Program PWSCF v.5.4.0 starts on 12Feb2017 at 4:41:57 This program is part of the open-source Quantum ESPRESSO suite for quantum simulation of materials; please cite "P. Giannozzi et al., J. Phys.:Condens. Matter 21 395502 (2009); URL http://www.quantum-espresso.org", in publications or presentations arising from this work. More details at http://www.quantum-espresso.org/quote Parallel version (MPI & OpenMP), running on 72 processor cores Number of MPI processes: 36 Threads/MPI process: 2 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: ./TaTlxPO4x2.save/ file Tl.rel-pbe-dn-rrkjus_psl.1.0.0.UPF: wavefunction(s) 6S 5D 5D renormalized Subspace diagonalization in iterative solution of the eigenvalue problem: one sub-group per band group 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 56 32 9 3438 1502 230 Max 57 33 11 3443 1528 235 Sum 2029 1159 337 123799 54641 8353 bravais-lattice index = 14 lattice parameter (alat) = 9.5068 a.u. unit-cell volume = 1256.7428 (a.u.)^3 number of atoms/cell = 12 number of atomic types = 4 number of electrons = 84.00 number of Kohn-Sham states= 100 kinetic-energy cutoff = 47.0000 Ry charge density cutoff = 324.0000 Ry Exchange-correlation = PBE ( 1 4 3 4 0 0) Non magnetic calculation with spin-orbit celldm(1)= 9.506834 celldm(2)= 1.000000 celldm(3)= 1.688916 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 1.688916 ) 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 0.592096 ) PseudoPot. # 1 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. # 2 for Tl read from file: /users/gautes/Pseudo/Tl.rel-pbe-dn-rrkjus_psl.1.0.0.UPF MD5 check sum: cd969aa200d2b9b89aab382fbbb9d684 Pseudo is Ultrasoft + core correction, Zval = 13.0 Generated using "atomic" code by A. Dal Corso v.5.0.2 svn rev. 9656 Using radial grid of 1281 points, 10 beta functions with: l(1) = 0 l(2) = 0 l(3) = 1 l(4) = 1 l(5) = 1 l(6) = 1 l(7) = 2 l(8) = 2 l(9) = 2 l(10) = 2 Q(r) pseudized with 0 coefficients PseudoPot. # 3 for Ta read from file: /users/gautes/Pseudo/Ta.rel-pbe-spn-rrkjus_psl.1.0.0.UPF MD5 check sum: ce7a4fa75595c0f83f911fa846a48acf Pseudo is Ultrasoft + core correction, Zval = 13.0 Generated using "atomic" code by A. Dal Corso v.5.0.2 svn rev. 9656 Using radial grid of 1273 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. # 4 for P read from file: /users/gautes/Pseudo/P.rel-pbe-n-rrkjus_psl.1.0.0.UPF MD5 check sum: 667ec27f6326587e4f0d1734a2230026 Pseudo is Ultrasoft + core correction, Zval = 5.0 Generated using "atomic" code by A. Dal Corso v.5.0.2 svn rev. 9656 Using radial grid of 1147 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 O 6.00 15.99940 O( 1.00) Tl 13.00 204.38330 Tl( 1.00) Ta 13.00 180.94790 Ta( 1.00) P 5.00 30.97380 P( 1.00) 6 Sym. Ops. (no inversion) found s frac. trans. isym = 1 identity cryst. s( 1) = ( 1 0 0 ) ( 0 1 0 ) ( 0 0 1 ) cart. s( 1) = ( 1.0000000 -0.0000000 0.0000000 ) ( 0.0000000 1.0000000 0.0000000 ) ( 0.0000000 0.0000000 1.0000000 ) isym = 2 180 deg rotation - cart. axis [1,0,0] cryst. s( 2) = ( 1 0 0 ) ( -1 -1 0 ) ( 0 0 -1 ) cart. s( 2) = ( 1.0000000 -0.0000000 -0.0000000 ) ( 0.0000000 -1.0000000 -0.0000000 ) ( 0.0000000 0.0000000 -1.0000000 ) isym = 3 120 deg rotation - cryst. axis [0,0,1] cryst. s( 3) = ( 0 1 0 ) ( -1 -1 0 ) ( 0 0 1 ) cart. s( 3) = ( -0.5000000 -0.8660254 0.0000000 ) ( 0.8660254 -0.5000000 0.0000000 ) ( 0.0000000 0.0000000 1.0000000 ) isym = 4 120 deg rotation - cryst. axis [0,0,-1] cryst. s( 4) = ( -1 -1 0 ) ( 1 0 0 ) ( 0 0 1 ) cart. s( 4) = ( -0.5000000 0.8660254 0.0000000 ) ( -0.8660254 -0.5000000 0.0000000 ) ( 0.0000000 0.0000000 1.0000000 ) isym = 5 180 deg rotation - cryst. axis [0,1,0] cryst. s( 5) = ( -1 -1 0 ) ( 0 1 0 ) ( 0 0 -1 ) cart. s( 5) = ( -0.5000000 -0.8660254 0.0000000 ) ( -0.8660254 0.5000000 -0.0000000 ) ( 0.0000000 0.0000000 -1.0000000 ) isym = 6 180 deg rotation - cryst. axis [1,1,0] cryst. s( 6) = ( 0 1 0 ) ( 1 0 0 ) ( 0 0 -1 ) cart. s( 6) = ( -0.5000000 0.8660254 -0.0000000 ) ( 0.8660254 0.5000000 -0.0000000 ) ( 0.0000000 0.0000000 -1.0000000 ) double point group D_3 (32) there are 6 classes and 3 irreducible representations the character table: E -E 2C3 -2C3 3C2' -3C2' G_4 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 G_6 1.00 -1.00 -1.00 1.00 0.00 0.00 imaginary part E -E 2C3 -2C3 3C2' -3C2' G_4 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 G_6 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] Cartesian axes number of k points= 266 Fermi-Dirac smearing, width (Ry)= 0.0010 cart. coord. in units 2pi/alat k( 1) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0037594 k( 2) = ( 0.0135135 0.0078020 -0.0000000), wk = 0.0037594 k( 3) = ( 0.0270270 0.0156041 -0.0000000), wk = 0.0037594 k( 4) = ( 0.0405405 0.0234061 -0.0000000), wk = 0.0037594 k( 5) = ( 0.0540540 0.0312081 -0.0000000), wk = 0.0037594 k( 6) = ( 0.0675676 0.0390102 -0.0000000), wk = 0.0037594 k( 7) = ( 0.0810811 0.0468122 -0.0000000), wk = 0.0037594 k( 8) = ( 0.0945946 0.0546142 -0.0000000), wk = 0.0037594 k( 9) = ( 0.1081081 0.0624162 -0.0000000), wk = 0.0037594 k( 10) = ( 0.1216216 0.0702183 -0.0000000), wk = 0.0037594 k( 11) = ( 0.1351351 0.0780203 -0.0000000), wk = 0.0037594 k( 12) = ( 0.1486486 0.0858223 -0.0000000), wk = 0.0037594 k( 13) = ( 0.1621622 0.0936244 -0.0000000), wk = 0.0037594 k( 14) = ( 0.1756757 0.1014264 -0.0000000), wk = 0.0037594 k( 15) = ( 0.1891892 0.1092284 -0.0000000), wk = 0.0037594 k( 16) = ( 0.2027027 0.1170305 -0.0000000), wk = 0.0037594 k( 17) = ( 0.2162162 0.1248325 -0.0000000), wk = 0.0037594 k( 18) = ( 0.2297297 0.1326345 -0.0000000), wk = 0.0037594 k( 19) = ( 0.2432432 0.1404366 -0.0000000), wk = 0.0037594 k( 20) = ( 0.2567568 0.1482386 -0.0000000), wk = 0.0037594 k( 21) = ( 0.2702703 0.1560406 -0.0000000), wk = 0.0037594 k( 22) = ( 0.2837838 0.1638426 -0.0000000), wk = 0.0037594 k( 23) = ( 0.2972973 0.1716447 -0.0000000), wk = 0.0037594 k( 24) = ( 0.3108108 0.1794467 -0.0000000), wk = 0.0037594 k( 25) = ( 0.3243243 0.1872487 -0.0000000), wk = 0.0037594 k( 26) = ( 0.3378378 0.1950508 -0.0000000), wk = 0.0037594 k( 27) = ( 0.3513514 0.2028528 -0.0000000), wk = 0.0037594 k( 28) = ( 0.3648649 0.2106548 -0.0000000), wk = 0.0037594 k( 29) = ( 0.3783784 0.2184569 -0.0000000), wk = 0.0037594 k( 30) = ( 0.3918919 0.2262589 -0.0000000), wk = 0.0037594 k( 31) = ( 0.4054054 0.2340609 -0.0000000), wk = 0.0037594 k( 32) = ( 0.4189189 0.2418630 -0.0000000), wk = 0.0037594 k( 33) = ( 0.4324324 0.2496650 -0.0000000), wk = 0.0037594 k( 34) = ( 0.4459459 0.2574670 -0.0000000), wk = 0.0037594 k( 35) = ( 0.4594595 0.2652690 -0.0000000), wk = 0.0037594 k( 36) = ( 0.4729730 0.2730711 -0.0000000), wk = 0.0037594 k( 37) = ( 0.4864865 0.2808731 -0.0000000), wk = 0.0037594 k( 38) = ( 0.5000000 0.2886751 -0.0000000), wk = 0.0037594 k( 39) = ( 0.5000000 0.2886751 -0.0000000), wk = 0.0037594 k( 40) = ( 0.4920635 0.3024216 -0.0000000), wk = 0.0037594 k( 41) = ( 0.4841270 0.3161680 -0.0000000), wk = 0.0037594 k( 42) = ( 0.4761905 0.3299144 -0.0000000), wk = 0.0037594 k( 43) = ( 0.4682540 0.3436609 -0.0000000), wk = 0.0037594 k( 44) = ( 0.4603175 0.3574073 -0.0000000), wk = 0.0037594 k( 45) = ( 0.4523810 0.3711537 -0.0000000), wk = 0.0037594 k( 46) = ( 0.4444444 0.3849002 -0.0000000), wk = 0.0037594 k( 47) = ( 0.4365079 0.3986466 -0.0000000), wk = 0.0037594 k( 48) = ( 0.4285714 0.4123930 -0.0000000), wk = 0.0037594 k( 49) = ( 0.4206349 0.4261395 -0.0000000), wk = 0.0037594 k( 50) = ( 0.4126984 0.4398859 -0.0000000), wk = 0.0037594 k( 51) = ( 0.4047619 0.4536324 -0.0000000), wk = 0.0037594 k( 52) = ( 0.3968254 0.4673788 -0.0000000), wk = 0.0037594 k( 53) = ( 0.3888889 0.4811252 -0.0000000), wk = 0.0037594 k( 54) = ( 0.3809524 0.4948717 -0.0000000), wk = 0.0037594 k( 55) = ( 0.3730159 0.5086181 -0.0000000), wk = 0.0037594 k( 56) = ( 0.3650794 0.5223645 -0.0000000), wk = 0.0037594 k( 57) = ( 0.3571429 0.5361110 -0.0000000), wk = 0.0037594 k( 58) = ( 0.3492063 0.5498574 -0.0000000), wk = 0.0037594 k( 59) = ( 0.3412698 0.5636038 -0.0000000), wk = 0.0037594 k( 60) = ( 0.3333333 0.5773503 -0.0000000), wk = 0.0037594 k( 61) = ( 0.3333333 0.5773503 -0.0000000), wk = 0.0037594 k( 62) = ( 0.3253968 0.5636038 -0.0000000), wk = 0.0037594 k( 63) = ( 0.3174603 0.5498574 -0.0000000), wk = 0.0037594 k( 64) = ( 0.3095238 0.5361110 -0.0000000), wk = 0.0037594 k( 65) = ( 0.3015873 0.5223645 -0.0000000), wk = 0.0037594 k( 66) = ( 0.2936508 0.5086181 -0.0000000), wk = 0.0037594 k( 67) = ( 0.2857143 0.4948717 -0.0000000), wk = 0.0037594 k( 68) = ( 0.2777778 0.4811252 -0.0000000), wk = 0.0037594 k( 69) = ( 0.2698413 0.4673788 -0.0000000), wk = 0.0037594 k( 70) = ( 0.2619048 0.4536324 -0.0000000), wk = 0.0037594 k( 71) = ( 0.2539683 0.4398859 -0.0000000), wk = 0.0037594 k( 72) = ( 0.2460317 0.4261395 -0.0000000), wk = 0.0037594 k( 73) = ( 0.2380952 0.4123931 -0.0000000), wk = 0.0037594 k( 74) = ( 0.2301587 0.3986466 -0.0000000), wk = 0.0037594 k( 75) = ( 0.2222222 0.3849002 -0.0000000), wk = 0.0037594 k( 76) = ( 0.2142857 0.3711537 -0.0000000), wk = 0.0037594 k( 77) = ( 0.2063492 0.3574073 -0.0000000), wk = 0.0037594 k( 78) = ( 0.1984127 0.3436609 -0.0000000), wk = 0.0037594 k( 79) = ( 0.1904762 0.3299144 -0.0000000), wk = 0.0037594 k( 80) = ( 0.1825397 0.3161680 -0.0000000), wk = 0.0037594 k( 81) = ( 0.1746032 0.3024216 -0.0000000), wk = 0.0037594 k( 82) = ( 0.1666667 0.2886751 -0.0000000), wk = 0.0037594 k( 83) = ( 0.1587302 0.2749287 -0.0000000), wk = 0.0037594 k( 84) = ( 0.1507937 0.2611823 -0.0000000), wk = 0.0037594 k( 85) = ( 0.1428571 0.2474358 -0.0000000), wk = 0.0037594 k( 86) = ( 0.1349206 0.2336894 -0.0000000), wk = 0.0037594 k( 87) = ( 0.1269841 0.2199430 -0.0000000), wk = 0.0037594 k( 88) = ( 0.1190476 0.2061965 -0.0000000), wk = 0.0037594 k( 89) = ( 0.1111111 0.1924501 -0.0000000), wk = 0.0037594 k( 90) = ( 0.1031746 0.1787036 -0.0000000), wk = 0.0037594 k( 91) = ( 0.0952381 0.1649572 -0.0000000), wk = 0.0037594 k( 92) = ( 0.0873016 0.1512108 -0.0000000), wk = 0.0037594 k( 93) = ( 0.0793651 0.1374644 -0.0000000), wk = 0.0037594 k( 94) = ( 0.0714286 0.1237179 -0.0000000), wk = 0.0037594 k( 95) = ( 0.0634921 0.1099715 -0.0000000), wk = 0.0037594 k( 96) = ( 0.0555556 0.0962251 -0.0000000), wk = 0.0037594 k( 97) = ( 0.0476191 0.0824786 -0.0000000), wk = 0.0037594 k( 98) = ( 0.0396825 0.0687322 -0.0000000), wk = 0.0037594 k( 99) = ( 0.0317460 0.0549857 -0.0000000), wk = 0.0037594 k( 100) = ( 0.0238095 0.0412393 -0.0000000), wk = 0.0037594 k( 101) = ( 0.0158730 0.0274929 -0.0000000), wk = 0.0037594 k( 102) = ( 0.0079365 0.0137464 -0.0000000), wk = 0.0037594 k( 103) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0037594 k( 104) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0037594 k( 105) = ( 0.0000000 0.0000000 0.0155815), wk = 0.0037594 k( 106) = ( 0.0000000 0.0000000 0.0311629), wk = 0.0037594 k( 107) = ( 0.0000000 0.0000000 0.0467444), wk = 0.0037594 k( 108) = ( 0.0000000 0.0000000 0.0623259), wk = 0.0037594 k( 109) = ( 0.0000000 0.0000000 0.0779073), wk = 0.0037594 k( 110) = ( 0.0000000 0.0000000 0.0934888), wk = 0.0037594 k( 111) = ( 0.0000000 0.0000000 0.1090703), wk = 0.0037594 k( 112) = ( 0.0000000 0.0000000 0.1246517), wk = 0.0037594 k( 113) = ( 0.0000000 0.0000000 0.1402332), wk = 0.0037594 k( 114) = ( 0.0000000 0.0000000 0.1558146), wk = 0.0037594 k( 115) = ( 0.0000000 0.0000000 0.1713961), wk = 0.0037594 k( 116) = ( 0.0000000 0.0000000 0.1869776), wk = 0.0037594 k( 117) = ( 0.0000000 0.0000000 0.2025590), wk = 0.0037594 k( 118) = ( 0.0000000 0.0000000 0.2181405), wk = 0.0037594 k( 119) = ( 0.0000000 0.0000000 0.2337220), wk = 0.0037594 k( 120) = ( 0.0000000 0.0000000 0.2493034), wk = 0.0037594 k( 121) = ( 0.0000000 0.0000000 0.2648849), wk = 0.0037594 k( 122) = ( 0.0000000 0.0000000 0.2804664), wk = 0.0037594 k( 123) = ( 0.0000000 0.0000000 0.2960478), wk = 0.0037594 k( 124) = ( 0.0000000 0.0000000 0.2960478), wk = 0.0037594 k( 125) = ( 0.0135135 0.0078020 0.2960478), wk = 0.0037594 k( 126) = ( 0.0270270 0.0156041 0.2960478), wk = 0.0037594 k( 127) = ( 0.0405405 0.0234061 0.2960478), wk = 0.0037594 k( 128) = ( 0.0540540 0.0312081 0.2960478), wk = 0.0037594 k( 129) = ( 0.0675676 0.0390102 0.2960478), wk = 0.0037594 k( 130) = ( 0.0810811 0.0468122 0.2960478), wk = 0.0037594 k( 131) = ( 0.0945946 0.0546142 0.2960478), wk = 0.0037594 k( 132) = ( 0.1081081 0.0624162 0.2960478), wk = 0.0037594 k( 133) = ( 0.1216216 0.0702183 0.2960478), wk = 0.0037594 k( 134) = ( 0.1351351 0.0780203 0.2960478), wk = 0.0037594 k( 135) = ( 0.1486486 0.0858223 0.2960478), wk = 0.0037594 k( 136) = ( 0.1621622 0.0936244 0.2960478), wk = 0.0037594 k( 137) = ( 0.1756757 0.1014264 0.2960478), wk = 0.0037594 k( 138) = ( 0.1891892 0.1092284 0.2960478), wk = 0.0037594 k( 139) = ( 0.2027027 0.1170305 0.2960478), wk = 0.0037594 k( 140) = ( 0.2162162 0.1248325 0.2960478), wk = 0.0037594 k( 141) = ( 0.2297297 0.1326345 0.2960478), wk = 0.0037594 k( 142) = ( 0.2432432 0.1404366 0.2960478), wk = 0.0037594 k( 143) = ( 0.2567568 0.1482386 0.2960478), wk = 0.0037594 k( 144) = ( 0.2702703 0.1560406 0.2960478), wk = 0.0037594 k( 145) = ( 0.2837838 0.1638426 0.2960478), wk = 0.0037594 k( 146) = ( 0.2972973 0.1716447 0.2960478), wk = 0.0037594 k( 147) = ( 0.3108108 0.1794467 0.2960478), wk = 0.0037594 k( 148) = ( 0.3243243 0.1872487 0.2960478), wk = 0.0037594 k( 149) = ( 0.3378378 0.1950508 0.2960478), wk = 0.0037594 k( 150) = ( 0.3513514 0.2028528 0.2960478), wk = 0.0037594 k( 151) = ( 0.3648649 0.2106548 0.2960478), wk = 0.0037594 k( 152) = ( 0.3783784 0.2184569 0.2960478), wk = 0.0037594 k( 153) = ( 0.3918919 0.2262589 0.2960478), wk = 0.0037594 k( 154) = ( 0.4054054 0.2340609 0.2960478), wk = 0.0037594 k( 155) = ( 0.4189189 0.2418630 0.2960478), wk = 0.0037594 k( 156) = ( 0.4324324 0.2496650 0.2960478), wk = 0.0037594 k( 157) = ( 0.4459459 0.2574670 0.2960478), wk = 0.0037594 k( 158) = ( 0.4594595 0.2652690 0.2960478), wk = 0.0037594 k( 159) = ( 0.4729730 0.2730711 0.2960478), wk = 0.0037594 k( 160) = ( 0.4864865 0.2808731 0.2960478), wk = 0.0037594 k( 161) = ( 0.5000000 0.2886751 0.2960478), wk = 0.0037594 k( 162) = ( 0.5000000 0.2886751 0.2960478), wk = 0.0037594 k( 163) = ( 0.4920635 0.3024216 0.2960478), wk = 0.0037594 k( 164) = ( 0.4841270 0.3161680 0.2960478), wk = 0.0037594 k( 165) = ( 0.4761905 0.3299144 0.2960478), wk = 0.0037594 k( 166) = ( 0.4682540 0.3436609 0.2960478), wk = 0.0037594 k( 167) = ( 0.4603175 0.3574073 0.2960478), wk = 0.0037594 k( 168) = ( 0.4523810 0.3711537 0.2960478), wk = 0.0037594 k( 169) = ( 0.4444444 0.3849002 0.2960478), wk = 0.0037594 k( 170) = ( 0.4365079 0.3986466 0.2960478), wk = 0.0037594 k( 171) = ( 0.4285714 0.4123930 0.2960478), wk = 0.0037594 k( 172) = ( 0.4206349 0.4261395 0.2960478), wk = 0.0037594 k( 173) = ( 0.4126984 0.4398859 0.2960478), wk = 0.0037594 k( 174) = ( 0.4047619 0.4536324 0.2960478), wk = 0.0037594 k( 175) = ( 0.3968254 0.4673788 0.2960478), wk = 0.0037594 k( 176) = ( 0.3888889 0.4811252 0.2960478), wk = 0.0037594 k( 177) = ( 0.3809524 0.4948717 0.2960478), wk = 0.0037594 k( 178) = ( 0.3730159 0.5086181 0.2960478), wk = 0.0037594 k( 179) = ( 0.3650794 0.5223645 0.2960478), wk = 0.0037594 k( 180) = ( 0.3571429 0.5361110 0.2960478), wk = 0.0037594 k( 181) = ( 0.3492063 0.5498574 0.2960478), wk = 0.0037594 k( 182) = ( 0.3412698 0.5636038 0.2960478), wk = 0.0037594 k( 183) = ( 0.3333333 0.5773503 0.2960478), wk = 0.0037594 k( 184) = ( 0.3333333 0.5773503 0.2960478), wk = 0.0037594 k( 185) = ( 0.3253968 0.5636038 0.2960478), wk = 0.0037594 k( 186) = ( 0.3174603 0.5498574 0.2960478), wk = 0.0037594 k( 187) = ( 0.3095238 0.5361110 0.2960478), wk = 0.0037594 k( 188) = ( 0.3015873 0.5223645 0.2960478), wk = 0.0037594 k( 189) = ( 0.2936508 0.5086181 0.2960478), wk = 0.0037594 k( 190) = ( 0.2857143 0.4948717 0.2960478), wk = 0.0037594 k( 191) = ( 0.2777778 0.4811252 0.2960478), wk = 0.0037594 k( 192) = ( 0.2698413 0.4673788 0.2960478), wk = 0.0037594 k( 193) = ( 0.2619048 0.4536324 0.2960478), wk = 0.0037594 k( 194) = ( 0.2539683 0.4398859 0.2960478), wk = 0.0037594 k( 195) = ( 0.2460317 0.4261395 0.2960478), wk = 0.0037594 k( 196) = ( 0.2380952 0.4123931 0.2960478), wk = 0.0037594 k( 197) = ( 0.2301587 0.3986466 0.2960478), wk = 0.0037594 k( 198) = ( 0.2222222 0.3849002 0.2960478), wk = 0.0037594 k( 199) = ( 0.2142857 0.3711537 0.2960478), wk = 0.0037594 k( 200) = ( 0.2063492 0.3574073 0.2960478), wk = 0.0037594 k( 201) = ( 0.1984127 0.3436609 0.2960478), wk = 0.0037594 k( 202) = ( 0.1904762 0.3299144 0.2960478), wk = 0.0037594 k( 203) = ( 0.1825397 0.3161680 0.2960478), wk = 0.0037594 k( 204) = ( 0.1746032 0.3024216 0.2960478), wk = 0.0037594 k( 205) = ( 0.1666667 0.2886751 0.2960478), wk = 0.0037594 k( 206) = ( 0.1587302 0.2749287 0.2960478), wk = 0.0037594 k( 207) = ( 0.1507937 0.2611823 0.2960478), wk = 0.0037594 k( 208) = ( 0.1428571 0.2474358 0.2960478), wk = 0.0037594 k( 209) = ( 0.1349206 0.2336894 0.2960478), wk = 0.0037594 k( 210) = ( 0.1269841 0.2199430 0.2960478), wk = 0.0037594 k( 211) = ( 0.1190476 0.2061965 0.2960478), wk = 0.0037594 k( 212) = ( 0.1111111 0.1924501 0.2960478), wk = 0.0037594 k( 213) = ( 0.1031746 0.1787036 0.2960478), wk = 0.0037594 k( 214) = ( 0.0952381 0.1649572 0.2960478), wk = 0.0037594 k( 215) = ( 0.0873016 0.1512108 0.2960478), wk = 0.0037594 k( 216) = ( 0.0793651 0.1374644 0.2960478), wk = 0.0037594 k( 217) = ( 0.0714286 0.1237179 0.2960478), wk = 0.0037594 k( 218) = ( 0.0634921 0.1099715 0.2960478), wk = 0.0037594 k( 219) = ( 0.0555556 0.0962251 0.2960478), wk = 0.0037594 k( 220) = ( 0.0476191 0.0824786 0.2960478), wk = 0.0037594 k( 221) = ( 0.0396825 0.0687322 0.2960478), wk = 0.0037594 k( 222) = ( 0.0317460 0.0549857 0.2960478), wk = 0.0037594 k( 223) = ( 0.0238095 0.0412393 0.2960478), wk = 0.0037594 k( 224) = ( 0.0158730 0.0274929 0.2960478), wk = 0.0037594 k( 225) = ( 0.0079365 0.0137464 0.2960478), wk = 0.0037594 k( 226) = ( 0.0000000 0.0000000 0.2960478), wk = 0.0037594 k( 227) = ( 0.5000000 0.2886751 0.2960478), wk = 0.0037594 k( 228) = ( 0.5000000 0.2886751 0.2804664), wk = 0.0037594 k( 229) = ( 0.5000000 0.2886751 0.2648849), wk = 0.0037594 k( 230) = ( 0.5000000 0.2886751 0.2493034), wk = 0.0037594 k( 231) = ( 0.5000000 0.2886751 0.2337220), wk = 0.0037594 k( 232) = ( 0.5000000 0.2886751 0.2181405), wk = 0.0037594 k( 233) = ( 0.5000000 0.2886751 0.2025590), wk = 0.0037594 k( 234) = ( 0.5000000 0.2886751 0.1869776), wk = 0.0037594 k( 235) = ( 0.5000000 0.2886751 0.1713961), wk = 0.0037594 k( 236) = ( 0.5000000 0.2886751 0.1558146), wk = 0.0037594 k( 237) = ( 0.5000000 0.2886751 0.1402332), wk = 0.0037594 k( 238) = ( 0.5000000 0.2886751 0.1246517), wk = 0.0037594 k( 239) = ( 0.5000000 0.2886751 0.1090703), wk = 0.0037594 k( 240) = ( 0.5000000 0.2886751 0.0934888), wk = 0.0037594 k( 241) = ( 0.5000000 0.2886751 0.0779073), wk = 0.0037594 k( 242) = ( 0.5000000 0.2886751 0.0623259), wk = 0.0037594 k( 243) = ( 0.5000000 0.2886751 0.0467444), wk = 0.0037594 k( 244) = ( 0.5000000 0.2886751 0.0311629), wk = 0.0037594 k( 245) = ( 0.5000000 0.2886751 0.0155815), wk = 0.0037594 k( 246) = ( 0.5000000 0.2886751 -0.0000000), wk = 0.0037594 k( 247) = ( 0.3333333 0.5773503 -0.0000000), wk = 0.0037594 k( 248) = ( 0.3333333 0.5773503 0.0155815), wk = 0.0037594 k( 249) = ( 0.3333333 0.5773503 0.0311629), wk = 0.0037594 k( 250) = ( 0.3333333 0.5773503 0.0467444), wk = 0.0037594 k( 251) = ( 0.3333333 0.5773503 0.0623259), wk = 0.0037594 k( 252) = ( 0.3333333 0.5773503 0.0779073), wk = 0.0037594 k( 253) = ( 0.3333333 0.5773503 0.0934888), wk = 0.0037594 k( 254) = ( 0.3333333 0.5773503 0.1090703), wk = 0.0037594 k( 255) = ( 0.3333333 0.5773503 0.1246517), wk = 0.0037594 k( 256) = ( 0.3333333 0.5773503 0.1402332), wk = 0.0037594 k( 257) = ( 0.3333333 0.5773503 0.1558146), wk = 0.0037594 k( 258) = ( 0.3333333 0.5773503 0.1713961), wk = 0.0037594 k( 259) = ( 0.3333333 0.5773503 0.1869776), wk = 0.0037594 k( 260) = ( 0.3333333 0.5773503 0.2025590), wk = 0.0037594 k( 261) = ( 0.3333333 0.5773503 0.2181405), wk = 0.0037594 k( 262) = ( 0.3333333 0.5773503 0.2337220), wk = 0.0037594 k( 263) = ( 0.3333333 0.5773503 0.2493034), wk = 0.0037594 k( 264) = ( 0.3333333 0.5773503 0.2648849), wk = 0.0037594 k( 265) = ( 0.3333333 0.5773503 0.2804664), wk = 0.0037594 k( 266) = ( 0.3333333 0.5773503 0.2960478), wk = 0.0037594 cryst. coord. k( 1) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0037594 k( 2) = ( 0.0135135 -0.0000000 0.0000000), wk = 0.0037594 k( 3) = ( 0.0270270 -0.0000000 -0.0000000), wk = 0.0037594 k( 4) = ( 0.0405405 -0.0000000 -0.0000000), wk = 0.0037594 k( 5) = ( 0.0540540 -0.0000000 0.0000000), wk = 0.0037594 k( 6) = ( 0.0675676 -0.0000000 0.0000000), wk = 0.0037594 k( 7) = ( 0.0810811 -0.0000000 -0.0000000), wk = 0.0037594 k( 8) = ( 0.0945946 -0.0000000 -0.0000000), wk = 0.0037594 k( 9) = ( 0.1081081 -0.0000000 0.0000000), wk = 0.0037594 k( 10) = ( 0.1216216 -0.0000000 0.0000000), wk = 0.0037594 k( 11) = ( 0.1351351 -0.0000000 0.0000000), wk = 0.0037594 k( 12) = ( 