1.3596 1.7504 1.7504 2.2475 2.2475 2.3049 2.3049 2.4781 2.4781 2.6885 2.6885 2.9283 2.9283 3.0211 3.0211 3.6900 3.6900 3.8293 3.8293 4.0243 4.0243 4.1477 4.1477 4.2220 4.2220 4.3689 4.3689 4.6807 4.6807 4.7896 4.7896 5.2225 5.2225 5.7144 5.7144 5.8248 5.8248 5.9506 5.9506 6.9986 6.9986 7.0786 7.0786 7.5758 7.5758 8.6856 8.6856 k = 0.5000 0.2887 0.2969 ( 6108 PWs) bands (ev): -14.4380 -14.4380 -14.2445 -14.2445 -12.9613 -12.9613 -12.8874 -12.8874 -11.0800 -11.0800 -10.9848 -10.9848 -10.7437 -10.7437 -10.7137 -10.7137 -6.5070 -6.5070 -6.4901 -6.4901 -2.9585 -2.9585 -2.9295 -2.9295 -2.2872 -2.2872 -2.2521 -2.2521 -2.2273 -2.2273 -2.0390 -2.0390 -1.8815 -1.8815 -1.3882 -1.3882 -1.2728 -1.2728 -1.1842 -1.1842 -0.4569 -0.4569 -0.0566 -0.0566 0.0248 0.0248 0.0468 0.0468 0.9542 0.9542 0.9862 0.9862 1.3606 1.3606 1.7466 1.7466 2.2495 2.2495 2.3029 2.3029 2.4805 2.4805 2.6904 2.6904 2.9179 2.9179 3.0258 3.0258 3.6893 3.6893 3.8278 3.8278 4.0126 4.0126 4.1413 4.1413 4.2274 4.2274 4.3799 4.3799 4.6815 4.6815 4.7918 4.7918 5.2236 5.2236 5.7139 5.7139 5.8244 5.8244 5.9521 5.9521 6.9985 6.9985 7.0777 7.0777 7.5758 7.5758 8.6895 8.6895 k = 0.5000 0.2887 0.2813 ( 6112 PWs) bands (ev): -14.4381 -14.4381 -14.2445 -14.2445 -12.9615 -12.9615 -12.8869 -12.8869 -11.0806 -11.0806 -10.9843 -10.9843 -10.7437 -10.7437 -10.7137 -10.7137 -6.5074 -6.5074 -6.4905 -6.4905 -2.9585 -2.9585 -2.9297 -2.9297 -2.2874 -2.2874 -2.2523 -2.2523 -2.2276 -2.2276 -2.0394 -2.0394 -1.8807 -1.8807 -1.3888 -1.3888 -1.2717 -1.2717 -1.1841 -1.1841 -0.4477 -0.4477 -0.0581 -0.0581 0.0220 0.0220 0.0489 0.0489 0.9567 0.9567 0.9811 0.9811 1.3623 1.3623 1.7404 1.7404 2.2528 2.2528 2.2997 2.2997 2.4842 2.4842 2.6935 2.6935 2.9030 2.9030 3.0315 3.0315 3.6880 3.6880 3.8252 3.8252 3.9946 3.9946 4.1326 4.1326 4.2346 4.2346 4.3965 4.3965 4.6828 4.6828 4.7954 4.7954 5.2256 5.2256 5.7129 5.7129 5.8238 5.8238 5.9547 5.9547 6.9985 6.9985 7.0763 7.0763 7.5758 7.5758 8.6958 8.6959 k = 0.5000 0.2887 0.2656 ( 6110 PWs) bands (ev): -14.4382 -14.4382 -14.2446 -14.2446 -12.9619 -12.9619 -12.8862 -12.8862 -11.0813 -11.0813 -10.9837 -10.9837 -10.7437 -10.7437 -10.7136 -10.7136 -6.5079 -6.5079 -6.4909 -6.4909 -2.9585 -2.9585 -2.9298 -2.9298 -2.2877 -2.2877 -2.2526 -2.2526 -2.2280 -2.2280 -2.0398 -2.0398 -1.8796 -1.8796 -1.3897 -1.3897 -1.2701 -1.2701 -1.1838 -1.1838 -0.4351 -0.4351 -0.0601 -0.0601 0.0182 0.0182 0.0520 0.0520 0.9599 0.9599 0.9744 0.9744 1.3646 1.3646 1.7316 1.7316 2.2573 2.2573 2.2953 2.2953 2.4892 2.4892 2.6977 2.6977 2.8852 2.8852 3.0370 3.0370 3.6861 3.6861 3.8215 3.8215 3.9723 3.9723 4.1232 4.1232 4.2421 4.2421 4.4172 4.4172 4.6847 4.6847 4.8003 4.8003 5.2282 5.2282 5.7117 5.7117 5.8230 5.8230 5.9581 5.9581 6.9984 6.9984 7.0744 7.0744 7.5757 7.5757 8.7047 8.7047 k = 0.5000 0.2887 0.2500 ( 6108 PWs) bands (ev): -14.4383 -14.4383 -14.2447 -14.2447 -12.9623 -12.9623 -12.8854 -12.8854 -11.0823 -11.0823 -10.9829 -10.9829 -10.7437 -10.7437 -10.7136 -10.7136 -6.5086 -6.5086 -6.4914 -6.4914 -2.9586 -2.9586 -2.9300 -2.9300 -2.2881 -2.2881 -2.2530 -2.2530 -2.2284 -2.2284 -2.0405 -2.0405 -1.8781 -1.8781 -1.3907 -1.3907 -1.2679 -1.2679 -1.1834 -1.1834 -0.4195 -0.4195 -0.0626 -0.0626 0.0134 0.0134 0.0559 0.0559 0.9619 0.9619 0.9679 0.9679 1.3677 1.3677 1.7206 1.7206 2.2629 2.2629 2.2901 2.2901 2.4951 2.4951 2.7030 2.7030 2.8656 2.8656 3.0414 3.0414 3.6834 3.6834 3.8164 3.8164 3.9473 3.9473 4.1138 4.1138 4.2495 4.2495 4.4405 4.4405 4.6870 4.6870 4.8064 4.8064 5.2314 5.2314 5.7100 5.7100 5.8220 5.8220 5.9625 5.9625 6.9982 6.9982 7.0720 7.0720 7.5756 7.5756 8.7158 8.7159 k = 0.5000 0.2887 0.2344 ( 6112 PWs) bands (ev): -14.4384 -14.4384 -14.2447 -14.2447 -12.9627 -12.9627 -12.8844 -12.8844 -11.0833 -11.0833 -10.9821 -10.9821 -10.7438 -10.7438 -10.7136 -10.7136 -6.5094 -6.5094 -6.4921 -6.4921 -2.9586 -2.9586 -2.9303 -2.9303 -2.2886 -2.2886 -2.2535 -2.2535 -2.2289 -2.2289 -2.0413 -2.0413 -1.8764 -1.8764 -1.3920 -1.3920 -1.2652 -1.2652 -1.1829 -1.1829 -0.4014 -0.4014 -0.0656 -0.0656 0.0079 0.0079 0.0608 0.0608 0.9539 0.9539 0.9705 0.9705 1.3713 1.3713 1.7074 1.7074 2.2690 2.2690 2.2844 2.2844 2.5015 2.5015 2.7092 2.7092 2.8455 2.8455 3.0445 3.0445 3.6797 3.6797 3.8101 3.8101 3.9209 3.9209 4.1052 4.1052 4.2561 4.2561 4.4652 4.4652 4.6897 4.6897 4.8134 4.8134 5.2351 5.2351 5.7081 5.7081 5.8209 5.8209 5.9675 5.9675 6.9979 6.9979 7.0693 7.0693 7.5755 7.5755 8.7290 8.7290 k = 0.5000 0.2887 0.2188 ( 6104 PWs) bands (ev): -14.4385 -14.4385 -14.2448 -14.2448 -12.9633 -12.9633 -12.8833 -12.8833 -11.0845 -11.0845 -10.9811 -10.9811 -10.7438 -10.7438 -10.7136 -10.7136 -6.5103 -6.5103 -6.4928 -6.4928 -2.9586 -2.9586 -2.9305 -2.9305 -2.2891 -2.2891 -2.2540 -2.2540 -2.2295 -2.2295 -2.0422 -2.0422 -1.8744 -1.8744 -1.3934 -1.3934 -1.2620 -1.2620 -1.1822 -1.1822 -0.3810 -0.3810 -0.0689 -0.0689 0.0016 0.0016 0.0667 0.0667 0.9421 0.9421 0.9760 0.9760 1.3756 1.3756 1.6922 1.6922 2.2720 2.2720 2.2821 2.2821 2.5081 2.5081 2.7163 2.7163 2.8256 2.8256 3.0460 3.0460 3.6748 3.6748 3.8024 3.8024 3.8942 3.8942 4.0977 4.0977 4.2619 4.2619 4.4905 4.4905 4.6928 4.6928 4.8213 4.8213 5.2393 5.2393 5.7058 5.7058 5.8197 5.8197 5.9732 5.9732 6.9975 6.9975 7.0662 7.0662 7.5755 7.5755 8.7440 8.7441 k = 0.5000 0.2887 0.2031 ( 6106 PWs) bands (ev): -14.4386 -14.4386 -14.2449 -14.2449 -12.9638 -12.9638 -12.8822 -12.8822 -11.0858 -11.0858 -10.9800 -10.9800 -10.7438 -10.7438 -10.7136 -10.7136 -6.5113 -6.5113 -6.4935 -6.4935 -2.9587 -2.9587 -2.9308 -2.9308 -2.2897 -2.2897 -2.2546 -2.2546 -2.2301 -2.2301 -2.0433 -2.0433 -1.8722 -1.8722 -1.3950 -1.3950 -1.2583 -1.2583 -1.1813 -1.1813 -0.3591 -0.3591 -0.0726 -0.0726 -0.0051 -0.0051 0.0738 0.0738 0.9288 0.9288 0.9821 0.9821 1.3804 1.3804 1.6752 1.6752 2.2666 2.2666 2.2884 2.2884 2.5140 2.5140 2.7239 2.7239 2.8071 2.8071 3.0459 3.0459 3.6684 3.6684 3.7933 3.7933 3.8684 3.8684 4.0917 4.0917 4.2666 4.2666 4.5157 4.5157 4.6961 4.6961 4.8298 4.8298 5.2438 5.2438 5.7033 5.7033 5.8184 5.8184 5.9794 5.9794 6.9968 6.9968 7.0630 7.0630 7.5754 7.5754 8.7606 8.7606 k = 0.5000 0.2887 0.1875 ( 6102 PWs) bands (ev): -14.4388 -14.4388 -14.2450 -14.2450 -12.9644 -12.9644 -12.8809 -12.8809 -11.0871 -11.0871 -10.9790 -10.9790 -10.7438 -10.7438 -10.7136 -10.7136 -6.5124 -6.5124 -6.4942 -6.4942 -2.9587 -2.9587 -2.9311 -2.9311 -2.2903 -2.2903 -2.2552 -2.2552 -2.2306 -2.2306 -2.0445 -2.0445 -1.8698 -1.8698 -1.3966 -1.3966 -1.2542 -1.2542 -1.1803 -1.1803 -0.3361 -0.3361 -0.0765 -0.0765 -0.0123 -0.0123 0.0820 0.0820 0.9144 0.9144 0.9886 0.9886 1.3857 1.3857 1.6568 1.6568 2.2588 2.2588 2.2972 2.2972 2.5187 2.5187 2.7321 2.7321 2.7910 2.7910 3.0441 3.0441 3.6600 3.6600 3.7831 3.7831 3.8443 3.8443 4.0871 4.0871 4.2704 4.2704 4.5403 4.5403 4.6997 4.6997 4.8388 4.8388 5.2484 5.2484 5.7005 5.7005 5.8171 5.8171 5.9860 5.9860 6.9960 6.9960 7.0598 7.0598 7.5753 7.5753 8.7783 8.7784 k = 0.5000 0.2887 0.1719 ( 6108 PWs) bands (ev): -14.4390 -14.4390 -14.2451 -14.2451 -12.9649 -12.9649 -12.8797 -12.8797 -11.0884 -11.0884 -10.9779 -10.9779 -10.7438 -10.7438 -10.7136 -10.7136 -6.5135 -6.5135 -6.4950 -6.4950 -2.9588 -2.9588 -2.9314 -2.9314 -2.2911 -2.2911 -2.2559 -2.2559 -2.2313 -2.2313 -2.0459 -2.0459 -1.8673 -1.8673 -1.3983 -1.3983 -1.2498 -1.2498 -1.1791 -1.1791 -0.3127 -0.3127 -0.0807 -0.0807 -0.0197 -0.0197 0.0914 0.0914 0.8990 0.8990 0.9954 0.9954 1.3912 1.3912 1.6372 1.6372 2.2506 2.2506 2.3067 2.3067 2.5212 2.5212 2.7406 2.7406 2.7785 2.7785 3.0406 3.0406 3.6495 3.6495 3.7718 3.7718 3.8228 3.8228 4.0840 4.0840 4.2732 4.2732 4.5641 4.5641 4.7034 4.7034 4.8478 4.8478 5.2532 5.2532 5.6976 5.6976 5.8159 5.8159 5.9929 5.9929 6.9949 6.9949 7.0565 7.0565 7.5752 7.5752 8.7968 8.7968 k = 0.5000 0.2887 0.1563 ( 6102 PWs) bands (ev): -14.4391 -14.4391 -14.2452 -14.2452 -12.9655 -12.9655 -12.8784 -12.8784 -11.0897 -11.0897 -10.9768 -10.9768 -10.7438 -10.7438 -10.7136 -10.7136 -6.5147 -6.5147 -6.4957 -6.4957 -2.9588 -2.9588 -2.9317 -2.9317 -2.2918 -2.2918 -2.2565 -2.2565 -2.2318 -2.2318 -2.0472 -2.0472 -1.8647 -1.8647 -1.3999 -1.3999 -1.2451 -1.2451 -1.1777 -1.1777 -0.2894 -0.2894 -0.0849 -0.0849 -0.0270 -0.0270 0.1021 0.1021 0.8830 0.8830 1.0023 1.0023 1.3970 1.3970 1.6168 1.6168 2.2421 2.2421 2.3167 2.3167 2.5208 2.5208 2.7491 2.7491 2.7705 2.7705 3.0355 3.0355 3.6368 3.6368 3.7599 3.7599 3.8044 3.8044 4.0823 4.0823 4.2751 4.2751 4.5866 4.5866 4.7071 4.7071 4.8569 4.8569 5.2580 5.2580 5.6944 5.6944 5.8147 5.8147 5.9999 5.9999 6.9935 6.9935 7.0535 7.0535 7.5751 7.5751 8.8156 8.8156 k = 0.5000 0.2887 0.1406 ( 6108 PWs) bands (ev): -14.4393 -14.4393 -14.2453 -14.2453 -12.9660 -12.9660 -12.8772 -12.8772 -11.0910 -11.0910 -10.9758 -10.9758 -10.7439 -10.7439 -10.7135 -10.7135 -6.5159 -6.5159 -6.4964 -6.4964 -2.9589 -2.9589 -2.9321 -2.9321 -2.2926 -2.2926 -2.2572 -2.2572 -2.2324 -2.2324 -2.0487 -2.0487 -1.8622 -1.8622 -1.4015 -1.4015 -1.2405 -1.2405 -1.1761 -1.1761 -0.2668 -0.2668 -0.0892 -0.0892 -0.0343 -0.0343 0.1141 0.1141 0.8665 0.8665 1.0091 1.0091 1.4028 1.4028 1.5962 1.5962 2.2338 2.2338 2.3267 2.3267 2.5173 2.5173 2.7572 2.7572 2.7681 2.7681 3.0289 3.0289 3.6220 3.6220 3.7477 3.7477 3.7892 3.7892 4.0818 4.0818 