0.1486486 -0.0000000 0.0000000), wk = 0.0037594 k( 13) = ( 0.1621622 -0.0000000 -0.0000000), wk = 0.0037594 k( 14) = ( 0.1756757 -0.0000000 -0.0000000), wk = 0.0037594 k( 15) = ( 0.1891892 -0.0000000 -0.0000000), wk = 0.0037594 k( 16) = ( 0.2027027 -0.0000000 -0.0000000), wk = 0.0037594 k( 17) = ( 0.2162162 -0.0000000 0.0000000), wk = 0.0037594 k( 18) = ( 0.2297297 -0.0000000 0.0000000), wk = 0.0037594 k( 19) = ( 0.2432432 -0.0000000 0.0000000), wk = 0.0037594 k( 20) = ( 0.2567568 -0.0000000 0.0000000), wk = 0.0037594 k( 21) = ( 0.2702703 -0.0000000 0.0000000), wk = 0.0037594 k( 22) = ( 0.2837838 -0.0000000 -0.0000000), wk = 0.0037594 k( 23) = ( 0.2972973 -0.0000000 0.0000000), wk = 0.0037594 k( 24) = ( 0.3108108 0.0000000 0.0000000), wk = 0.0037594 k( 25) = ( 0.3243243 -0.0000000 -0.0000000), wk = 0.0037594 k( 26) = ( 0.3378378 0.0000000 -0.0000000), wk = 0.0037594 k( 27) = ( 0.3513514 -0.0000000 0.0000000), wk = 0.0037594 k( 28) = ( 0.3648649 -0.0000000 0.0000000), wk = 0.0037594 k( 29) = ( 0.3783784 -0.0000000 -0.0000000), wk = 0.0037594 k( 30) = ( 0.3918919 -0.0000000 -0.0000000), wk = 0.0037594 k( 31) = ( 0.4054054 0.0000000 -0.0000000), wk = 0.0037594 k( 32) = ( 0.4189189 0.0000000 -0.0000000), wk = 0.0037594 k( 33) = ( 0.4324324 -0.0000000 0.0000000), wk = 0.0037594 k( 34) = ( 0.4459459 0.0000000 0.0000000), wk = 0.0037594 k( 35) = ( 0.4594595 -0.0000000 0.0000000), wk = 0.0037594 k( 36) = ( 0.4729730 -0.0000000 0.0000000), wk = 0.0037594 k( 37) = ( 0.4864865 -0.0000000 -0.0000000), wk = 0.0037594 k( 38) = ( 0.5000000 -0.0000000 0.0000000), wk = 0.0037594 k( 39) = ( 0.5000000 -0.0000000 0.0000000), wk = 0.0037594 k( 40) = ( 0.4920635 0.0158730 0.0000000), wk = 0.0037594 k( 41) = ( 0.4841270 0.0317460 -0.0000000), wk = 0.0037594 k( 42) = ( 0.4761905 0.0476190 0.0000000), wk = 0.0037594 k( 43) = ( 0.4682540 0.0634921 0.0000000), wk = 0.0037594 k( 44) = ( 0.4603175 0.0793651 0.0000000), wk = 0.0037594 k( 45) = ( 0.4523810 0.0952381 0.0000000), wk = 0.0037594 k( 46) = ( 0.4444444 0.1111111 0.0000000), wk = 0.0037594 k( 47) = ( 0.4365079 0.1269841 -0.0000000), wk = 0.0037594 k( 48) = ( 0.4285714 0.1428571 0.0000000), wk = 0.0037594 k( 49) = ( 0.4206349 0.1587302 -0.0000000), wk = 0.0037594 k( 50) = ( 0.4126984 0.1746032 -0.0000000), wk = 0.0037594 k( 51) = ( 0.4047619 0.1904762 0.0000000), wk = 0.0037594 k( 52) = ( 0.3968254 0.2063492 -0.0000000), wk = 0.0037594 k( 53) = ( 0.3888889 0.2222222 -0.0000000), wk = 0.0037594 k( 54) = ( 0.3809524 0.2380952 -0.0000000), wk = 0.0037594 k( 55) = ( 0.3730159 0.2539682 0.0000000), wk = 0.0037594 k( 56) = ( 0.3650794 0.2698413 0.0000000), wk = 0.0037594 k( 57) = ( 0.3571429 0.2857143 0.0000000), wk = 0.0037594 k( 58) = ( 0.3492063 0.3015873 -0.0000000), wk = 0.0037594 k( 59) = ( 0.3412698 0.3174603 0.0000000), wk = 0.0037594 k( 60) = ( 0.3333333 0.3333333 0.0000000), wk = 0.0037594 k( 61) = ( 0.3333333 0.3333333 0.0000000), wk = 0.0037594 k( 62) = ( 0.3253968 0.3253968 -0.0000000), wk = 0.0037594 k( 63) = ( 0.3174603 0.3174603 0.0000000), wk = 0.0037594 k( 64) = ( 0.3095238 0.3095238 -0.0000000), wk = 0.0037594 k( 65) = ( 0.3015873 0.3015873 -0.0000000), wk = 0.0037594 k( 66) = ( 0.2936508 0.2936508 -0.0000000), wk = 0.0037594 k( 67) = ( 0.2857143 0.2857143 0.0000000), wk = 0.0037594 k( 68) = ( 0.2777778 0.2777778 -0.0000000), wk = 0.0037594 k( 69) = ( 0.2698413 0.2698413 -0.0000000), wk = 0.0037594 k( 70) = ( 0.2619048 0.2619048 -0.0000000), wk = 0.0037594 k( 71) = ( 0.2539683 0.2539682 0.0000000), wk = 0.0037594 k( 72) = ( 0.2460317 0.2460317 -0.0000000), wk = 0.0037594 k( 73) = ( 0.2380952 0.2380952 0.0000000), wk = 0.0037594 k( 74) = ( 0.2301587 0.2301587 0.0000000), wk = 0.0037594 k( 75) = ( 0.2222222 0.2222222 -0.0000000), wk = 0.0037594 k( 76) = ( 0.2142857 0.2142857 -0.0000000), wk = 0.0037594 k( 77) = ( 0.2063492 0.2063492 0.0000000), wk = 0.0037594 k( 78) = ( 0.1984127 0.1984127 0.0000000), wk = 0.0037594 k( 79) = ( 0.1904762 0.1904762 -0.0000000), wk = 0.0037594 k( 80) = ( 0.1825397 0.1825397 -0.0000000), wk = 0.0037594 k( 81) = ( 0.1746032 0.1746032 0.0000000), wk = 0.0037594 k( 82) = ( 0.1666667 0.1666667 0.0000000), wk = 0.0037594 k( 83) = ( 0.1587302 0.1587302 0.0000000), wk = 0.0037594 k( 84) = ( 0.1507937 0.1507937 -0.0000000), wk = 0.0037594 k( 85) = ( 0.1428571 0.1428571 0.0000000), wk = 0.0037594 k( 86) = ( 0.1349206 0.1349206 -0.0000000), wk = 0.0037594 k( 87) = ( 0.1269841 0.1269841 -0.0000000), wk = 0.0037594 k( 88) = ( 0.1190476 0.1190476 0.0000000), wk = 0.0037594 k( 89) = ( 0.1111111 0.1111111 -0.0000000), wk = 0.0037594 k( 90) = ( 0.1031746 0.1031746 0.0000000), wk = 0.0037594 k( 91) = ( 0.0952381 0.0952381 -0.0000000), wk = 0.0037594 k( 92) = ( 0.0873016 0.0873016 -0.0000000), wk = 0.0037594 k( 93) = ( 0.0793651 0.0793651 0.0000000), wk = 0.0037594 k( 94) = ( 0.0714286 0.0714286 0.0000000), wk = 0.0037594 k( 95) = ( 0.0634921 0.0634921 0.0000000), wk = 0.0037594 k( 96) = ( 0.0555556 0.0555556 0.0000000), wk = 0.0037594 k( 97) = ( 0.0476191 0.0476190 -0.0000000), wk = 0.0037594 k( 98) = ( 0.0396825 0.0396825 0.0000000), wk = 0.0037594 k( 99) = ( 0.0317460 0.0317460 0.0000000), wk = 0.0037594 k( 100) = ( 0.0238095 0.0238095 0.0000000), wk = 0.0037594 k( 101) = ( 0.0158730 0.0158730 0.0000000), wk = 0.0037594 k( 102) = ( 0.0079365 0.0079365 0.0000000), wk = 0.0037594 k( 103) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0037594 k( 104) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0037594 k( 105) = ( 0.0000000 0.0000000 0.0263158), wk = 0.0037594 k( 106) = ( 0.0000000 0.0000000 0.0526316), wk = 0.0037594 k( 107) = ( 0.0000000 0.0000000 0.0789474), wk = 0.0037594 k( 108) = ( 0.0000000 0.0000000 0.1052632), wk = 0.0037594 k( 109) = ( 0.0000000 0.0000000 0.1315790), wk = 0.0037594 k( 110) = ( 0.0000000 0.0000000 0.1578947), wk = 0.0037594 k( 111) = ( 0.0000000 0.0000000 0.1842105), wk = 0.0037594 k( 112) = ( 0.0000000 0.0000000 0.2105263), wk = 0.0037594 k( 113) = ( 0.0000000 0.0000000 0.2368421), wk = 0.0037594 k( 114) = ( 0.0000000 0.0000000 0.2631579), wk = 0.0037594 k( 115) = ( 0.0000000 0.0000000 0.2894737), wk = 0.0037594 k( 116) = ( 0.0000000 0.0000000 0.3157895), wk = 0.0037594 k( 117) = ( 0.0000000 0.0000000 0.3421053), wk = 0.0037594 k( 118) = ( 0.0000000 0.0000000 0.3684211), wk = 0.0037594 k( 119) = ( 0.0000000 0.0000000 0.3947368), wk = 0.0037594 k( 120) = ( 0.0000000 0.0000000 0.4210526), wk = 0.0037594 k( 121) = ( 0.0000000 0.0000000 0.4473684), wk = 0.0037594 k( 122) = ( 0.0000000 0.0000000 0.4736842), wk = 0.0037594 k( 123) = ( 0.0000000 0.0000000 0.5000000), wk = 0.0037594 k( 124) = ( 0.0000000 0.0000000 0.5000000), wk = 0.0037594 k( 125) = ( 0.0135135 -0.0000000 0.5000000), wk = 0.0037594 k( 126) = ( 0.0270270 -0.0000000 0.5000000), wk = 0.0037594 k( 127) = ( 0.0405405 -0.0000000 0.5000000), wk = 0.0037594 k( 128) = ( 0.0540540 -0.0000000 0.5000000), wk = 0.0037594 k( 129) = ( 0.0675676 -0.0000000 0.5000000), wk = 0.0037594 k( 130) = ( 0.0810811 -0.0000000 0.5000000), wk = 0.0037594 k( 131) = ( 0.0945946 -0.0000000 0.5000000), wk = 0.0037594 k( 132) = ( 0.1081081 -0.0000000 0.5000000), wk = 0.0037594 k( 133) = ( 0.1216216 -0.0000000 0.5000000), wk = 0.0037594 k( 134) = ( 0.1351351 -0.0000000 0.5000000), wk = 0.0037594 k( 135) = ( 0.1486486 -0.0000000 0.5000000), wk = 0.0037594 k( 136) = ( 0.1621622 -0.0000000 0.5000000), wk = 0.0037594 k( 137) = ( 0.1756757 -0.0000000 0.5000000), wk = 0.0037594 k( 138) = ( 0.1891892 -0.0000000 0.5000000), wk = 0.0037594 k( 139) = ( 0.2027027 -0.0000000 0.5000000), wk = 0.0037594 k( 140) = ( 0.2162162 -0.0000000 0.5000000), wk = 0.0037594 k( 141) = ( 0.2297297 -0.0000000 0.5000000), wk = 0.0037594 k( 142) = ( 0.2432432 -0.0000000 0.5000000), wk = 0.0037594 k( 143) = ( 0.2567568 -0.0000000 0.5000000), wk = 0.0037594 k( 144) = ( 0.2702703 -0.0000000 0.5000000), wk = 0.0037594 k( 145) = ( 0.2837838 -0.0000000 0.5000000), wk = 0.0037594 k( 146) = ( 0.2972973 -0.0000000 0.5000000), wk = 0.0037594 k( 147) = ( 0.3108108 0.0000000 0.5000000), wk = 0.0037594 k( 148) = ( 0.3243243 -0.0000000 0.5000000), wk = 0.0037594 k( 149) = ( 0.3378378 0.0000000 0.5000000), wk = 0.0037594 k( 150) = ( 0.3513514 -0.0000000 0.5000000), wk = 0.0037594 k( 151) = ( 0.3648649 -0.0000000 0.5000000), wk = 0.0037594 k( 152) = ( 0.3783784 -0.0000000 0.5000000), wk = 0.0037594 k( 153) = ( 0.3918919 -0.0000000 0.5000000), wk = 0.0037594 k( 154) = ( 0.4054054 0.0000000 0.5000000), wk = 0.0037594 k( 155) = ( 0.4189189 0.0000000 0.5000000), wk = 0.0037594 k( 156) = ( 0.4324324 -0.0000000 0.5000000), wk = 0.0037594 k( 157) = ( 0.4459459 0.0000000 0.5000000), wk = 0.0037594 k( 158) = ( 0.4594595 -0.0000000 0.5000000), wk = 0.0037594 k( 159) = ( 0.4729730 -0.0000000 0.5000000), wk = 0.0037594 k( 160) = ( 0.4864865 -0.0000000 0.5000000), wk = 0.0037594 k( 161) = ( 0.5000000 -0.0000000 0.5000000), wk = 0.0037594 k( 162) = ( 0.5000000 -0.0000000 0.5000000), wk = 0.0037594 k( 163) = ( 0.4920635 0.0158730 0.5000000), wk = 0.0037594 k( 164) = ( 0.4841270 0.0317460 0.5000000), wk = 0.0037594 k( 165) = ( 0.4761905 0.0476190 0.5000000), wk = 0.0037594 k( 166) = ( 0.4682540 0.0634921 0.5000000), wk = 0.0037594 k( 167) = ( 0.4603175 0.0793651 0.5000000), wk = 0.0037594 k( 168) = ( 0.4523810 0.0952381 0.5000000), wk = 0.0037594 k( 169) = ( 0.4444444 0.1111111 0.5000000), wk = 0.0037594 k( 170) = ( 0.4365079 0.1269841 0.5000000), wk = 0.0037594 k( 171) = ( 0.4285714 0.1428571 0.5000000), wk = 0.0037594 k( 172) = ( 0.4206349 0.1587302 0.5000000), wk = 0.0037594 k( 173) = ( 0.4126984 0.1746032 0.5000000), wk = 0.0037594 k( 174) = ( 0.4047619 0.1904762 0.5000000), wk = 0.0037594 k( 175) = ( 0.3968254 0.2063492 0.5000000), wk = 0.0037594 k( 176) = ( 0.3888889 0.2222222 0.5000000), wk = 0.0037594 k( 177) = ( 0.3809524 0.2380952 0.5000000), wk = 0.0037594 k( 178) = ( 0.3730159 0.2539682 0.5000000), wk = 0.0037594 k( 179) = ( 0.3650794 0.2698413 0.5000000), wk = 0.0037594 k( 180) = ( 0.3571429 0.2857143 0.5000000), wk = 0.0037594 k( 181) = ( 0.3492063 0.3015873 0.5000000), wk = 0.0037594 k( 182) = ( 0.3412698 0.3174603 0.5000000), wk = 0.0037594 k( 183) = ( 0.3333333 0.3333333 0.5000000), wk = 0.0037594 k( 184) = ( 0.3333333 0.3333333 0.5000000), wk = 0.0037594 k( 185) = ( 0.3253968 0.3253968 0.5000000), wk = 0.0037594 k( 186) = ( 0.3174603 0.3174603 0.5000000), wk = 0.0037594 k( 187) = ( 0.3095238 0.3095238 0.5000000), wk = 0.0037594 k( 188) = ( 0.3015873 0.3015873 0.5000000), wk = 0.0037594 k( 189) = ( 