4.2763 4.2763 4.6077 4.6077 4.7107 4.7107 4.8658 4.8658 5.2627 5.2627 5.6913 5.6913 5.8135 5.8135 6.0069 6.0069 6.9918 6.9918 7.0507 7.0507 7.5750 7.5750 8.8341 8.8341 k = 0.5000 0.2887 0.1250 ( 6104 PWs) bands (ev): -14.4394 -14.4394 -14.2453 -14.2453 -12.9665 -12.9665 -12.8761 -12.8761 -11.0922 -11.0922 -10.9748 -10.9748 -10.7439 -10.7439 -10.7135 -10.7135 -6.5170 -6.5170 -6.4971 -6.4971 -2.9590 -2.9590 -2.9324 -2.9324 -2.2933 -2.2933 -2.2578 -2.2578 -2.2329 -2.2329 -2.0501 -2.0501 -1.8596 -1.8596 -1.4029 -1.4029 -1.2360 -1.2360 -1.1744 -1.1744 -0.2456 -0.2456 -0.0935 -0.0935 -0.0413 -0.0413 0.1272 0.1272 0.8499 0.8499 1.0156 1.0156 1.4085 1.4085 1.5757 1.5757 2.2257 2.2257 2.3368 2.3368 2.5106 2.5106 2.7644 2.7644 2.7714 2.7714 3.0206 3.0206 3.6059 3.6059 3.7355 3.7355 3.7772 3.7772 4.0822 4.0822 4.2767 4.2767 4.6272 4.6272 4.7142 4.7142 4.8742 4.8742 5.2672 5.2672 5.6881 5.6881 5.8124 5.8124 6.0137 6.0137 6.9898 6.9898 7.0482 7.0482 7.5749 7.5749 8.8521 8.8521 k = 0.5000 0.2887 0.1094 ( 6106 PWs) bands (ev): -14.4396 -14.4396 -14.2454 -14.2454 -12.9669 -12.9669 -12.8750 -12.8750 -11.0933 -11.0933 -10.9739 -10.9739 -10.7439 -10.7439 -10.7135 -10.7135 -6.5182 -6.5182 -6.4977 -6.4977 -2.9590 -2.9590 -2.9327 -2.9327 -2.2940 -2.2940 -2.2584 -2.2584 -2.2333 -2.2333 -2.0514 -2.0514 -1.8573 -1.8573 -1.4042 -1.4042 -1.2317 -1.2317 -1.1726 -1.1726 -0.2262 -0.2262 -0.0976 -0.0976 -0.0478 -0.0478 0.1413 0.1413 0.8335 0.8335 1.0218 1.0218 1.4139 1.4139 1.5560 1.5560 2.2181 2.2181 2.3468 2.3468 2.5014 2.5014 2.7719 2.7719 2.7786 2.7786 3.0109 3.0109 3.5892 3.5892 3.7236 3.7236 3.7679 3.7679 4.0833 4.0833 4.2767 4.2767 4.6450 4.6450 4.7173 4.7173 4.8821 4.8821 5.2715 5.2715 5.6849 5.6849 5.8115 5.8115 6.0201 6.0201 6.9876 6.9876 7.0462 7.0462 7.5749 7.5749 8.8689 8.8690 k = 0.5000 0.2887 0.0938 ( 6098 PWs) bands (ev): -14.4397 -14.4397 -14.2455 -14.2455 -12.9673 -12.9673 -12.8740 -12.8740 -11.0944 -11.0944 -10.9731 -10.9731 -10.7439 -10.7439 -10.7135 -10.7135 -6.5192 -6.5192 -6.4983 -6.4983 -2.9591 -2.9591 -2.9329 -2.9329 -2.2947 -2.2947 -2.2589 -2.2589 -2.2337 -2.2337 -2.0526 -2.0526 -1.8550 -1.8550 -1.4053 -1.4053 -1.2278 -1.2278 -1.1707 -1.1707 -0.2090 -0.2090 -0.1014 -0.1014 -0.0537 -0.0537 0.1559 0.1559 0.8177 0.8177 1.0275 1.0275 1.4188 1.4188 1.5376 1.5376 2.2112 2.2112 2.3566 2.3566 2.4906 2.4906 2.7806 2.7806 2.7878 2.7878 2.9997 2.9997 3.5730 3.5730 3.7126 3.7126 3.7607 3.7607 4.0849 4.0849 4.2762 4.2762 4.6608 4.6608 4.7200 4.7200 4.8892 4.8892 5.2754 5.2754 5.6820 5.6820 5.8106 5.8106 6.0261 6.0261 6.9854 6.9854 7.0445 7.0445 7.5748 7.5748 8.8844 8.8844 k = 0.5000 0.2887 0.0781 ( 6088 PWs) bands (ev): -14.4398 -14.4398 -14.2456 -14.2456 -12.9676 -12.9676 -12.8732 -12.8732 -11.0952 -11.0952 -10.9724 -10.9724 -10.7439 -10.7439 -10.7135 -10.7135 -6.5201 -6.5201 -6.4987 -6.4987 -2.9591 -2.9591 -2.9331 -2.9331 -2.2953 -2.2953 -2.2593 -2.2593 -2.2340 -2.2340 -2.0537 -2.0537 -1.8530 -1.8530 -1.4063 -1.4063 -1.2243 -1.2243 -1.1689 -1.1689 -0.1942 -0.1942 -0.1050 -0.1050 -0.0589 -0.0589 0.1705 0.1705 0.8029 0.8029 1.0325 1.0325 1.4231 1.4231 1.5210 1.5210 2.2050 2.2050 2.3660 2.3660 2.4790 2.4790 2.7886 2.7886 2.7997 2.7997 2.9873 2.9873 3.5579 3.5579 3.7026 3.7026 3.7553 3.7553 4.0867 4.0867 4.2755 4.2755 4.6747 4.6747 4.7222 4.7222 4.8955 4.8955 5.2789 5.2789 5.6793 5.6793 5.8098 5.8098 6.0315 6.0315 6.9832 6.9832 7.0431 7.0431 7.5748 7.5748 8.8980 8.8980 k = 0.5000 0.2887 0.0625 ( 6084 PWs) bands (ev): -14.4399 -14.4399 -14.2456 -14.2456 -12.9679 -12.9679 -12.8724 -12.8724 -11.0960 -11.0960 -10.9718 -10.9718 -10.7439 -10.7439 -10.7135 -10.7135 -6.5209 -6.5209 -6.4991 -6.4991 -2.9591 -2.9591 -2.9333 -2.9333 -2.2958 -2.2958 -2.2597 -2.2597 -2.2342 -2.2342 -2.0547 -2.0547 -1.8513 -1.8513 -1.4071 -1.4071 -1.2214 -1.2214 -1.1672 -1.1672 -0.1821 -0.1821 -0.1081 -0.1081 -0.0633 -0.0633 0.1842 0.1842 0.7896 0.7896 1.0368 1.0368 1.4265 1.4265 1.5069 1.5069 2.1997 2.1997 2.3752 2.3752 2.4672 2.4672 2.7950 2.7950 2.8139 2.8139 2.9738 2.9738 3.5447 3.5447 3.6940 3.6940 3.7512 3.7512 4.0885 4.0885 4.2747 4.2747 4.6866 4.6866 4.7236 4.7236 4.9007 4.9007 5.2819 5.2819 5.6769 5.6769 5.8092 5.8092 6.0361 6.0361 6.9812 6.9812 7.0421 7.0421 7.5748 7.5748 8.9095 8.9095 k = 0.5000 0.2887 0.0469 ( 6088 PWs) bands (ev): -14.4400 -14.4400 -14.2457 -14.2457 -12.9682 -12.9682 -12.8719 -12.8719 -11.0966 -11.0966 -10.9713 -10.9713 -10.7439 -10.7439 -10.7135 -10.7135 -6.5216 -6.5216 -6.4995 -6.4995 -2.9592 -2.9592 -2.9334 -2.9334 -2.2963 -2.2963 -2.2601 -2.2601 -2.2344 -2.2344 -2.0555 -2.0555 -1.8499 -1.8499 -1.4077 -1.4077 -1.2192 -1.2192 -1.1658 -1.1658 -0.1727 -0.1727 -0.1106 -0.1106 -0.0668 -0.0668 0.1963 0.1963 0.7784 0.7784 1.0403 1.0403 1.4289 1.4289 1.4956 1.4956 2.1955 2.1955 2.3839 2.3839 2.4560 2.4560 2.7999 2.7999 2.8292 2.8292 2.9599 2.9599 3.5339 3.5339 3.6871 3.6871 3.7483 3.7483 4.0901 4.0901 4.2739 4.2739 4.6964 4.6964 4.7243 4.7243 4.9049 4.9049 5.2843 5.2843 5.6750 5.6750 5.8087 5.8087 6.0398 6.0398 6.9794 6.9794 7.0414 7.0414 7.5747 7.5747 8.9187 8.9187 k = 0.5000 0.2887 0.0313 ( 6084 PWs) bands (ev): -14.4400 -14.4400 -14.2457 -14.2457 -12.9683 -12.9683 -12.8714 -12.8714 -11.0970 -11.0970 -10.9709 -10.9709 -10.7440 -10.7440 -10.7135 -10.7135 -6.5220 -6.5220 -6.4997 -6.4997 -2.9592 -2.9592 -2.9335 -2.9335 -2.2966 -2.2966 -2.2603 -2.2603 -2.2346 -2.2346 -2.0561 -2.0561 -1.8489 -1.8489 -1.4081 -1.4081 -1.2175 -1.2175 -1.1647 -1.1647 -0.1659 -0.1659 -0.1125 -0.1125 -0.0693 -0.0693 0.2057 0.2057 0.7698 0.7698 1.0428 1.0428 1.4304 1.4304 1.4877 1.4877 2.1924 2.1924 2.3919 2.3919 2.4460 2.4460 2.8036 2.8036 2.8440 2.8440 2.9463 2.9463 3.5259 3.5259 3.6819 3.6819 3.7463 3.7463 4.0914 4.0914 4.2733 4.2733 4.7041 4.7041 4.7242 4.7242 4.9079 4.9079 5.2861 5.2861 5.6735 5.6735 5.8084 5.8084 6.0425 6.0425 6.9781 6.9781 7.0409 7.0409 7.5747 7.5747 8.9254 8.9254 k = 0.5000 0.2887 0.0156 ( 6088 PWs) bands (ev): -14.4401 -14.4401 -14.2457 -14.2457 -12.9684 -12.9684 -12.8712 -12.8712 -11.0973 -11.0973 -10.9707 -10.9707 -10.7440 -10.7440 -10.7135 -10.7135 -6.5223 -6.5223 -6.4998 -6.4998 -2.9592 -2.9592 -2.9336 -2.9336 -2.2968 -2.2968 -2.2604 -2.2604 -2.2347 -2.2347 -2.0565 -2.0565 -1.8483 -1.8483 -1.4084 -1.4084 -1.2165 -1.2165 -1.1640 -1.1640 -0.1619 -0.1619 -0.1137 -0.1137 -0.0709 -0.0709 0.2117 0.2117 0.7644 0.7644 1.0443 1.0443 1.4311 1.4311 1.4829 1.4829 2.1906 2.1906 2.3983 2.3983 2.4383 2.4383 2.8057 2.8057 2.8560 2.8560 2.9352 2.9352 3.5210 3.5210 3.6788 3.6788 3.7451 3.7451 4.0922 4.0922 4.2729 4.2729 4.7094 4.7094 4.7235 4.7235 4.9098 4.9098 5.2871 5.2871 5.6726 5.6726 5.8081 5.8081 6.0442 6.0442 6.9772 6.9772 7.0406 7.0406 7.5747 7.5747 8.9294 8.9294 k = 0.5000 0.2887-0.0000 ( 6092 PWs) bands (ev): -14.4401 -14.4401 -14.2457 -14.2457 -12.9685 -12.9685 -12.8711 -12.8711 -11.0974 -11.0974 -10.9707 -10.9707 -10.7440 -10.7440 -10.7135 -10.7135 -6.5224 -6.5224 -6.4999 -6.4999 -2.9592 -2.9592 -2.9337 -2.9337 -2.2969 -2.2969 -2.2605 -2.2605 -2.2347 -2.2347 -2.0566 -2.0566 -1.8481 -1.8481 -1.4085 -1.4085 -1.2162 -1.2162 -1.1637 -1.1637 -0.1606 -0.1606 -0.1141 -0.1141 -0.0714 -0.0714 0.2138 0.2138 0.7625 0.7625 1.0448 1.0448 1.4313 1.4313 1.4814 1.4814 2.1899 2.1899 2.4011 2.4011 2.4351 2.4351 2.8065 2.8065 2.8609 2.8609 2.9306 2.9306 3.5193 3.5193 3.6777 3.6777 3.7447 3.7447 4.0925 4.0925 4.2727 4.2727 4.7114 4.7114 4.7230 4.7230 4.9104 4.9104 5.2875 5.2875 5.6723 5.6723 5.8081 5.8081 6.0447 6.0447 6.9770 6.9770 7.0405 7.0405 7.5747 7.5747 8.9308 8.9308 k = 0.3333 0.5774-0.0000 ( 6060 PWs) bands (ev): -14.3385 -14.3385 -14.3382 -14.3382 -12.8964 -12.8964 -12.8955 -12.8955 -11.1146 -11.1146 -10.9663 -10.9663 -10.7785 -10.7785 -10.7766 -10.7766 -6.5259 -6.5259 -6.5257 -6.5257 -2.9458 -2.9458 -2.9424 -2.9424 -2.2820 -2.2820 -2.2555 -2.2555 -2.2460 -2.2460 -1.9724 -1.9724 -1.9011 -1.9011 -1.3717 -1.3717 -1.2974 -1.2974 -1.1630 -1.1630 -0.2705 -0.2705 -0.1297 -0.1297 -0.1189 -0.1189 0.7989 0.7989 0.8087 0.8087 1.3152 1.3152 1.6530 1.6530 1.6662 1.6662 1.7523 1.7523 2.1979 2.1979 2.7059 2.7059 2.7668 2.7668 2.7697 2.7697 3.1678 3.1678 3.1826 3.1826 3.5483 3.5483 3.8484 3.8484 3.8656 3.8656 4.1690 4.1690 4.4272 4.4272 4.6562 4.6562 4.6598 4.6598 5.9173 5.9173 5.9181 5.9181 6.1513 6.1513 6.1650 6.1650 6.1868 6.1868 6.5395 6.5395 7.6175 7.6175 9.0134 9.0143 k = 0.3333 0.5774 0.0156 ( 6060 PWs) bands (ev): -14.3385 -14.3385 -14.3381 -14.3381 -12.8964 -12.8964 -12.8955 -12.8955 -11.1145 -11.1145 -10.9663 -10.9663 -10.7785 -10.7785 -10.7766 -10.7766 -6.5258 -6.5258 -6.5256 -6.5256 -2.9458 -2.9458 -2.9424 -2.9424 -2.2819 -2.2819 -2.2555 -2.2555 -2.2460 -2.2460 -1.9724 -1.9724 -1.9013 -1.9013 -1.3716 -1.3716 -1.2976 -1.2976 -1.1633 -1.1633 -0.2704 -0.2704 -0.1298 -0.1298 -0.1194 -0.1194 0.7986 0.7986 0.8083 0.8083 1.3147 1.3147 1.6536 1.6536 1.6669 1.6669 1.7527 1.7527 2.1969 2.1969 2.7068 2.7068 2.7673 2.7673 2.7703 2.7703 3.1681 3.1681 3.1828 3.1828 3.5498 3.5498 3.8491 3.8491 3.8663 3.8663 4.1683 4.1683 4.4261 4.4261 4.6554 4.6554 4.6590 4.6590 5.9172 5.9172 5.9180 5.9180 6.1513 6.1513 6.1653 6.1653 6.1868 6.1868 6.5396 6.5396 7.6175 