0.2936508 0.2936508 0.5000000), wk = 0.0037594 k( 190) = ( 0.2857143 0.2857143 0.5000000), wk = 0.0037594 k( 191) = ( 0.2777778 0.2777778 0.5000000), wk = 0.0037594 k( 192) = ( 0.2698413 0.2698413 0.5000000), wk = 0.0037594 k( 193) = ( 0.2619048 0.2619048 0.5000000), wk = 0.0037594 k( 194) = ( 0.2539683 0.2539682 0.5000000), wk = 0.0037594 k( 195) = ( 0.2460317 0.2460317 0.5000000), wk = 0.0037594 k( 196) = ( 0.2380952 0.2380952 0.5000000), wk = 0.0037594 k( 197) = ( 0.2301587 0.2301587 0.5000000), wk = 0.0037594 k( 198) = ( 0.2222222 0.2222222 0.5000000), wk = 0.0037594 k( 199) = ( 0.2142857 0.2142857 0.5000000), wk = 0.0037594 k( 200) = ( 0.2063492 0.2063492 0.5000000), wk = 0.0037594 k( 201) = ( 0.1984127 0.1984127 0.5000000), wk = 0.0037594 k( 202) = ( 0.1904762 0.1904762 0.5000000), wk = 0.0037594 k( 203) = ( 0.1825397 0.1825397 0.5000000), wk = 0.0037594 k( 204) = ( 0.1746032 0.1746032 0.5000000), wk = 0.0037594 k( 205) = ( 0.1666667 0.1666667 0.5000000), wk = 0.0037594 k( 206) = ( 0.1587302 0.1587302 0.5000000), wk = 0.0037594 k( 207) = ( 0.1507937 0.1507937 0.5000000), wk = 0.0037594 k( 208) = ( 0.1428571 0.1428571 0.5000000), wk = 0.0037594 k( 209) = ( 0.1349206 0.1349206 0.5000000), wk = 0.0037594 k( 210) = ( 0.1269841 0.1269841 0.5000000), wk = 0.0037594 k( 211) = ( 0.1190476 0.1190476 0.5000000), wk = 0.0037594 k( 212) = ( 0.1111111 0.1111111 0.5000000), wk = 0.0037594 k( 213) = ( 0.1031746 0.1031746 0.5000000), wk = 0.0037594 k( 214) = ( 0.0952381 0.0952381 0.5000000), wk = 0.0037594 k( 215) = ( 0.0873016 0.0873016 0.5000000), wk = 0.0037594 k( 216) = ( 0.0793651 0.0793651 0.5000000), wk = 0.0037594 k( 217) = ( 0.0714286 0.0714286 0.5000000), wk = 0.0037594 k( 218) = ( 0.0634921 0.0634921 0.5000000), wk = 0.0037594 k( 219) = ( 0.0555556 0.0555556 0.5000000), wk = 0.0037594 k( 220) = ( 0.0476191 0.0476190 0.5000000), wk = 0.0037594 k( 221) = ( 0.0396825 0.0396825 0.5000000), wk = 0.0037594 k( 222) = ( 0.0317460 0.0317460 0.5000000), wk = 0.0037594 k( 223) = ( 0.0238095 0.0238095 0.5000000), wk = 0.0037594 k( 224) = ( 0.0158730 0.0158730 0.5000000), wk = 0.0037594 k( 225) = ( 0.0079365 0.0079365 0.5000000), wk = 0.0037594 k( 226) = ( 0.0000000 0.0000000 0.5000000), wk = 0.0037594 k( 227) = ( 0.5000000 -0.0000000 0.5000000), wk = 0.0037594 k( 228) = ( 0.5000000 -0.0000000 0.4736842), wk = 0.0037594 k( 229) = ( 0.5000000 -0.0000000 0.4473684), wk = 0.0037594 k( 230) = ( 0.5000000 -0.0000000 0.4210526), wk = 0.0037594 k( 231) = ( 0.5000000 -0.0000000 0.3947368), wk = 0.0037594 k( 232) = ( 0.5000000 -0.0000000 0.3684211), wk = 0.0037594 k( 233) = ( 0.5000000 -0.0000000 0.3421053), wk = 0.0037594 k( 234) = ( 0.5000000 -0.0000000 0.3157895), wk = 0.0037594 k( 235) = ( 0.5000000 -0.0000000 0.2894737), wk = 0.0037594 k( 236) = ( 0.5000000 -0.0000000 0.2631579), wk = 0.0037594 k( 237) = ( 0.5000000 -0.0000000 0.2368421), wk = 0.0037594 k( 238) = ( 0.5000000 -0.0000000 0.2105263), wk = 0.0037594 k( 239) = ( 0.5000000 -0.0000000 0.1842105), wk = 0.0037594 k( 240) = ( 0.5000000 -0.0000000 0.1578947), wk = 0.0037594 k( 241) = ( 0.5000000 -0.0000000 0.1315790), wk = 0.0037594 k( 242) = ( 0.5000000 -0.0000000 0.1052632), wk = 0.0037594 k( 243) = ( 0.5000000 -0.0000000 0.0789474), wk = 0.0037594 k( 244) = ( 0.5000000 -0.0000000 0.0526316), wk = 0.0037594 k( 245) = ( 0.5000000 -0.0000000 0.0263158), wk = 0.0037594 k( 246) = ( 0.5000000 -0.0000000 0.0000000), wk = 0.0037594 k( 247) = ( 0.3333333 0.3333333 0.0000000), wk = 0.0037594 k( 248) = ( 0.3333333 0.3333333 0.0263158), wk = 0.0037594 k( 249) = ( 0.3333333 0.3333333 0.0526316), wk = 0.0037594 k( 250) = ( 0.3333333 0.3333333 0.0789474), wk = 0.0037594 k( 251) = ( 0.3333333 0.3333333 0.1052632), wk = 0.0037594 k( 252) = ( 0.3333333 0.3333333 0.1315790), wk = 0.0037594 k( 253) = ( 0.3333333 0.3333333 0.1578947), wk = 0.0037594 k( 254) = ( 0.3333333 0.3333333 0.1842105), wk = 0.0037594 k( 255) = ( 0.3333333 0.3333333 0.2105263), wk = 0.0037594 k( 256) = ( 0.3333333 0.3333333 0.2368421), wk = 0.0037594 k( 257) = ( 0.3333333 0.3333333 0.2631579), wk = 0.0037594 k( 258) = ( 0.3333333 0.3333333 0.2894737), wk = 0.0037594 k( 259) = ( 0.3333333 0.3333333 0.3157895), wk = 0.0037594 k( 260) = ( 0.3333333 0.3333333 0.3421053), wk = 0.0037594 k( 261) = ( 0.3333333 0.3333333 0.3684211), wk = 0.0037594 k( 262) = ( 0.3333333 0.3333333 0.3947368), wk = 0.0037594 k( 263) = ( 0.3333333 0.3333333 0.4210526), wk = 0.0037594 k( 264) = ( 0.3333333 0.3333333 0.4473684), wk = 0.0037594 k( 265) = ( 0.3333333 0.3333333 0.4736842), wk = 0.0037594 k( 266) = ( 0.3333333 0.3333333 0.5000000), wk = 0.0037594 Dense grid: 123799 G-vectors FFT dimensions: ( 60, 60, 96) Smooth grid: 54641 G-vectors FFT dimensions: ( 45, 45, 72) Largest allocated arrays est. size (Mb) dimensions Kohn-Sham Wavefunctions 0.61 Mb ( 398, 100) NL pseudopotentials 0.75 Mb ( 199, 248) Each V/rho on FFT grid 0.16 Mb ( 10800) Each G-vector array 0.03 Mb ( 3441) G-vector shells 0.01 Mb ( 1593) Largest temporary arrays est. size (Mb) dimensions Auxiliary wavefunctions 2.43 Mb ( 398, 400) Each subspace H/S matrix 0.15 Mb ( 100, 100) Each matrix 0.76 Mb ( 248, 2, 100) Check: negative/imaginary core charge= -0.000003 0.000000 The potential is recalculated from file : ./TaTlxPO4x2.save/charge-density.dat Starting wfc are 118 randomized atomic wfcs Band Structure Calculation Davidson diagonalization with overlap Computing kpt #: 1 total cpu time spent up to now is 6.1 secs Computing kpt #: 2 total cpu time spent up to now is 8.5 secs Computing kpt #: 3 total cpu time spent up to now is 10.9 secs Computing kpt #: 4 total cpu time spent up to now is 13.2 secs Computing kpt #: 5 total cpu time spent up to now is 15.7 secs Computing kpt #: 6 total cpu time spent up to now is 18.2 secs Computing kpt #: 7 total cpu time spent up to now is 20.7 secs Computing kpt #: 8 total cpu time spent up to now is 23.3 secs Computing kpt #: 9 total cpu time spent up to now is 25.7 secs Computing kpt #: 10 total cpu time spent up to now is 28.3 secs Computing kpt #: 11 total cpu time spent up to now is 31.0 secs Computing kpt #: 12 total cpu time spent up to now is 33.7 secs Computing kpt #: 13 total cpu time spent up to now is 36.4 secs Computing kpt #: 14 total cpu time spent up to now is 39.4 secs Computing kpt #: 15 total cpu time spent up to now is 42.7 secs Computing kpt #: 16 total cpu time spent up to now is 47.0 secs Computing kpt #: 17 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 51.5 secs Computing kpt #: 18 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 56.1 secs Computing kpt #: 19 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 60.6 secs Computing kpt #: 20 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 65.1 secs Computing kpt #: 21 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 69.5 secs Computing kpt #: 22 total cpu time spent up to now is 73.9 secs Computing kpt #: 23 total cpu time spent up to now is 78.0 secs Computing kpt #: 24 total cpu time spent up to now is 82.3 secs Computing kpt #: 25 total cpu time spent up to now is 86.7 secs Computing kpt #: 26 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 91.3 secs Computing kpt #: 27 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 95.8 secs Computing kpt #: 28 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 100.3 secs Computing kpt #: 29 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 104.8 secs Computing kpt #: 30 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 109.3 secs Computing kpt #: 31 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 113.9 secs Computing kpt #: 32 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 118.5 secs Computing kpt #: 33 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 123.0 secs Computing kpt #: 34 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 127.5 secs Computing kpt #: 35 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 132.1 secs Computing kpt #: 36 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 136.6 secs Computing kpt #: 37 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 141.1 secs Computing kpt #: 38 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 145.7 secs Computing kpt #: 39 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 150.3 secs Computing kpt #: 40 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 155.4 secs Computing kpt #: 41 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 159.9 secs Computing kpt #: 42 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 164.4 secs Computing kpt #: 43 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 168.9 secs Computing kpt #: 44 total cpu time spent up to now is 172.9 secs Computing kpt #: 45 total cpu time spent up to now is 177.0 secs Computing kpt #: 46 total cpu time spent up to now is 180.5 secs Computing kpt #: 47 total cpu time spent up to now is 183.2 secs Computing kpt #: 48 total cpu time spent up to now is 185.9 secs Computing kpt #: 49 total cpu time spent up to now is 188.5 secs Computing kpt #: 50 total cpu time spent up to now is 190.9 secs Computing kpt #: 51 total cpu time spent up to now is 193.3 secs Computing kpt #: 52 total cpu time spent up to now is 195.8 secs Computing kpt #: 53 total cpu time spent up to now is 198.2 secs Computing kpt #: 54 total cpu time spent up to now is 200.5 secs Computing kpt #: 55 total cpu time spent up to now is 202.9 secs Computing kpt #: 56 total cpu time spent up to now is 205.0 secs Computing kpt #: 57 total cpu time spent up to now is 207.2 secs Computing kpt #: 58 total cpu time spent up to now is 209.4 secs Computing kpt #: 59 total cpu time spent up to now is 211.7 secs Computing kpt #: 60 total cpu time spent up to now is 213.9 secs Computing kpt #: 61 total cpu time spent up to now is 216.1 secs Computing kpt #: 62 total cpu time spent up to now is 218.2 secs Computing kpt #: 63 total cpu time spent up to now is 220.4 secs Computing kpt #: 64 total cpu time spent up to now is 222.7 secs Computing kpt #: 65 total cpu time spent up to now is 224.9 secs Computing kpt #: 66 total cpu time spent up to now is 227.1 secs Computing kpt #: 67 total cpu time spent up to now is 229.6 secs Computing kpt #: 68 total cpu time spent up to now is 232.0 secs Computing kpt #: 69 total cpu time spent up to now is 234.4 secs Computing kpt #: 70 total cpu time spent up to now is 236.9 secs Computing kpt #: 71 total cpu time spent up to now is 239.4 secs Computing kpt #: 72 total cpu