7.6175 9.0120 9.0122 k = 0.3333 0.5774 0.0313 ( 6063 PWs) bands (ev): -14.3384 -14.3384 -14.3381 -14.3381 -12.8965 -12.8965 -12.8956 -12.8956 -11.1142 -11.1142 -10.9666 -10.9666 -10.7785 -10.7785 -10.7766 -10.7766 -6.5256 -6.5256 -6.5253 -6.5253 -2.9458 -2.9458 -2.9424 -2.9424 -2.2818 -2.2818 -2.2556 -2.2556 -2.2460 -2.2460 -1.9724 -1.9724 -1.9019 -1.9019 -1.3714 -1.3714 -1.2982 -1.2982 -1.1642 -1.1642 -0.2701 -0.2701 -0.1300 -0.1300 -0.1206 -0.1206 0.7975 0.7975 0.8073 0.8073 1.3132 1.3132 1.6555 1.6555 1.6688 1.6688 1.7540 1.7540 2.1939 2.1939 2.7095 2.7095 2.7689 2.7689 2.7719 2.7719 3.1687 3.1687 3.1835 3.1835 3.5542 3.5542 3.8512 3.8512 3.8683 3.8683 4.1660 4.1660 4.4228 4.4228 4.6532 4.6532 4.6567 4.6567 5.9168 5.9168 5.9176 5.9176 6.1513 6.1513 6.1663 6.1663 6.1868 6.1868 6.5397 6.5397 7.6175 7.6175 9.0080 9.0094 k = 0.3333 0.5774 0.0469 ( 6066 PWs) bands (ev): -14.3384 -14.3384 -14.3381 -14.3381 -12.8965 -12.8965 -12.8956 -12.8956 -11.1138 -11.1138 -10.9671 -10.9671 -10.7785 -10.7785 -10.7766 -10.7766 -6.5251 -6.5251 -6.5248 -6.5248 -2.9458 -2.9458 -2.9424 -2.9424 -2.2815 -2.2815 -2.2558 -2.2558 -2.2459 -2.2459 -1.9723 -1.9723 -1.9029 -1.9029 -1.3711 -1.3711 -1.2991 -1.2991 -1.1658 -1.1658 -0.2695 -0.2695 -0.1305 -0.1305 -0.1227 -0.1227 0.7957 0.7957 0.8057 0.8057 1.3107 1.3107 1.6586 1.6586 1.6719 1.6719 1.7560 1.7560 2.1890 2.1890 2.7139 2.7139 2.7713 2.7713 2.7745 2.7745 3.1699 3.1699 3.1847 3.1847 3.5615 3.5615 3.8547 3.8547 3.8716 3.8716 4.1623 4.1623 4.4174 4.4174 4.6494 4.6494 4.6529 4.6529 5.9161 5.9161 5.9169 5.9169 6.1513 6.1513 6.1678 6.1678 6.1867 6.1867 6.5401 6.5401 7.6175 7.6175 9.0001 9.0022 k = 0.3333 0.5774 0.0625 ( 6066 PWs) bands (ev): -14.3383 -14.3383 -14.3380 -14.3380 -12.8967 -12.8967 -12.8958 -12.8958 -11.1132 -11.1132 -10.9677 -10.9677 -10.7786 -10.7786 -10.7766 -10.7766 -6.5245 -6.5245 -6.5242 -6.5242 -2.9457 -2.9457 -2.9424 -2.9424 -2.2812 -2.2812 -2.2559 -2.2559 -2.2458 -2.2458 -1.9723 -1.9723 -1.9042 -1.9042 -1.3707 -1.3707 -1.3005 -1.3005 -1.1678 -1.1678 -0.2688 -0.2688 -0.1311 -0.1311 -0.1255 -0.1255 0.7934 0.7934 0.8034 0.8034 1.3073 1.3073 1.6628 1.6628 1.6762 1.6762 1.7588 1.7588 2.1824 2.1824 2.7200 2.7200 2.7745 2.7745 2.7779 2.7779 3.1718 3.1718 3.1865 3.1865 3.5715 3.5715 3.8595 3.8595 3.8761 3.8761 4.1572 4.1572 4.4099 4.4099 4.6442 4.6442 4.6475 4.6475 5.9152 5.9152 5.9161 5.9161 6.1513 6.1513 6.1699 6.1699 6.1866 6.1866 6.5405 6.5405 7.6176 7.6176 8.9899 8.9939 k = 0.3333 0.5774 0.0781 ( 6084 PWs) bands (ev): -14.3383 -14.3383 -14.3380 -14.3380 -12.8968 -12.8968 -12.8959 -12.8959 -11.1125 -11.1125 -10.9684 -10.9684 -10.7786 -10.7786 -10.7766 -10.7766 -6.5237 -6.5237 -6.5234 -6.5234 -2.9457 -2.9457 -2.9425 -2.9425 -2.2808 -2.2808 -2.2563 -2.2563 -2.2458 -2.2458 -1.9723 -1.9723 -1.9060 -1.9060 -1.3701 -1.3701 -1.3023 -1.3023 -1.1703 -1.1703 -0.2679 -0.2679 -0.1318 -0.1318 -0.1289 -0.1289 0.7904 0.7904 0.8006 0.8006 1.3032 1.3032 1.6681 1.6681 1.6815 1.6815 1.7622 1.7622 2.1742 2.1742 2.7274 2.7274 2.7783 2.7783 2.7819 2.7819 3.1743 3.1743 3.1890 3.1890 3.5842 3.5842 3.8655 3.8655 3.8819 3.8819 4.1508 4.1508 4.4003 4.4003 4.6376 4.6376 4.6407 4.6407 5.9141 5.9141 5.9150 5.9150 6.1513 6.1513 6.1724 6.1724 6.1864 6.1864 6.5411 6.5411 7.6176 7.6176 8.9778 8.9817 k = 0.3333 0.5774 0.0938 ( 6078 PWs) bands (ev): -14.3382 -14.3382 -14.3379 -14.3379 -12.8970 -12.8970 -12.8961 -12.8961 -11.1116 -11.1116 -10.9694 -10.9694 -10.7786 -10.7786 -10.7766 -10.7766 -6.5227 -6.5227 -6.5225 -6.5225 -2.9456 -2.9456 -2.9425 -2.9425 -2.2803 -2.2803 -2.2565 -2.2565 -2.2457 -2.2457 -1.9722 -1.9722 -1.9079 -1.9079 -1.3694 -1.3694 -1.3044 -1.3044 -1.1730 -1.1730 -0.2668 -0.2668 -0.1330 -0.1330 -0.1327 -0.1327 0.7870 0.7870 0.7974 0.7974 1.2984 1.2984 1.6743 1.6743 1.6877 1.6877 1.7662 1.7662 2.1648 2.1648 2.7360 2.7360 2.7823 2.7823 2.7862 2.7862 3.1776 3.1776 3.1923 3.1923 3.5993 3.5993 3.8728 3.8728 3.8888 3.8888 4.1431 4.1431 4.3889 4.3889 4.6296 4.6296 4.6325 4.6325 5.9128 5.9128 5.9137 5.9137 6.1512 6.1512 6.1754 6.1754 6.1862 6.1862 6.5417 6.5417 7.6177 7.6177 8.9630 8.9639 k = 0.3333 0.5774 0.1094 ( 6072 PWs) bands (ev): -14.3381 -14.3381 -14.3378 -14.3378 -12.8972 -12.8972 -12.8963 -12.8963 -11.1107 -11.1107 -10.9704 -10.9704 -10.7786 -10.7786 -10.7766 -10.7766 -6.5217 -6.5217 -6.5215 -6.5215 -2.9455 -2.9455 -2.9425 -2.9425 -2.2797 -2.2797 -2.2567 -2.2567 -2.2456 -2.2456 -1.9720 -1.9720 -1.9101 -1.9101 -1.3686 -1.3686 -1.3069 -1.3069 -1.1759 -1.1759 -0.2655 -0.2655 -0.1376 -0.1376 -0.1337 -0.1337 0.7831 0.7831 0.7937 