time spent up to now is 241.9 secs Computing kpt #: 73 total cpu time spent up to now is 244.5 secs Computing kpt #: 74 total cpu time spent up to now is 247.3 secs Computing kpt #: 75 total cpu time spent up to now is 250.5 secs Computing kpt #: 76 total cpu time spent up to now is 253.8 secs Computing kpt #: 77 total cpu time spent up to now is 257.3 secs Computing kpt #: 78 total cpu time spent up to now is 261.0 secs Computing kpt #: 79 total cpu time spent up to now is 264.7 secs Computing kpt #: 80 total cpu time spent up to now is 268.5 secs Computing kpt #: 81 total cpu time spent up to now is 272.2 secs Computing kpt #: 82 total cpu time spent up to now is 276.1 secs Computing kpt #: 83 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 280.6 secs Computing kpt #: 84 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 285.1 secs Computing kpt #: 85 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 289.7 secs Computing kpt #: 86 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 294.2 secs Computing kpt #: 87 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 298.8 secs Computing kpt #: 88 total cpu time spent up to now is 303.0 secs Computing kpt #: 89 total cpu time spent up to now is 306.8 secs Computing kpt #: 90 total cpu time spent up to now is 310.0 secs Computing kpt #: 91 total cpu time spent up to now is 313.1 secs Computing kpt #: 92 total cpu time spent up to now is 315.9 secs Computing kpt #: 93 total cpu time spent up to now is 318.6 secs Computing kpt #: 94 total cpu time spent up to now is 321.3 secs Computing kpt #: 95 total cpu time spent up to now is 323.8 secs Computing kpt #: 96 total cpu time spent up to now is 326.4 secs Computing kpt #: 97 total cpu time spent up to now is 328.9 secs Computing kpt #: 98 total cpu time spent up to now is 331.4 secs Computing kpt #: 99 total cpu time spent up to now is 333.9 secs Computing kpt #: 100 total cpu time spent up to now is 336.3 secs Computing kpt #: 101 total cpu time spent up to now is 338.7 secs Computing kpt #: 102 total cpu time spent up to now is 341.0 secs Computing kpt #: 103 total cpu time spent up to now is 343.4 secs Computing kpt #: 104 total cpu time spent up to now is 345.8 secs Computing kpt #: 105 total cpu time spent up to now is 348.2 secs Computing kpt #: 106 total cpu time spent up to now is 350.2 secs Computing kpt #: 107 total cpu time spent up to now is 352.6 secs Computing kpt #: 108 total cpu time spent up to now is 355.0 secs Computing kpt #: 109 total cpu time spent up to now is 357.1 secs Computing kpt #: 110 total cpu time spent up to now is 359.6 secs Computing kpt #: 111 total cpu time spent up to now is 362.0 secs Computing kpt #: 112 total cpu time spent up to now is 364.6 secs Computing kpt #: 113 total cpu time spent up to now is 367.7 secs Computing kpt #: 114 total cpu time spent up to now is 371.2 secs Computing kpt #: 115 total cpu time spent up to now is 374.7 secs Computing kpt #: 116 total cpu time spent up to now is 379.1 secs Computing kpt #: 117 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 383.5 secs Computing kpt #: 118 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 387.9 secs Computing kpt #: 119 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 392.5 secs Computing kpt #: 120 total cpu time spent up to now is 396.3 secs Computing kpt #: 121 total cpu time spent up to now is 400.0 secs Computing kpt #: 122 total cpu time spent up to now is 403.7 secs Computing kpt #: 123 total cpu time spent up to now is 406.4 secs Computing kpt #: 124 total cpu time spent up to now is 409.1 secs Computing kpt #: 125 total cpu time spent up to now is 412.8 secs Computing kpt #: 126 total cpu time spent up to now is 416.4 secs Computing kpt #: 127 total cpu time spent up to now is 420.1 secs Computing kpt #: 128 total cpu time spent up to now is 423.9 secs Computing kpt #: 129 total cpu time spent up to now is 427.8 secs Computing kpt #: 130 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 432.3 secs Computing kpt #: 131 total cpu time spent up to now is 436.0 secs Computing kpt #: 132 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 440.5 secs Computing kpt #: 133 total cpu time spent up to now is 444.6 secs Computing kpt #: 134 total cpu time spent up to now is 448.7 secs Computing kpt #: 135 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 453.5 secs Computing kpt #: 136 total cpu time spent up to now is 457.6 secs Computing kpt #: 137 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 462.1 secs Computing kpt #: 138 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 466.5 secs Computing kpt #: 139 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 470.9 secs Computing kpt #: 140 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 475.3 secs Computing kpt #: 141 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 479.7 secs Computing kpt #: 142 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 484.1 secs Computing kpt #: 143 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 488.5 secs Computing kpt #: 144 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 492.9 secs Computing kpt #: 145 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 497.4 secs Computing kpt #: 146 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 501.8 secs Computing kpt #: 147 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 506.2 secs Computing kpt #: 148 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 510.6 secs Computing kpt #: 149 total cpu time spent up to now is 514.4 secs Computing kpt #: 150 total cpu time spent up to now is 518.3 secs Computing kpt #: 151 total cpu time spent up to now is 522.1 secs Computing kpt #: 152 total cpu time spent up to now is 525.8 secs Computing kpt #: 153 total cpu time spent up to now is 529.4 secs Computing kpt #: 154 total cpu time spent up to now is 532.9 secs Computing kpt #: 155 total cpu time spent up to now is 536.4 secs Computing kpt #: 156 total cpu time spent up to now is 540.0 secs Computing kpt #: 157 total cpu time spent up to now is 543.3 secs Computing kpt #: 158 total cpu time spent up to now is 546.6 secs Computing kpt #: 159 total cpu time spent up to now is 549.8 secs Computing kpt #: 160 total cpu time spent up to now is 553.1 secs Computing kpt #: 161 total cpu time spent up to now is 556.3 secs Computing kpt #: 162 total cpu time spent up to now is 559.6 secs Computing kpt #: 163 total cpu time spent up to now is 562.8 secs Computing kpt #: 164 total cpu time spent up to now is 566.1 secs Computing kpt #: 165 total cpu time spent up to now is 569.3 secs Computing kpt #: 166 total cpu time spent up to now is 572.4 secs Computing kpt #: 167 total cpu time spent up to now is 575.6 secs Computing kpt #: 168 total cpu time spent up to now is 578.7 secs Computing kpt #: 169 total cpu time spent up to now is 581.9 secs Computing kpt #: 170 total cpu time spent up to now is 585.0 secs Computing kpt #: 171 total cpu time spent up to now is 588.2 secs Computing kpt #: 172 total cpu time spent up to now is 591.1 secs Computing kpt #: 173 total cpu time spent up to now is 594.1 secs Computing kpt #: 174 total cpu time spent up to now is 596.8 secs Computing kpt #: 175 total cpu time spent up to now is 599.4 secs Computing kpt #: 176 total cpu time spent up to now is 601.9 secs Computing kpt #: 177 total cpu time spent up to now is 604.4 secs Computing kpt #: 178 total cpu time spent up to now is 606.9 secs Computing kpt #: 179 total cpu time spent up to now is 609.4 secs Computing kpt #: 180 total cpu time spent up to now is 611.9 secs Computing kpt #: 181 total cpu time spent up to now is 614.3 secs Computing kpt #: 182 total cpu time spent up to now is 616.8 secs Computing kpt #: 183 total cpu time spent up to now is 619.2 secs Computing kpt #: 184 total cpu time spent up to now is 621.7 secs Computing kpt #: 185 total cpu time spent up to now is 624.0 secs Computing kpt #: 186 total cpu time spent up to now is 626.5 secs Computing kpt #: 187 total cpu time spent up to now is 628.9 secs Computing kpt #: 188 total cpu time spent up to now is 631.4 secs Computing kpt #: 189 total cpu time spent up to now is 633.9 secs Computing kpt #: 190 total cpu time spent up to now is 636.4 secs Computing kpt #: 191 total cpu time spent up to now is 638.9 secs Computing kpt #: 192 total cpu time spent up to now is 641.4 secs Computing kpt #: 193 total cpu time spent up to now is 644.0 secs Computing kpt #: 194 total cpu time spent up to now is 646.6 secs Computing kpt #: 195 total cpu time spent up to now is 649.2 secs Computing kpt #: 196 total cpu time spent up to now is 651.8 secs Computing kpt #: 197 total cpu time spent up to now is 654.4 secs Computing kpt #: 198 total cpu time spent up to now is 657.0 secs Computing kpt #: 199 total cpu time spent up to now is 659.7 secs Computing kpt #: 200 total cpu time spent up to now is 662.3 secs Computing kpt #: 201 total cpu time spent up to now is 665.0 secs Computing kpt #: 202 total cpu time spent up to now is 667.7 secs Computing kpt #: 203 total cpu time spent up to now is 670.7 secs Computing kpt #: 204 total cpu time spent up to now is 673.8 secs Computing kpt #: 205 total cpu time spent up to now is 676.8 secs Computing kpt #: 206 total cpu time spent up to now is 680.0 secs Computing kpt #: 207 total cpu time spent up to now is 683.5 secs Computing kpt #: 208 total cpu time spent up to now is 686.8 secs Computing kpt #: 209 total cpu time spent up to now is 690.5 secs Computing kpt #: 210 total cpu time spent up to now is 694.2 secs Computing kpt #: 211 total cpu time spent up to now is 698.0 secs Computing kpt #: 212 total cpu time spent up to now is 701.7 secs Computing kpt #: 213 total cpu time spent up to now is 705.8 secs Computing kpt #: 214 total cpu time spent up to now is 709.9 secs Computing kpt #: 215 total cpu time spent up to now is 713.7 secs Computing kpt #: 216 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 718.2 secs Computing kpt #: 217 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 722.7 secs Computing kpt #: 218 total cpu time spent up to now is 726.5 secs Computing kpt #: 219 total cpu time spent up to now is 730.8 secs Computing kpt #: 220 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 735.2 secs Computing kpt #: 221 total cpu time spent up to now is 739.1 secs Computing kpt #: 222 total cpu time spent up to now is 742.8 secs Computing kpt #: 223 total cpu