0.7937 1.2931 1.2931 1.6813 1.6813 1.6947 1.6947 1.7708 1.7708 2.1544 2.1544 2.7455 2.7455 2.7865 2.7865 2.7907 2.7907 3.1819 3.1819 3.1964 3.1964 3.6167 3.6167 3.8813 3.8813 3.8967 3.8967 4.1343 4.1343 4.3757 4.3757 4.6204 4.6204 4.6230 4.6230 5.9113 5.9113 5.9123 5.9123 6.1511 6.1511 6.1788 6.1788 6.1859 6.1859 6.5425 6.5425 7.6177 7.6177 8.9466 8.9504 k = 0.3333 0.5774 0.1250 ( 6084 PWs) bands (ev): -14.3380 -14.3380 -14.3377 -14.3377 -12.8974 -12.8974 -12.8965 -12.8965 -11.1096 -11.1096 -10.9716 -10.9716 -10.7786 -10.7786 -10.7767 -10.7767 -6.5206 -6.5206 -6.5204 -6.5204 -2.9454 -2.9454 -2.9426 -2.9426 -2.2791 -2.2791 -2.2571 -2.2571 -2.2454 -2.2454 -1.9720 -1.9720 -1.9126 -1.9126 -1.3677 -1.3677 -1.3099 -1.3099 -1.1790 -1.1790 -0.2641 -0.2641 -0.1425 -0.1425 -0.1348 -0.1348 0.7790 0.7790 0.7899 0.7899 1.2873 1.2873 1.6889 1.6889 1.7024 1.7024 1.7757 1.7757 2.1432 2.1432 2.7558 2.7558 2.7906 2.7906 2.7951 2.7951 3.1871 3.1871 3.2015 3.2015 3.6362 3.6362 3.8907 3.8907 3.9057 3.9057 4.1245 4.1245 4.3608 4.3608 4.6100 4.6100 4.6122 4.6122 5.9097 5.9097 5.9108 5.9108 6.1510 6.1510 6.1823 6.1823 6.1856 6.1856 6.5433 6.5433 7.6178 7.6178 8.9309 8.9326 k = 0.3333 0.5774 0.1406 ( 6081 PWs) bands (ev): -14.3379 -14.3379 -14.3376 -14.3376 -12.8977 -12.8977 -12.8967 -12.8967 -11.1084 -11.1084 -10.9728 -10.9728 -10.7786 -10.7786 -10.7767 -10.7767 -6.5193 -6.5193 -6.5192 -6.5192 -2.9453 -2.9453 -2.9426 -2.9426 -2.2784 -2.2784 -2.2574 -2.2574 -2.2453 -2.2453 -1.9719 -1.9719 -1.9152 -1.9152 -1.3667 -1.3667 -1.3132 -1.3132 -1.1820 -1.1820 -0.2627 -0.2627 -0.1477 -0.1477 -0.1360 -0.1360 0.7747 0.7747 0.7858 0.7858 1.2813 1.2813 1.6970 1.6970 1.7105 1.7105 1.7810 1.7810 2.1315 2.1315 2.7663 2.7663 2.7946 2.7946 2.7991 2.7991 3.1934 3.1934 3.2074 3.2074 3.6575 3.6575 3.9012 3.9012 3.9156 3.9156 4.1139 4.1139 4.3444 4.3444 4.5985 4.5985 4.6004 4.6004 5.9080 5.9080 5.9092 5.9092 6.1509 6.1509 6.1850 6.1850 6.1864 6.1864 6.5441 6.5441 7.6178 7.6178 8.9107 8.9129 k = 0.3333 0.5774 0.1563 ( 6075 PWs) bands (ev): -14.3378 -14.3378 -14.3375 -14.3375 -12.8979 -12.8979 -12.8970 -12.8970 -11.1071 -11.1071 -10.9741 -10.9741 -10.7787 -10.7787 -10.7767 -10.7767 -6.5181 -6.5181 -6.5179 -6.5179 -2.9452 -2.9452 -2.9426 -2.9426 -2.2776 -2.2776 -2.2577 -2.2577 -2.2451 -2.2451 -1.9718 -1.9718 -1.9180 -1.9180 -1.3656 -1.3656 -1.3167 -1.3167 -1.1849 -1.1849 -0.2612 -0.2612 -0.1531 -0.1531 -0.1372 -0.1372 0.7703 0.7703 0.7817 0.7817 1.2752 1.2752 1.7055 1.7055 1.7189 1.7189 1.7865 1.7865 2.1195 2.1195 2.7765 2.7765 2.7986 2.7986 2.8026 2.8026 3.2005 3.2005 3.2143 3.2143 3.6804 3.6804 3.9124 3.9124 3.9262 3.9262 4.1027 4.1027 4.3267 4.3267 4.5861 4.5861 4.5877 4.5877 5.9064 5.9064 5.9075 5.9075 6.1507 6.1507 6.1847 6.1847 6.1901 6.1901 6.5450 6.5450 7.6178 7.6178 8.8913 8.8924 k = 0.3333 0.5774 0.1719 ( 6090 PWs) bands (ev): -14.3377 -14.3377 -14.3374 -14.3374 -12.8981 -12.8981 -12.8972 -12.8972 -11.1058 -11.1058 -10.9755 -10.9755 -10.7787 -10.7787 -10.7767 -10.7767 -6.5168 -6.5168 -6.5167 -6.5167 -2.9451 -2.9451 -2.9426 -2.9426 -2.2770 -2.2770 -2.2581 -2.2581 -2.2450 -2.2450 -1.9718 -1.9718 -1.9208 -1.9208 -1.3646 -1.3646 -1.3205 -1.3205 -1.1877 -1.1877 -0.2596 -0.2596 -0.1585 -0.1585 -0.1385 -0.1385 0.7659 0.7659 0.7775 0.7775 1.2690 1.2690 1.7140 1.7140 1.7274 1.7274 1.7921 1.7921 2.1075 2.1075 2.7853 2.7853 2.8035 2.8035 2.8054 2.8054 3.2085 3.2085 3.2218 3.2218 3.7046 3.7046 3.9243 3.9243 3.9373 3.9373 4.0909 4.0909 4.3078 4.3078 4.5730 4.5730 4.5742 4.5742 5.9046 5.9046 5.9059 5.9059 6.1504 6.1504 6.1843 6.1843 6.1940 6.1940 6.5459 6.5459 7.6179 7.6179 8.8726 8.8772 k = 0.3333 0.5774 0.1875 ( 6078 PWs) bands (ev): -14.3376 -14.3376 -14.3373 -14.3373 -12.8984 -12.8984 -12.8974 -12.8974 -11.1045 -11.1045 -10.9768 -10.9768 -10.7787 -10.7787 -10.7768 -10.7768 -6.5156 -6.5156 -6.5154 -6.5154 -2.9450 -2.9450 -2.9426 -2.9426 -2.2762 -2.2762 -2.2584 -2.2584 -2.2448 -2.2448 -1.9717 -1.9717 -1.9236 -1.9236 -1.3634 -1.3634 -1.3244 -1.3244 -1.1902 -1.1902 -0.2581 -0.2581 -0.1638 -0.1638 -0.1398 -0.1398 0.7616 0.7616 0.7735 0.7735 1.2631 1.2631 1.7225 1.7225 1.7358 1.7358 1.7978 1.7978 2.0957 2.0957 2.7912 2.7912 2.8077 2.8077 2.8106 2.8106 3.2170 3.2170 3.2299 3.2299 3.7300 3.7300 3.9367 3.9367 3.9490 3.9490 4.0789 4.0789 4.2879 4.2879 4.5595 4.5595 4.5602 4.5602 5.9030 5.9030 5.9043 5.9043 6.1501 6.1501 6.1838 6.1838 6.1978 6.1978 6.5467 6.5467 7.6179 7.6179 8.8537 8.8550 k = 0.3333 0.5774 0.2031 ( 6087 PWs) bands (ev): -14.3374 -14.3374 -14.3372 -14.3372 -12.8986 -12.8986 -12.8977 -12.8977 -11.1032 -11.1032 -10.9782 -10.9782 -10.7787 -10.7787 -10.7768 -10.7768 -6.5143 -6.5143 -6.5143 -6.5143 -2.9449 -2.9449 -2.9426 -2.9426 -2.2756 -2.2756 -2.2587 -2.2587 -2.2447 -2.2447 -1.9716 -1.9716 -1.9264 -1.9264 -1.3624 -1.3624 -1.3284 -1.3284 -1.1925 -1.1925 -0.2566 -0.2566 -0.1689 -0.1689 -0.1410 -0.1410 0.7575 0.7575 0.7697 0.7697 1.2574 1.2574 1.7307 1.7307 1.7439 1.7439 1.8033 1.8033 2.0843 2.0843 2.7941 2.7941 2.8092 2.8092 2.8195 2.8195 3.2259 3.2259 3.2383 3.2383 3.7561 3.7561 3.9493 3.9493 3.9608 3.9608 4.0668 4.0668 4.2673 4.2673 4.5457 4.5457 4.5459 4.5459 5.9014 5.9014 5.9027 5.9027 6.1498 6.1498 6.1833 6.1833 6.2015 6.2015 6.5476 6.5476 7.6179 7.6179 8.8355 8.8363 k = 0.3333 0.5774 0.2188 ( 6081 PWs) bands (ev): -14.3373 -14.3373 -14.3371 -14.3371 -12.8988 -12.8988 -12.8979 -12.8979 -11.1020 -11.1020 -10.9795 -10.9795 -10.7787 -10.7787 -10.7768 -10.7768 -6.5132 -6.5132 -6.5131 -6.5131 -2.9448 -2.9448 -2.9426 -2.9426 -2.2749 -2.2749 -2.2589 -2.2589 -2.2445 -2.2445 -1.9716 -1.9716 -1.9290 -1.9290 -1.3613 -1.3613 -1.3321 -1.3321 -1.1945 -1.1945 -0.2552 -0.2552 -0.1737 -0.1737 -0.1422 -0.1422 0.7537 0.7537 0.7661 0.7661 1.2520 1.2520 1.7385 1.7385 1.7515 1.7515 1.8087 1.8087 2.0736 2.0736 2.7953 2.7953 2.8102 2.8102 2.8291 2.8291 3.2347 3.2347 3.2467 3.2467 3.7828 3.7828 3.9619 3.9619 3.9727 3.9727 4.0549 4.0549 4.2463 4.2463 4.5317 4.5317 4.5319 4.5319 5.8999 5.8999 5.9012 5.9012 6.1495 6.1495 6.1828 6.1828 6.2049 6.2049 6.5483 6.5483 7.6179 7.6179 8.8192 8.8216 k = 0.3333 0.5774 0.2344 ( 6081 PWs) bands (ev): -14.3373 -14.3373 -14.3370 -14.3370 -12.8990 -12.8990 -12.8981 -12.8981 -11.1008 -11.1008 -10.9807 -10.9807 -10.7787 -10.7787 -10.7768 -10.7768 -6.5121 -6.5121 -6.5121 -6.5121 -2.9447 -2.9447 -2.9426 -2.9426 -2.2742 -2.2742 -2.2591 -2.2591 -2.2443 -2.2443 -1.9715 -1.9715 -1.9314 -1.9314 -1.3603 -1.3603 -1.3358 -1.3358 -1.1961 -1.1961 -0.2539 -0.2539 -0.1781 -0.1781 -0.1433 -0.1433 0.7502 0.7502 0.7629 0.7629 1.2472 1.2472 1.7457 1.7457 1.7586 1.7586 1.8138 1.8138 2.0636 2.0636 2.7955 2.7955 2.8107 2.8107 2.8384 2.8384 3.2433 3.2433 3.2548 3.2548 3.8097 3.8097 3.9742 3.9742 3.9841 3.9841 4.0431 4.0431 4.2251 4.2251 4.5180 4.5180 4.5187 4.5187 5.8985 5.8985 5.8999 5.8999 6.1491 6.1491 6.1823 6.1823 6.2080 6.2080 6.5491 6.5491 7.6180 7.6180 8.8044 8.8052 k = 0.3333 0.5774 0.2500 ( 6081 PWs) bands (ev): -14.3372 -14.3372 -14.3369 -14.3369 -12.8992 -12.8992 -12.8983 -12.8983 -11.0998 -11.0998 -10.9818 -10.9818 -10.7788 -10.7788 -10.7769 -10.7769 -6.5112 -6.5112 -6.5112 -6.5112 -2.9446 -2.9446 -2.9426 -2.9426 -2.2737 -2.2737 -2.2594 -2.2594 -2.2442 -2.2442 -1.9715 -1.9715 -1.9336 -1.9336 -1.3594 -1.3594 -1.3391 -1.3391 -1.1975 -1.1975 -0.2528 -0.2528 -0.1820 -0.1820 -0.1443 -0.1443 0.7472 0.7472 0.7601 0.7601 1.2429 1.2429 1.7521 1.7521 1.7648 1.7648 1.8185 1.8185 2.0547 2.0547 2.7952 2.7952 2.8108 2.8108 2.8469 2.8469 3.2512 3.2512 3.2623 3.2623 3.8364 3.8364 3.9857 3.9857 3.9949 3.9949 4.0316 4.0316 4.2045 4.2045 4.5051 4.5051 4.5062 4.5062 5.8973 5.8973 5.8987 5.8987 6.1488 6.1488 6.1818 6.1818 6.2107 6.2107 6.5497 6.5497 7.6180 7.6180 8.7904 8.7933 k = 0.3333 0.5774 0.2656 ( 6090 PWs) bands (ev): -14.3371 -14.3371 -14.3368 -14.3368 -12.8994 -12.8994 -12.8984 -12.8984 -11.0989 -11.0989 -10.9827 -10.9827 -10.7788 -10.7788 -10.7769 -10.7769 -6.5104 -6.5104 -6.5104 -6.5104 -2.9446 -2.9446 -2.9427 -2.9427 -2.2733 -2.2733 -2.2596 -2.2596 -2.2441 -2.2441 -1.9715 -1.9715 -1.9354 -1.9354 -1.3586 -1.3586 -1.3420 -1.3420 -1.1986 -1.1986 -0.2518 -0.2518 -0.1853 -0.1853 -0.1451 -0.1451 0.7446 0.7446 0.7577 0.7577 1.2393 1.2393 1.7576 1.7576 1.7701 1.7701 1.8226 1.8226 2.0470 2.0470 2.7946 2.7946 2.8107 2.8107 2.8543 2.8543 3.2581 3.2581 3.2688 3.2688 3.8625 3.8625 3.9961 3.9961 4.0044 4.0044 4.0204 4.0204 4.1850 4.1850 4.4935 4.4935 4.4951 4.4951 5.8963 5.8963 5.8977 5.8977 6.1485 6.1485 6.1814 6.1814 6.2130 6.2130 6.5502 6.5502 7.6180 7.6180 8.7789 8.7819 k = 0.3333 0.5774 0.2813 ( 6081 PWs) bands (ev): -14.3370 -14.3370 -14.3368 -14.3368 -12.8995 -12.8995 -12.8985 -12.8985 -11.0981 -11.0981 -10.9835 -10.9835 -10.7788 -10.7788 -10.7769 -10.7769 -6.5098 -6.5098 -6.5098 -6.5098 -2.9445 -2.9445 -2.9426 -2.9426 -2.2729 -2.2729 -2.2597 -2.2597 -2.2440 -2.2440 -1.9714 -1.9714 -1.9369 -1.9369 -1.3580 -1.3580 -1.3443 -1.3443 -1.1995 -1.1995 -0.2510 -0.2510 -0.1879 -0.1879 -0.1458 -0.1458 0.7426 0.7426 0.7558 0.7558 1.2365 1.2365 1.7620 1.7620 1.7744 1.7744 1.8260 1.8260 2.0408 2.0408 2.7940 2.7940 2.8104 2.8104 2.8603 2.8603 3.2638 3.2638 3.2742 3.2742 