time spent up to now is 746.6 secs Computing kpt #: 224 total cpu time spent up to now is 750.2 secs Computing kpt #: 225 total cpu time spent up to now is 754.4 secs Computing kpt #: 226 total cpu time spent up to now is 757.1 secs Computing kpt #: 227 total cpu time spent up to now is 760.4 secs Computing kpt #: 228 total cpu time spent up to now is 763.6 secs Computing kpt #: 229 total cpu time spent up to now is 766.9 secs Computing kpt #: 230 total cpu time spent up to now is 770.4 secs Computing kpt #: 231 total cpu time spent up to now is 773.9 secs Computing kpt #: 232 total cpu time spent up to now is 777.4 secs Computing kpt #: 233 total cpu time spent up to now is 781.1 secs Computing kpt #: 234 total cpu time spent up to now is 785.0 secs Computing kpt #: 235 total cpu time spent up to now is 789.3 secs Computing kpt #: 236 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 793.7 secs Computing kpt #: 237 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 798.2 secs Computing kpt #: 238 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 802.7 secs Computing kpt #: 239 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 807.2 secs Computing kpt #: 240 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 811.8 secs Computing kpt #: 241 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 816.3 secs Computing kpt #: 242 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 820.9 secs Computing kpt #: 243 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 825.4 secs Computing kpt #: 244 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 830.0 secs Computing kpt #: 245 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 834.5 secs Computing kpt #: 246 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 839.1 secs Computing kpt #: 247 total cpu time spent up to now is 841.3 secs Computing kpt #: 248 total cpu time spent up to now is 843.4 secs Computing kpt #: 249 total cpu time spent up to now is 845.6 secs Computing kpt #: 250 total cpu time spent up to now is 847.8 secs Computing kpt #: 251 total cpu time spent up to now is 850.2 secs Computing kpt #: 252 total cpu time spent up to now is 852.7 secs Computing kpt #: 253 total cpu time spent up to now is 855.1 secs Computing kpt #: 254 total cpu time spent up to now is 857.5 secs Computing kpt #: 255 total cpu time spent up to now is 859.9 secs Computing kpt #: 256 total cpu time spent up to now is 862.3 secs Computing kpt #: 257 total cpu time spent up to now is 864.8 secs Computing kpt #: 258 total cpu time spent up to now is 867.2 secs Computing kpt #: 259 total cpu time spent up to now is 869.7 secs Computing kpt #: 260 total cpu time spent up to now is 872.2 secs Computing kpt #: 261 total cpu time spent up to now is 874.7 secs Computing kpt #: 262 total cpu time spent up to now is 877.2 secs Computing kpt #: 263 total cpu time spent up to now is 879.7 secs Computing kpt #: 264 total cpu time spent up to now is 882.2 secs Computing kpt #: 265 total cpu time spent up to now is 884.6 secs Computing kpt #: 266 total cpu time spent up to now is 887.0 secs ethr = 1.19E-08, avg # of iterations = 76.4 total cpu time spent up to now is 887.0 secs End of band structure calculation k = 0.0000 0.0000 0.0000 ( 6869 PWs) bands (ev): -64.4515 -64.4515 -37.3780 -37.3780 -28.8154 -28.8154 -28.8088 -28.8088 -17.1260 -17.1260 -16.5058 -16.5058 -14.9077 -14.9077 -14.8759 -14.8759 -14.5781 -14.5781 -14.4532 -14.4532 -10.1736 -10.1736 -10.0301 -10.0301 -6.1635 -6.1635 -5.9309 -5.9309 -5.8422 -5.8422 -4.3867 -4.3867 -3.7568 -3.7568 -3.7074 -3.7074 -3.6353 -3.6353 -3.4481 -3.4481 -3.4183 -3.4183 -2.6636 -2.6636 -2.4800 -2.4800 -2.0502 -2.0502 -0.8593 -0.8593 -0.7302 -0.7302 -0.7156 -0.7156 0.9392 0.9392 0.9818 0.9818 1.5641 1.5641 1.7107 1.7107 1.7200 1.7200 2.1012 2.1012 2.4142 2.4142 2.4290 2.4290 2.5005 2.5005 3.9716 3.9716 4.4636 4.4636 4.4741 4.4741 4.5108 4.5108 4.5724 4.5724 4.5822 4.5822 4.7850 4.7850 5.5121 5.5121 7.4916 7.4916 7.7462 7.7462 8.0374 8.0374 9.0792 9.0792 10.1295 10.1295 10.1823 10.1823 k = 0.0135 0.0078-0.0000 ( 6885 PWs) bands (ev): -64.4515 -64.4515 -37.3780 -37.3780 -28.8154 -28.8154 -28.8089 -28.8088 -17.1254 -17.1254 -16.5076 -16.5050 -14.9108 -14.9041 -14.8755 -14.8754 -14.5801 -14.5769 -14.4537 -14.4537 -10.1735 -10.1735 -10.0301 -10.0301 -6.1621 -6.1620 -5.9309 -5.9308 -5.8422 -5.8422 -4.3990 -4.3843 -3.7569 -3.7568 -3.7074 -3.7074 -3.6354 -3.6348 -3.4483 -3.4432 -3.4157 -3.4153 -2.6696 -2.6583 -2.4806 -2.4806 -2.0496 -2.0492 -0.8670 -0.8601 -0.7293 -0.7251 -0.7122 -0.7104 0.9379 0.9384 0.9806 0.9807 1.5637 1.5637 1.7065 1.7086 1.7178 1.7181 2.1025 2.1028 2.4119 2.4150 2.4283 2.4284 2.4995 2.5005 3.9721 3.9735 4.4586 4.4605 4.4691 4.4711 4.5142 4.5152 4.5728 4.5739 4.5840 4.5860 4.7856 4.7856 5.5115 5.5119 7.4705 7.5081 7.7475 7.7480 8.0197 8.0568 9.0771 9.0814 10.1208 10.1382 10.1841 10.1844 k = 0.0270 0.0156-0.0000 ( 6896 PWs) bands (ev): -64.4515 -64.4515 -37.3780 -37.3780 -28.8155 -28.8155 -28.8089 -28.8088 -17.1236 -17.1236 -16.5105 -16.5053 -14.9132 -14.9005 -14.8743 -14.8735 -14.5831 -14.5766 -14.4555 -14.4555 -10.1733 -10.1733 -10.0303 -10.0303 -6.1578 -6.1577 -5.9309 -5.9307 -5.8421 -5.8421 -4.4205 -4.3920 -3.7568 -3.7568 -3.7074 -3.7073 -3.6351 -3.6340 -3.4444 -3.4370 -3.4065 -3.4039 -2.6760 -2.6537 -2.4825 -2.4820 -2.0475 -2.0466 -0.8804 -0.8684 -0.7257 -0.7162 -0.7019 -0.6933 0.9344 0.9354 0.9772 0.9773 1.5626 1.5626 1.6929 1.6971 1.7148 1.7157 2.1064 2.1068 2.4074 2.4135 2.4268 2.4272 2.4977 2.4996 3.9749 3.9778 4.4457 4.4519 4.4572 4.4651 4.5206 4.5252 4.5737 4.5788 4.5902 4.5948 4.7875 4.7875 5.5101 5.5108 7.4465 7.5185 7.7504 7.7542 8.0037 8.0775 9.0751 9.0835 10.1132 10.1460 10.1886 10.1914 k = 0.0405 0.0234-0.0000 ( 6896 PWs) bands (ev): -64.4516 -64.4516 -37.3780 -37.3780 -28.8155 -28.8155 -28.8089 -28.8088 -17.1207 -17.1206 -16.5143 -16.5065 -14.9149 -14.8973 -14.8726 -14.8697 -14.5869 -14.5773 -14.4584 -14.4582 -10.1728 -10.1728 -10.0306 -10.0306 -6.1507 -6.1504 -5.9309 -5.9305 -5.8419 -5.8419 -4.4498 -4.4090 -3.7568 -3.7567 -3.7073 -3.7072 -3.6344 -3.6331 -3.4394 -3.4324 -3.3885 -3.3823 -2.6831 -2.6500 -2.4857 -2.4840 -2.0438 -2.0425 -0.8965 -0.8810 -0.7215 -0.7054 -0.6827 -0.6686 0.9285 0.9300 0.9717 0.9721 1.5605 1.5606 1.6700 1.6757 1.7126 1.7136 2.1120 2.1125 2.3997 2.4079 2.4263 2.4269 2.4950 2.4976 3.9800 3.9844 4.4289 4.4366 4.4457 4.4561 4.5277 4.5369 4.5756 4.5860 4.5996 4.6064 4.7906 4.7907 5.5078 5.5088 7.4209 7.5221 7.7537 7.7656 7.9896 8.0992 9.0733 9.0855 10.1072 10.1525 10.1954 10.2033 k = 0.0541 0.0312-0.0000 ( 6888 PWs) bands (ev): -64.4515 -64.4515 -37.3780 -37.3780 -28.8156 -28.8156 -28.8089 -28.8088 -17.1165 -17.1165 -16.5190 -16.5089 -14.9158 -14.8951 -14.8702 -14.8637 -14.5918 -14.5791 -14.4623 -14.4618 -10.1722 -10.1722 -10.0310 -10.0310 -6.1408 -6.1403 -5.9309 -5.9303 -5.8417 -5.8417 -4.4856 -4.4343 -3.7567 -3.7566 -3.7072 -3.7071 -3.6335 -3.6320 -3.4349 -3.4288 -3.3609 -3.3528 -2.6907 -2.6473 -2.4902 -2.4860 -2.0385 -2.0368 -0.9132 -0.8950 -0.7156 -0.6938 -0.6567 -0.6393 0.9197 0.9216 0.9647 0.9656 1.5572 1.5575 1.6397 1.6470 1.7102 1.7112 2.1184 2.1191 2.3883 2.3978 2.4267 2.4281 2.4915 2.4948 3.9872 3.9930 4.4101 4.4177 4.4346 4.4449 4.5352 4.5484 4.5792 4.5940 4.6113 4.6192 4.7951 4.7953 5.5045 5.5060 7.3948 7.5194 7.7567 7.7816 7.9773 8.1215 9.0717 9.0875 10.1035 10.1589 10.2041 10.2194 k = 0.0676 0.0390-0.0000 ( 6888 PWs) bands (ev): -64.4515 -64.4515 -37.3780 -37.3780 -28.8156 -28.8156 -28.8089 -28.8088 -17.1113 -17.1112 -16.5246 -16.5122 -14.9161 -14.8938 -14.8672 -14.8556 -14.5978 -14.5821 -14.4672 -14.4660 -10.1715 -10.1715 -10.0316 -10.0315 -6.1281 -6.1275 -5.9308 -5.9300 -5.8415 -5.8415 -4.5264 -4.4664 -3.7567 -3.7565 -3.7070 -3.7069 -3.6324 -3.6310 -3.4308 -3.4253 -3.3254 -3.3177 -2.6989 -2.6461 -2.4959 -2.4876 -2.0316 -2.0295 -0.9296 -0.9088 -0.7076 -0.6804 -0.6265 -0.6069 0.9078 0.9101 0.9567 0.9584 1.5513 1.5520 1.6048 1.6133 1.7071 1.7083 2.1244 2.1254 2.3736 2.3840 2.4275 2.4300 2.4874 2.4914 3.9962 4.0034 4.3902 4.3974 4.4227 4.4324 4.5431 4.5592 4.5846 4.6024 4.6241 4.6323 4.8010 4.8013 5.5005 5.5023 7.3690 7.5116 7.7588 7.8008 7.9667 8.1439 9.0706 9.0895 10.1022 10.1663 10.2143 10.2388 k = 0.0811 0.0468-0.0000 ( 6878 PWs) bands (ev): -64.4515 -64.4515 -37.3780 -37.3780 -28.8157 -28.8157 -28.8089 -28.8088 -17.1049 -17.1047 -16.5310 -16.5164 -14.9160 -14.8931 -14.8634 -14.8457 -14.6049 -14.5864 -14.4727 -14.4705 -10.1706 -10.1706 -10.0322 -10.0322 -6.1129 -6.1120 -5.9306 -5.9296 -5.8412 -5.8411 -4.5709 -4.5038 -3.7566 -3.7564 -3.7069 -3.7067 -3.6313 -3.6299 -3.4268 -3.4215 -3.2838 -3.2790 -2.7079 -2.6465 -2.5026 -2.4880 -2.0230 -2.0205 -0.9452 -0.9216 -0.6971 -0.6651 -0.5934 -0.5721 0.8925 0.8952 0.9481 0.9506 1.5365 1.5389 1.5728 1.5809 1.7034 1.7048 2.1293 2.1310 2.3559 2.3671 2.4281 2.4317 2.4830 2.4879 4.0068 4.0153 4.3696 4.3765 4.4104 4.4191 4.5512 4.5687 4.5920 4.6110 4.6370 4.6452 4.8083 4.8087 5.4955 5.4978 7.3442 7.5004 7.7599 7.8216 7.9580 8.1658 9.0700 9.0914 10.1036 10.1752 10.2261 10.2608 k = 0.0946 0.0546-0.0000 ( 6870 PWs) bands (ev): -64.4515 -64.4515 -37.3780 -37.3780 -28.8158 -28.8158 -28.8089 -28.8087 -17.0974 -17.0971 -16.5381 -16.5215 -14.9157 -14.8929 -14.8589 -14.8345 -14.6134 -14.5922 -14.4787 -14.4752 -10.1695 -10.1695 -10.0330 -10.0329 -6.0952 -6.0939 -5.9304 -5.9291 -5.8408 -5.8408 -4.6180 -4.5454 -3.7564 -3.7563 -3.7068 -3.7066 -3.6301 -3.6288 -3.4226 -3.4174 -3.2390 -3.2372 -2.7178 -2.6489 -2.5099 -2.4867 -2.0128 -2.0098 -0.9595 -0.9331 -0.6844 -0.6477 -0.5580 -0.5353 0.8739 0.8770 0.9392 0.9425 1.5001 1.5068 1.5573 1.5621 1.6991 1.7007 2.1327 2.1351 2.3355 2.3473 2.4274 2.4322 2.4792 2.4852 4.0185 4.0283 4.3488 4.3555 4.3976 4.4054 4.5595 4.5769 4.6011 4.6198 4.6497 4.6576 4.8172 4.8176 5.4895 5.4924 7.3207 7.4871 7.7597 7.8422 7.9512 8.1868 9.0701 9.0934 10.1078 10.1862 10.2392 10.2853 k = 0.1081 0.0624-0.0000 ( 6868 PWs) bands (ev): -64.4515 -64.4515 -37.3780 -37.3780 -28.8159 -28.8159 -28.8089 -28.8087 -17.0889 -17.0884 -16.5458 -16.5275 -14.9152 -14.8928 -14.8537 -14.8221 -14.6232 -14.5996 -14.4851 -14.4795 -10.1683 -10.1683 -10.0338 -10.0338 -6.0752 -6.0734 -5.9301 -5.9285 -5.8404 -5.8404 -4.6667 -4.5898 -3.7563 -3.7562 -3.7067 -3.7064 -3.6290 -3.6277 -3.4181 -3.4129 -3.1970 -3.1889 -2.7285 -2.6534 -2.5176 -2.4829 -2.0009 -1.9975 -0.9725 -0.9432 -0.6692 -0.6282 -0.5208 -0.4967 0.8523 0.8556 0.9298 0.9340 1.4514 1.4605 1.5495 1.5528 1.6939 1.6958 2.1342 2.1375 2.3126 