3.8874 3.8874 4.0049 4.0049 4.0074 4.0074 4.0141 4.0141 4.1676 4.1676 4.4838 4.4838 4.4858 4.4858 5.8954 5.8954 5.8969 5.8969 6.1483 6.1483 6.1811 6.1811 6.2148 6.2148 6.5506 6.5506 7.6180 7.6180 8.7697 8.7727 k = 0.3333 0.5774 0.2969 ( 6081 PWs) bands (ev): -14.3370 -14.3370 -14.3367 -14.3367 -12.8996 -12.8996 -12.8986 -12.8986 -11.0976 -11.0976 -10.9841 -10.9841 -10.7788 -10.7788 -10.7769 -10.7769 -6.5093 -6.5093 -6.5093 -6.5093 -2.9445 -2.9445 -2.9426 -2.9426 -2.2726 -2.2726 -2.2598 -2.2598 -2.2439 -2.2439 -1.9714 -1.9714 -1.9380 -1.9380 -1.3575 -1.3575 -1.3460 -1.3460 -1.2000 -1.2000 -0.2504 -0.2504 -0.1898 -0.1898 -0.1462 -0.1462 0.7411 0.7411 0.7545 0.7545 1.2344 1.2344 1.7653 1.7653 1.7775 1.7775 1.8286 1.8286 2.0362 2.0362 2.7934 2.7934 2.8102 2.8102 2.8647 2.8647 3.2680 3.2680 3.2783 3.2783 3.9102 3.9102 3.9965 3.9965 4.0115 4.0115 4.0196 4.0196 4.1536 4.1536 4.4765 4.4765 4.4788 4.4788 5.8948 5.8948 5.8963 5.8963 6.1481 6.1481 6.1808 6.1808 6.2162 6.2162 6.5509 6.5509 7.6180 7.6180 8.7630 8.7652 k = 0.3333 0.5774 0.3125 ( 6087 PWs) bands (ev): -14.3370 -14.3370 -14.3367 -14.3367 -12.8996 -12.8996 -12.8987 -12.8987 -11.0973 -11.0973 -10.9844 -10.9844 -10.7788 -10.7788 -10.7769 -10.7769 -6.5090 -6.5090 -6.5090 -6.5090 -2.9445 -2.9445 -2.9427 -2.9427 -2.2725 -2.2725 -2.2598 -2.2598 -2.2439 -2.2439 -1.9714 -1.9714 -1.9387 -1.9387 -1.3572 -1.3572 -1.3471 -1.3471 -1.2004 -1.2004 -0.2501 -0.2501 -0.1910 -0.1910 -0.1465 -0.1465 0.7402 0.7402 0.7536 0.7536 1.2331 1.2331 1.7672 1.7672 1.7794 1.7794 1.8301 1.8301 2.0333 2.0333 2.7930 2.7930 2.8100 2.8100 2.8674 2.8674 3.2706 3.2706 3.2807 3.2807 3.9288 3.9288 3.9854 3.9854 4.0157 4.0157 4.0234 4.0234 4.1444 4.1444 4.4719 4.4719 4.4743 4.4743 5.8945 5.8945 5.8960 5.8960 6.1480 6.1480 6.1807 6.1807 6.2170 6.2170 6.5511 6.5511 7.6180 7.6180 8.7591 8.7617 k = 0.3333 0.5774 0.3281 ( 6096 PWs) bands (ev): -14.3370 -14.3370 -14.3367 -14.3367 -12.8997 -12.8997 -12.8987 -12.8987 -11.0971 -11.0971 -10.9845 -10.9845 -10.7788 -10.7788 -10.7769 -10.7769 -6.5089 -6.5089 -6.5089 -6.5089 -2.9445 -2.9445 -2.9427 -2.9427 -2.2724 -2.2724 -2.2599 -2.2599 -2.2439 -2.2439 -1.9715 -1.9715 -1.9389 -1.9389 -1.3572 -1.3572 -1.3474 -1.3474 -1.2006 -1.2006 -0.2500 -0.2500 -0.1914 -0.1914 -0.1467 -0.1467 0.7399 0.7399 0.7533 0.7533 1.2327 1.2327 1.7679 1.7679 1.7801 1.7801 1.8307 1.8307 2.0324 2.0324 2.7929 2.7929 2.8099 2.8099 2.8683 2.8683 3.2715 3.2715 3.2816 3.2816 3.9373 3.9373 3.9795 3.9795 4.0172 4.0172 4.0247 4.0247 4.1412 4.1412 4.4703 4.4703 4.4728 4.4728 5.8943 5.8943 5.8959 5.8959 6.1480 6.1480 6.1806 6.1806 6.2173 6.2173 6.5512 6.5512 7.6180 7.6180 8.7578 8.7631 Writing output data file CdSO4.save init_run : 0.86s CPU 1.17s WALL ( 1 calls) electrons : 961.27s CPU 972.37s WALL ( 1 calls) Called by init_run: wfcinit : 0.00s CPU 0.06s WALL ( 1 calls) potinit : 0.06s CPU 0.10s WALL ( 1 calls) Called by electrons: c_bands : 961.26s CPU 972.35s WALL ( 1 calls) v_of_rho : 0.02s CPU 0.02s WALL ( 1 calls) v_h : 0.00s CPU 0.00s WALL ( 1 calls) v_xc : 0.02s CPU 0.02s WALL ( 1 calls) newd : 0.25s CPU 0.36s WALL ( 1 calls) Called by c_bands: init_us_2 : 0.09s CPU 0.13s WALL ( 272 calls) cegterg : 934.15s CPU 943.82s WALL ( 1424 calls) Called by sum_band: Called by *egterg: h_psi : 362.69s CPU 367.03s WALL ( 29072 calls) s_psi : 35.78s CPU 35.90s WALL ( 29072 calls) g_psi : 1.02s CPU 0.96s WALL ( 27376 calls) cdiaghg : 435.02s CPU 440.04s WALL ( 27648 calls) cegterg:over : 43.50s CPU 43.77s WALL ( 27376 calls) cegterg:upda : 44.25s CPU 44.50s WALL ( 27376 calls) cegterg:last : 15.45s CPU 15.47s WALL ( 2240 calls) cdiaghg:chol : 25.46s CPU 25.52s WALL ( 27648 calls) cdiaghg:inve : 18.96s CPU 19.45s WALL ( 27648 calls) cdiaghg:para : 34.04s CPU 33.54s WALL ( 55296 calls) Called by h_psi: h_psi:vloc : 287.40s CPU 291.17s WALL ( 29072 calls) h_psi:vnl : 73.84s CPU 74.31s WALL ( 29072 calls) add_vuspsi : 37.91s CPU 38.09s WALL ( 29072 calls) General routines calbec : 35.83s CPU 36.13s WALL ( 29072 calls) fft : 0.04s CPU 0.03s WALL ( 19 calls) ffts : 0.00s CPU 0.00s WALL ( 4 calls) fftw : 246.67s CPU 250.34s WALL ( 2360572 calls) interpolate : 0.01s CPU 0.01s WALL ( 4 calls) davcio : 0.27s CPU 0.44s WALL ( 544 calls) Parallel routines fft_scatter : 80.44s CPU 82.52s WALL ( 2360595 calls) PWSCF : 16m33.20s CPU 17m 9.44s WALL This run was terminated on: 17:11:15 5Jan2017 =------------------------------------------------------------------------------= JOB DONE. =------------------------------------------------------------------------------=