2.3249 2.4243 2.4300 2.4773 2.4843 4.0307 4.0417 4.3282 4.3349 4.3845 4.3915 4.5680 4.5842 4.6114 4.6286 4.6619 4.6694 4.8277 4.8282 5.4826 5.4860 7.2989 7.4727 7.7582 7.8610 7.9469 8.2064 9.0708 9.0954 10.1149 10.1993 10.2536 10.3123 k = 0.1216 0.0702-0.0000 ( 6864 PWs) bands (ev): -64.4515 -64.4515 -37.3780 -37.3780 -28.8160 -28.8160 -28.8089 -28.8087 -17.0793 -17.0787 -16.5541 -16.5341 -14.9149 -14.8930 -14.8479 -14.8091 -14.6345 -14.6085 -14.4915 -14.4835 -10.1669 -10.1669 -10.0348 -10.0347 -6.0532 -6.0507 -5.9297 -5.9275 -5.8399 -5.8399 -4.7164 -4.6362 -3.7562 -3.7560 -3.7065 -3.7062 -3.6277 -3.6265 -3.4134 -3.4080 -3.1561 -3.1389 -2.7401 -2.6597 -2.5251 -2.4764 -1.9873 -1.9835 -0.9840 -0.9518 -0.6516 -0.6066 -0.4819 -0.4567 0.8281 0.8316 0.9200 0.9250 1.3975 1.4083 1.5426 1.5455 1.6881 1.6903 2.1336 2.1380 2.2873 2.3000 2.4180 2.4239 2.4782 2.4858 4.0429 4.0548 4.3085 4.3153 4.3712 4.3775 4.5766 4.5909 4.6224 4.6373 4.6734 4.6806 4.8398 4.8404 5.4748 5.4788 7.2790 7.4582 7.7554 7.8758 7.9461 8.2243 9.0721 9.0976 10.1249 10.2146 10.2691 10.3420 k = 0.1351 0.0780-0.0000 ( 6866 PWs) bands (ev): -64.4515 -64.4515 -37.3780 -37.3780 -28.8162 -28.8161 -28.8088 -28.8087 -17.0688 -17.0680 -16.5627 -16.5414 -14.9148 -14.8934 -14.8415 -14.7956 -14.6471 -14.6187 -14.4979 -14.4868 -10.1654 -10.1654 -10.0359 -10.0358 -6.0296 -6.0261 -5.9289 -5.9259 -5.8394 -5.8394 -4.7663 -4.6837 -3.7560 -3.7559 -3.7064 -3.7060 -3.6265 -3.6253 -3.4084 -3.4028 -3.1169 -3.0894 -2.7523 -2.6675 -2.5316 -2.4666 -1.9720 -1.9677 -0.9941 -0.9590 -0.6317 -0.5830 -0.4416 -0.4153 0.8015 0.8051 0.9097 0.9154 1.3403 1.3525 1.5355 1.5384 1.6814 1.6840 2.1309 2.1365 2.2599 2.2729 2.4085 2.4142 2.4820 2.4897 4.0541 4.0667 4.2901 4.2972 4.3578 4.3636 4.5853 4.5972 4.6336 4.6457 4.6843 4.6910 4.8537 4.8543 5.4661 5.4708 7.2613 7.4439 7.7513 7.8849 7.9500 8.2401 9.0742 9.0997 10.1377 10.2320 10.2859 10.3745 k = 0.1486 0.0858-0.0000 ( 6862 PWs) bands (ev): -64.4515 -64.4515 -37.3781 -37.3780 -28.8163 -28.8163 -28.8088 -28.8086 -17.0574 -17.0562 -16.5718 -16.5493 -14.9151 -14.8940 -14.8348 -14.7821 -14.6609 -14.6297 -14.5042 -14.4894 -10.1637 -10.1637 -10.0370 -10.0369 -6.0052 -6.0001 -5.9275 -5.9233 -5.8389 -5.8388 -4.8159 -4.7316 -3.7559 -3.7557 -3.7062 -3.7058 -3.6252 -3.6241 -3.4031 -3.3974 -3.0808 -3.0426 -2.7643 -2.6758 -2.5366 -2.4535 -1.9550 -1.9501 -1.0026 -0.9646 -0.6096 -0.5575 -0.4002 -0.3727 0.7730 0.7766 0.8988 0.9052 1.2806 1.2942 1.5278 1.5309 1.6739 1.6770 2.1259 2.1330 2.2307 2.2438 2.3963 2.4015 2.4879 2.4953 4.0632 4.0762 4.2742 4.2817 4.3443 4.3499 4.5939 4.6033 4.6449 4.6538 4.6947 4.7008 4.8693 4.8699 5.4565 5.4619 7.2458 7.4305 7.7461 7.8882 7.9581 8.2536 9.0768 9.1019 10.1532 10.2510 10.3041 10.4100 k = 0.1622 0.0936-0.0000 ( 6856 PWs) bands (ev): -64.4515 -64.4515 -37.3781 -37.3781 -28.8164 -28.8164 -28.8088 -28.8086 -17.0451 -17.0436 -16.5810 -16.5576 -14.9158 -14.8947 -14.8283 -14.7697 -14.6753 -14.6409 -14.5101 -14.4912 -10.1619 -10.1619 -10.0383 -10.0382 -5.9814 -5.9740 -5.9244 -5.9183 -5.8384 -5.8381 -4.8646 -4.7793 -3.7557 -3.7555 -3.7061 -3.7057 -3.6238 -3.6227 -3.3977 -3.3918 -3.0492 -3.0016 -2.7745 -2.6835 -2.5391 -2.4370 -1.9364 -1.9308 -1.0097 -0.9689 -0.5852 -0.5300 -0.3577 -0.3291 0.7427 0.7462 0.8872 0.8945 1.2189 1.2342 1.5195 1.5227 1.6656 1.6693 2.1185 2.1276 2.2001 2.2130 2.3817 2.3864 2.4950 2.5021 4.0689 4.0818 4.2615 4.2698 4.3309 4.3366 4.6024 4.6091 4.6561 4.6617 4.7045 4.7101 4.8867 4.8872 5.4460 5.4523 7.2328 7.4182 7.7397 7.8874 7.9682 8.2648 9.0798 9.1040 10.1712 10.2710 10.3239 10.4485 k = 0.1757 0.1014-0.0000 ( 6854 PWs) bands (ev): -64.4515 -64.4515 -37.3781 -37.3781 -28.8166 -28.8166 -28.8088 -28.8086 -17.0320 -17.0301 -16.5904 -16.5662 -14.9172 -14.8959 -14.8224 -14.7597 -14.6892 -14.6510 -14.5158 -14.4924 -10.1601 -10.1601 -10.0396 -10.0395 -5.9617 -5.9523 -5.9157 -5.9077 -5.8378 -5.8374 -4.9121 -4.8262 -3.7556 -3.7553 -3.7059 -3.7055 -3.6224 -3.6214 -3.3922 -3.3860 -3.0236 -2.9711 -2.7802 -2.6887 -2.5380 -2.4169 -1.9160 -1.9097 -1.0153 -0.9719 -0.5587 -0.5008 -0.3143 -0.2847 0.7110 0.7144 0.8749 0.8830 1.1559 1.1730 1.5103 1.5139 1.6564 1.6608 2.1081 2.1199 2.1688 2.1809 2.3651 2.3694 2.5030 2.5097 4.0701 4.0824 4.2528 4.2623 4.3178 4.3240 4.6106 4.6148 4.6670 4.6695 4.7138 4.7187 4.9056 4.9060 5.4348 5.4420 7.2222 7.4072 7.7323 7.8843 7.9782 8.2734 9.0831 9.1059 10.1911 10.2912 10.3458 10.4902 k = 0.1892 0.1092-0.0000 ( 6856 PWs) bands (ev): -64.4515 -64.4515 -37.3781 -37.3781 -28.8168 -28.8168 -28.8088 -28.8085 -17.0183 -17.0159 -16.5998 -16.5751 -14.9194 -14.8975 -14.8179 -14.7557 -14.7001 -14.6579 -14.5211 -14.4928 -10.1581 -10.1580 -10.0410 -10.0409 -5.9495 -5.9414 -5.8953 -5.8883 -5.8371 -5.8365 -4.9577 -4.8718 -3.7555 -3.7551 -3.7058 -3.7053 -3.6210 -3.6200 -3.3867 -3.3802 -3.0058 -2.9558 -2.7791 -2.6890 -2.5319 -2.3934 -1.8940 -1.8868 -1.0196 -0.9737 -0.5302 -0.4699 -0.2702 -0.2394 0.6781 0.6811 0.8617 0.8709 1.0920 1.1115 1.5004 1.5042 1.6463 1.6515 2.0935 2.1095 2.1382 2.1487 2.3468 2.3508 2.5116 2.5179 4.0661 4.0774 4.2481 4.2590 4.3051 4.3127 4.6183 4.6207 4.6762 4.6785 4.7229 4.7270 4.9260 4.9263 5.4230 5.4311 7.2142 7.3977 7.7239 7.8801 7.9870 8.2796 9.0866 9.1075 10.2125 10.3108 10.3703 10.5348 k = 0.2027 0.1170-0.0000 ( 6864 PWs) bands (ev): -64.4515 -64.4515 -37.3781 -37.3781 -28.8170 -28.8170 -28.8088 -28.8085 -17.0040 -17.0009 -16.6092 -16.5840 -14.9227 -14.8998 -14.8157 -14.7610 -14.7056 -14.6594 -14.5261 -14.4927 -10.1560 -10.1559 -10.0426 -10.0425 -5.9435 -5.9376 -5.8679 -5.8619 -5.8365 -5.8349 -5.0011 -4.9156 -3.7554 -3.7549 -3.7056 -3.7052 -3.6195 -3.6185 -3.3811 -3.3744 -2.9974 -2.9567 -2.7719 -2.6832 -2.5191 -2.3666 -1.8703 -1.8622 -1.0226 -0.9743 -0.4998 -0.4374 -0.2256 -0.1936 0.6440 0.6468 0.8473 0.8579 1.0281 1.0506 1.4896 1.4938 1.6354 1.6414 2.0717 2.0924 2.1125 2.1197 2.3270 2.3307 2.5205 2.5264 4.0571 4.0674 4.2460 4.2585 4.2934 4.3038 4.6246 4.6280 4.6837 4.6890 4.7317 4.7350 4.9476 4.9478 5.4106 5.4197 7.2087 7.3898 7.7148 7.8751 7.9938 8.2832 9.0899 9.1088 10.2344 10.3294 10.3971 10.5820 k = 0.2162 0.1248-0.0000 ( 6860 PWs) bands (ev): -64.4515 -64.4515 -37.3781 -37.3781 -28.8172 -28.8171 -28.8087 -28.8085 -16.9892 -16.9854 -16.6183 -16.5929 -14.9274 -14.9031 -14.8164 -14.7740 -14.7069 -14.6542 -14.5308 -14.4919 -10.1538 -10.1537 -10.0441 -10.0440 -5.9405 -5.9359 -5.8425 -5.8360 -5.8350 -5.8260 -5.0417 -4.9569 -3.7552 -3.7547 -3.7055 -3.7051 -3.6180 -3.6170 -3.3756 -3.3686 -2.9995 -2.9696 -2.7621 -2.6725 -2.4979 -2.3367 -1.8450 -1.8358 -1.0243 -0.9739 -0.4678 -0.4036 -0.1807 -0.1473 0.6089 0.6114 0.8311 0.8437 0.9651 0.9916 1.4780 1.4824 1.6237 1.6307 2.0418 2.0631 2.0950 2.0974 2.3059 2.3094 2.5296 2.5351 4.0442 4.0536 4.2438 4.2574 4.2847 4.2987 4.6300 4.6359 4.6911 4.6993 4.7404 4.7430 4.9702 4.9704 5.3979 5.4080 7.2058 7.3836 7.7049 7.8697 7.9985 8.2845 9.0929 9.1095 10.2557 10.3470 10.4261 10.6305 k = 0.2297 0.1326-0.0000 ( 6844 PWs) bands (ev): -64.4515 -64.4515 -37.3781 -37.3781 -28.8173 -28.8173 -28.8087 -28.8084 -16.9740 -16.9693 -16.6271 -16.6016 -14.9340 -14.9080 -14.8203 -14.7902 -14.7058 -14.6439 -14.5352 -14.4905 -10.1515 -10.1515 -10.0458 -10.0457 -5.9388 -5.9351 -5.8370 -5.8352 -5.8071 -5.7972 -5.0787 -4.9951 -3.7551 -3.7545 -3.7053 -3.7049 -3.6164 -3.6156 -3.3701 -3.3630 -3.0123 -2.9892 -2.7515 -2.6607 -2.4679 -2.3042 -1.8181 -1.8077 -1.0248 -0.9726 -0.4342 -0.3686 -0.1356 -0.1008 0.5728 0.5751 0.8114 0.8265 0.9055 0.9371 1.4655 1.4701 1.6112 1.6192 2.0070 2.0274 2.0791 2.0802 2.2835 2.2871 2.5388 2.5440 4.0286 4.0373 4.2389 4.2518 4.2817 4.2983 4.6354 4.6440 4.6986 4.7093 4.7488 4.7513 4.9934 4.9938 5.3851 5.3961 7.2054 7.3792 7.6945 7.8639 8.0009 8.2834 9.0954 9.1096 10.2749 10.3637 10.4565 10.6758 k = 0.2432 0.1404-0.0000 ( 6838 PWs) bands (ev): -64.4515 -64.4515 -37.3781 -37.3781 -28.8175 -28.8175 -28.8087 -28.8084 -16.9587 -16.9530 -16.6355 -16.6100 -14.9429 -14.9152 -14.8264 -14.8067 -14.7026 -14.6308 -14.5392 -14.4885 -10.1491 -10.1491 -10.0475 -10.0474 -5.9377 -5.9346 -5.8357 -5.8346 -5.7785 -5.7662 -5.1115 -5.0294 -3.7550 -3.7543 -3.7051 -3.7048 -3.6149 -3.6140 -3.3649 -3.3575 -3.0345 -3.0124 -2.7404 -2.6503 -2.4302 -2.2695 -1.7896 -1.7780 -1.0243 -0.9704 -0.3995 -0.3327 -0.0907 -0.0543 0.5356 0.5379 0.7852 0.8005 0.8561 0.8909 1.4520 1.4567 1.5980 1.6072 1.9698 1.9897 2.0618 2.0645 2.2602 2.2640 2.5480 2.5528 4.0114 4.0196 4.2309 4.2421 4.2838 4.3013 4.6409 4.6521 4.7062 4.7187 4.7569 4.7606 5.0169 5.0176 5.3724 5.3843 7.2076 7.3765 7.6835 7.8580 8.0009 8.2801 9.0971 9.1090 10.2905 10.3795 10.4876 10.6688 k = 0.2568 0.1482-0.0000 ( 6848 PWs) bands (ev): -64.4515 -64.4515 -37.3782 -37.3781 -28.8177 -28.8177 -28.8086 -28.8084 -16.9433 -16.9365 -16.6433 -16.6180 -14.9546 -14.9255 -14.8334 -14.8215 -14.6975 -14.6164 -14.5429 -14.4860 -10.1467 -10.1467 -10.0493 -10.0492 -5.9370 -5.9343 -5.8348 -5.8339 -5.7519 -5.7364 -5.1392 -5.0590 -3.7550 -3.7541 -3.7050 -3.7048 -3.6134 -3.6125 -3.3598 -3.3522 -3.0631 -3.0387 -2.7289 -2.6419 -2.3871 -2.2332 -1.7596 -1.7468 -1.0227 -0.9675 -0.3637 -0.2963 -0.0462 -0.0081 0.4972 0.4998 0.7498 0.7572 0.8263 0.8567 1.4374 1.4420 1.5844 1.5946 1.9315 1.9510 2.0440 2.0477 2.2362 2.2404 2.5571 2.5615 3.9932 4.0012 4.2209 4.2307 4.2877 4.3056 4.6466 4.6601 4.7140 4.7276 4.7650 4.7707 5.0403 5.0412 5.3602 5.3729 7.2122 7.3754 7.6722 7.8521 7.9986 8.2745 9.0980 9.1076 10.3016 10.3936 10.5186 10.6615 k = 0.2703 0.1560-0.0000 ( 6840 PWs) bands (ev): -64.4515 -64.4515 -37.3782 -37.3781 -28.8179 -28.8179 -28.8086 -28.8084 -16.9282 -16.9200 -16.6504 -16.6252 -14.9691 -14.9396 -14.8402 -14.8336 -14.6911 -14.6019 -14.5458 -14.4829 -10.1442 -10.1442 -10.0511 -10.0510 -5.9366 -5.9341 -5.8340 -5.8333 -5.7283 -5.7095 -5.1607 -5.0827 -3.7549 -3.7539 -3.7048 -3.7047 -3.6118 -3.6110 -3.3550 -3.3472 -3.0957 -3.0682 -2.7175 -2.6350 -2.3408 -2.1959 -1.7283 -1.7140 -1.0203 -0.9640 -0.3274 -0.2599 -0.0024 0.0374 0.4576 0.4606 0.7058 0.7076 0.8083 0.8333 1.4217 1.4259 1.5705 1.5816 1.8927 1.9120 2.0252 2.0294 2.2116 2.2165 2.5661 2.5702 3.9748 3.9825 4.2100 4.2188 4.2917 4.3096 4.6524 4.6680 4.7220 4.7357 4.7735 4.7817 5.0631 5.0642 5.3489 5.3622 7.2193 7.3761 7.6605 7.8462 7.9939 8.2669 9.0977 9.1055 10.3081 10.4039 10.5494 10.6612 k = 0.2838 0.1638-0.0000 ( 6842 PWs) bands (ev): -64.4515 -64.4515 -37.3782 -37.3782 -28.8181 -28.8181 -28.8086 -28.8083 -16.9134 -16.9037 -16.6566 -16.6316 -14.9863 -14.9574 -14.8461 -14.8426 -14.6841 -14.5883 -14.5476 -14.4793 -10.1417 -10.1417 -10.0530 -10.0529 -5.9362 -5.9340 -5.8334 -5.8327 -5.7091 -5.6866 -5.1749 -5.0998 -3.7548 -3.7538 -3.7047 -3.7046 -3.6103 -3.6095 -3.3504 -3.3425 -3.1307 -3.1006 -2.7062 -2.6292 -2.2929 -2.1581 -1.6955 -1.6798 -1.0171 -0.9599 -0.2910 -0.2241 0.0401 0.0817 0.4170 0.4204 0.6556 0.6635 0.7942 0.8166 1.4047 1.4083 1.5565 1.5684 1.8539 1.8729 2.0050 2.0095 2.1870 2.1928 2.5750 2.5787 3.9565 3.9640 4.1987 4.2068 4.2949 4.3127 4.6583 4.6755 4.7302 4.7432 4.7828 4.7935 5.0847 5.0858 5.3390 5.3527 7.2287 7.3784 7.6487 7.8406 7.9870 8.2572 9.0962 9.1026 10.3105 10.4087 10.5799 10.6695 k = 0.2973 0.1716-0.0000 ( 6850 PWs) bands (ev): -64.4515 -64.4515 -37.3782 -37.3782 -28.8183 -28.8183 -28.8086 -28.8083 -16.8993 -16.8880 -16.6618 -16.6370 -15.0057 -14.9781 -14.8507 -14.8490 -14.6769 -14.5775 -14.5465 -14.4752 -10.1392 -10.1392 -10.0549 -10.0548 -5.9360 -5.9340 -5.8327 -5.8321 -5.6950 -5.6690 -5.1809 -5.1091 -3.7548 -3.7536 -3.7047 -3.7045 -3.6088 -3.6081 -3.3462 -3.3381 -3.1673 -3.1351 -2.6954 -2.6241 -2.2448 -2.1203 -1.6615 -1.6444 -1.0132 -0.9555 -0.2551 -0.1899 0.0808 0.1237 0.3761 0.3799 0.6096 0.6215 0.7822 0.8038 1.3862 1.3891 1.5428 1.5552 1.8154 1.8342 1.9832 1.9879 2.1627 2.1695 2.5835 2.5869 3.9386 3.9460 4.1874 4.1951 4.2972 4.3146 4.6642 4.6825 4.7385 4.7501 4.7929 4.8061 5.1042 5.1053 5.3314 5.3451 7.2403 7.3822 7.6368 7.8354 7.9778 8.2457 9.0933 9.0991 10.3097 10.4075 10.6108 10.6860 k = 0.3108 0.1794-0.0000 ( 6854 PWs) bands (ev): -64.4515 -64.4515 -37.3782 -37.3782 -28.8185 -28.8185 -28.8085 -28.8083 -16.8860 -16.8731 -16.6658 -16.6410 -15.0267 -15.0008 -14.8543 -14.8534 -14.6698 -14.5721 -14.5402 -14.4707 -10.1366 -10.1366 -10.0569 -10.0568 -5.9358 -5.9340 -5.8322 -5.8316 -5.6865 -5.6575 -5.1784 -5.1104 -3.7548 -3.7535 -3.7047 -3.7043 -3.6073 -3.6067 -3.3423 -3.3340 -3.2051 -3.1713 -2.6851 -2.6194 -2.1972 -2.0830 -1.6262 -1.6079 -1.0088 -0.9508 -0.2207 -0.1589 0.1188 0.1613 0.3372 0.3409 0.5691 0.5834 0.7719 0.7938 1.3658 1.3684 1.5296 1.5421 1.7776 1.7961 1.9596 1.9645 2.1392 2.1469 2.5918 2.5948 3.9214 3.9286 4.1763 4.1836 4.2982 4.3152 4.6701 4.6889 4.7465 4.7565 4.8040 4.8194 5.1208 5.1218 5.3269 5.3401 7.2541 7.3874 7.6249 7.8308 7.9664 8.2323 9.0890 9.0950 10.3068 10.4013 10.6425 10.7087 k = 0.3243 0.1872-0.0000 ( 6858 PWs) bands (ev): -64.4515 -64.4515 -37.3782 -37.3782 -28.8187 -28.8186 -28.8085 -28.8083 -16.8739 -16.8594 -16.6682 -16.6436 -15.0487 -15.0247 -14.8570 -14.8565 -14.6629 -14.5716 -14.5295 -14.4658 -10.1340 -10.1340 -10.0589 -10.0587 -5.9357 -5.9340 -5.8316 -5.8311 -5.6835 -5.6524 -5.1674 -5.1037 -3.7548 -3.7534 -3.7047 -3.7042 -3.6059 -3.6053 -3.3390 -3.3302 -3.2434 -3.2085 -2.6752 -2.6151 -2.1508 -2.0466 -1.5900 -1.5703 -1.0040 -0.9460 -0.1894 -0.1331 0.1527 0.1891 0.3059 0.3076 0.5345 0.5502 0.7636 0.7863 1.3433 1.3466 1.5170 1.5295 1.7408 1.7590 1.9340 1.9392 2.1168 2.1255 2.5997 2.6024 3.9050 3.9120 4.1655 4.1725 4.2983 4.3146 4.6758 4.6946 4.7543 4.7624 4.8162 4.8331 5.1332 5.1346 5.3262 5.3384 7.2698 7.3939 7.6131 7.8271 7.9529 8.2172 9.0836 9.0900 10.3025 10.3919 10.6751 10.7355 k = 0.3378 0.1951-0.0000 ( 6852 PWs) bands (ev): -64.4515 -64.4515 -37.3782 -37.3782 -28.8188 -28.8188 -28.8085 -28.8082 -16.8632 -16.8473 -16.6690 -16.6445 -15.0711 -15.0490 -14.8591 -14.8586 -14.6564 -14.5733 -14.5171 -14.4606 -10.1315 -10.1314 -10.0609 -10.0608 -5.9357 -5.9340 -5.8312 -5.8307 -5.6853 -5.6531 -5.1490 -5.0897 -3.7549 -3.7533 -3.7048 -3.7040 -3.6045 -3.6040 -3.3364 -3.3268 -3.2819 -3.2459 -2.6658 -2.6111 -2.1060 -2.0114 -1.5528 -1.5320 -0.9988 -0.9413 -0.1634 -0.1159 0.1786 0.1958 0.2826 0.2995 0.5056 0.5222 0.7575 0.7812 1.3187 1.3236 1.5053 1.5173 1.7053 1.7232 1.9065 1.9120 2.0961 2.1055 2.6072 2.6097 3.8896 3.8963 4.1551 4.1619 4.2973 4.3129 4.6812 4.6996 4.7616 4.7680 4.8292 4.8471 5.1407 5.1432 5.3299 5.3406 7.2872 7.4016 7.6014 7.8246 7.9374 8.2006 9.0772 9.0843 10.2976 10.3807 10.7081 10.7647 k = 0.3514 0.2029-0.0000 ( 6850 PWs) bands (ev): -64.4515 -64.4515 -37.3783 -37.3782 -28.8190 -28.8190 -28.8084 -28.8082 -16.8541 -16.8371 -16.6678 -16.6438 -15.0935 -15.0731 -14.8607 -14.8600 -14.6504 -14.5757 -14.5046 -14.4553 -10.1289 -10.1289 -10.0629 -10.0628 -5.9357 -5.9341 -5.8308 -5.8304 -5.6908 -5.6585 -5.1245 -5.0698 -3.7550 -3.7532 -3.7049 -3.7039 -3.6032 -3.6027 -3.3362 -3.3238 -3.3195 -3.2822 -2.6570 -2.6074 -2.0632 -1.9780 -1.5149 -1.4930 -0.9936 -0.9368 -0.1464 -0.1108 0.1768 0.1999 0.2764 0.3156 0.4823 0.4993 0.7542 0.7788 1.2924 1.2994 1.4945 1.5060 1.6716 1.6889 1.8772 1.8828 2.0772 2.0869 2.6143 2.6165 3.8752 3.8816 4.1452 4.1517 4.2956 4.3103 4.6864 4.7038 4.7684 4.7733 4.8430 4.8612 5.1435 5.1473 5.3377 5.3467 7.3062 7.4104 7.5901 7.8233 7.9200 8.1824 9.0702 9.0777 10.2926 10.3690 10.7411 10.7953 k = 0.3649 0.2107-0.0000 ( 6848 PWs) bands (ev): -64.4515 -64.4515 -37.3783 -37.3783 -28.8191 -28.8191 -28.8084 -28.8082 -16.8465 -16.8291 -16.6647 -16.6414 -15.1154 -15.0968 -14.8619 -14.8610 -14.6449 -14.5785 -14.4925 -14.4500 -10.1264 -10.1263 -10.0649 -10.0648 -5.9357 -5.9342 -5.8305 -5.8301 -5.6988 -5.6673 -5.0958 -5.0455 -3.7551 -3.7531 -3.7051 -3.7038 -3.6020 -3.6015 -3.3593 -3.3415 -3.3212 -3.3104 -2.6486 -2.6040 -2.0227 -1.9464 -1.4764 -1.4538 -0.9883 -0.9326 -0.1425 -0.1201 0.1634 0.2082 0.2871 0.3389 0.4643 0.4818 0.7541 0.7790 1.2652 1.2742 1.4848 1.4954 1.6398 1.6565 1.8464 1.8519 2.0603 2.0700 2.6209 2.6229 3.8619 3.8681 4.1359 4.1421 4.2934 4.3070 4.6911 4.7075 4.7747 4.7784 4.8572 4.8751 5.1425 5.1475 5.3487 5.3560 7.3264 7.4202 7.5790 7.8236 7.9006 8.1630 9.0626 9.0705 10.2880 10.3574 10.7735 10.8262 k = 0.3784 0.2185-0.0000 ( 6840 PWs) bands (ev): -64.4515 -64.4515 -37.3783 -37.3783 -28.8193 -28.8192 -28.8084 -28.8082 -16.8404 -16.8231 -16.6598 -16.6377 -15.1363 -15.1195 -14.8628 -14.8618 -14.6399 -14.5814 -14.4811 -14.4448 -10.1239 -10.1238 -10.0669 -10.0668 -5.9357 -5.9344 -5.8303 -5.8299 -5.7081 -5.6783 -5.0642 -5.0184 -3.7552 -3.7531 -3.7053 -3.7038 -3.6009 -3.6004 -3.3955 -3.3691 -3.3195 -3.3175 -2.6408 -2.6010 -1.9849 -1.9172 -1.4378 -1.4144 -0.9832 -0.9291 -0.1540 -0.1426 0.1601 0.2179 0.3048 0.3606 0.4520 0.4697 0.7573 0.7815 1.2377 1.2484 1.4761 1.4859 1.6104 1.6263 1.8145 1.8197 2.0453 2.0548 2.6271 2.6288 3.8499 3.8556 4.1272 4.1330 4.2908 4.3033 4.6955 4.7105 4.7805 4.7831 4.8714 4.8887 5.1386 5.1445 5.3617 5.3675 7.3474 7.4311 7.5684 7.8258 7.8796 8.1424 9.0549 9.0628 10.2840 10.3465 10.8050 10.8568 k = 0.3919 0.2263-0.0000 ( 6836 PWs) bands (ev): -64.4515 -64.4515 -37.3783 -37.3783 -28.8194 -28.8194 -28.8083 -28.8082 -16.8357 -16.8192 -16.6534 -16.6329 -15.1560 -15.1409 -14.8634 -14.8624 -14.6352 -14.5844 -14.4705 -14.4398 -10.1215 -10.1214 -10.0689 -10.0688 -5.9358 -5.9345 -5.8301 -5.8298 -5.7179 -5.6903 -5.0314 -4.9899 -3.7554 -3.7532 -3.7055 -3.7037 -3.5999 -3.5994 -3.4305 -3.4033 -3.3188 -3.3162 -2.6335 -2.5984 -1.9500 -1.8906 -1.3992 -1.3755 -0.9784 -0.9263 -0.1789 -0.1744 0.1680 0.2306 0.3230 0.3770 0.4462 0.4637 0.7637 0.7857 1.2108 1.2225 1.4685 1.4773 1.5835 1.5985 1.7820 1.7866 2.0323 2.0412 2.6327 2.6342 3.8391 3.8444 4.1193 4.1247 4.2881 4.2993 4.6995 4.7130 4.7857 4.7876 4.8854 4.9017 5.1330 5.1394 5.3757 5.3801 7.3685 7.4432 7.5584 7.8299 7.8569 8.1209 9.0471 9.0549 10.2809 10.3364 10.8351 10.8970 k = 0.4054 0.2341-0.0000 ( 6830 PWs) bands (ev): -64.4515 -64.4515 -37.3783 -37.3783 -28.8195 -28.8195 -28.8083 -28.8081 -16.8322 -16.8170 -16.6460 -16.6275 -15.1742 -15.1609 -14.8638 -14.8628 -14.6309 -14.5873 -14.4608 -14.4352 -10.1192 -10.1191 -10.0708 -10.0707 -5.9359 -5.9347 -5.8301 -5.8299 -5.7274 -5.7026 -4.9985 -4.9614 -3.7555 -3.7533 -3.7057 -3.7037 -3.5990 -3.5985 -3.4632 -3.4373 -3.3175 -3.3146 -2.6268 -2.5962 -1.9183 -1.8667 -1.3611 -1.3373 -0.9741 -0.9245 -0.2125 -0.2111 0.1831 0.2441 0.3387 0.3862 0.4483 0.4647 0.7722 0.7906 1.1855 1.1975 1.4618 1.4697 1.5596 1.5735 1.7493 1.7534 2.0211 2.0292 2.6377 2.6390 3.8296 3.8344 4.1121 4.1171 4.2853 4.2953 4.7031 4.7150 4.7905 4.7918 4.8989 4.9139 5.1265 5.1329 5.3895 5.3930 7.3888 7.4569 7.5491 7.8327 7.8363 8.0986 9.0396 9.0470 10.2787 10.3272 10.8633 10.9135 k = 0.4189 0.2419-0.0000 ( 6826 PWs) bands (ev): -64.4515 -64.4515 -37.3783 -37.3783 -28.8196 -28.8196 -28.8083 -28.8081 -16.8296 -16.8160 -16.6381 -16.6219 -15.1905 -15.1789 -14.8641 -14.8632 -14.6270 -14.5902 -14.4521 -14.4311 -10.1170 -10.1169 -10.0727 -10.0726 -5.9360 -5.9349 -5.8302 -5.8300 -5.7361 -5.7144 -4.9667 -4.9341 -3.7558 -3.7534 -3.7060 -3.7039 -3.5983 -3.5977 -3.4931 -3.4693 -3.3160 -3.3132 -2.6206 -2.5946 -1.8898 -1.8460 -1.3241 -1.3007 -0.9703 -0.9239 -0.2501 -0.2488 0.2010 0.2561 0.3504 0.3885 0.4579 0.4736 0.7814 0.7946 1.1633 1.1744 1.4561 1.4631 1.5390 1.5517 1.7173 1.7206 2.0116 2.0188 2.6421 2.6432 3.8214 3.8257 4.1059 4.1102 4.2827 4.2914 4.7063 4.7166 4.7946 4.7955 4.9117 4.9251 5.1197 5.1259 5.4026 5.4053 7.4074 7.4723 7.5412 7.8073 7.8448 8.0757 9.0326 9.0393 10.2774 10.3190 10.8891 10.9395 k = 0.4324 0.2497-0.0000 ( 6826 PWs) bands (ev): -64.4515 -64.4515 -37.3783 -37.3783 -28.8197 -28.8197 -28.8082 -28.8081 -16.8276 -16.8160 -16.6302 -16.6165 -15.2046 -15.1949 -14.8643 -14.8635 -14.6233 -14.5932 -14.4445 -14.4277 -10.1149 -10.1149 -10.0744 -10.0743 -5.9360 -5.9351 -5.8304 -5.8301 -5.7436 -5.7252 -4.9371 -4.9092 -3.7560 -3.7536 -3.7063 -3.7041 -3.5978 -3.5971 -3.5195 -3.4985 -3.3146 -3.3121 -2.6150 -2.5934 -1.8649 -1.8286 -1.2890 -1.2664 -0.9671 -0.9246 -0.2872 -0.2857 0.2189 0.2657 0.3573 0.3869 0.4731 0.4894 0.7892 0.7963 1.1453 1.1546 1.4512 1.4573 1.5219 1.5332 1.6867 1.6893 2.0039 2.0100 2.6459 2.6468 3.8146 3.8182 4.1005 4.1043 4.2805 4.2877 4.7090 4.7177 4.7982 4.7989 4.9234 4.9350 5.1131 5.1187 5.4144 5.4164 7.4236 7.4881 7.5365 7.7808 7.8555 8.0524 9.0263 9.0322 10.2771 10.3117 10.9121 10.9618 k = 0.4459 0.2575-0.0000 ( 6810 PWs) bands (ev): -64.4515 -64.4515 -37.3783 -37.3783 -28.8197 -28.8197 -28.8082 -28.8081 -16.8260 -16.8166 -16.6229 -16.6118 -15.2163 -15.2085 -14.8644 -14.8637 -14.6199 -14.5961 -14.4380 -14.4250 -10.1131 -10.1131 -10.0760 -10.0759 -5.9361 -5.9353 -5.8306 -5.8304 -5.7496 -5.7348 -4.9106 -4.8878 -3.7561 -3.7539 -3.7066 -3.7044 -3.5974 -3.5965 -3.5415 -3.5241 -3.3134 -3.3112 -2.6100 -2.5928 -1.8436 -1.8148 -1.2565 -1.2356 -0.9643 -0.9270 -0.3210 -0.3197 0.2350 0.2726 0.3605 0.3834 0.4920 0.5095 0.7933 0.7950 1.1322 1.1391 1.4472 1.4523 1.5087 1.5185 1.6586 1.6605 1.9977 2.0027 2.6491 2.6498 3.8090 3.8120 4.0961 4.0992 4.2786 4.2845 4.7115 4.7184 4.8013 4.8017 4.9339 4.9435 5.1071 5.1120 5.4245 5.4260 7.4374 7.4982 7.5408 7.7532 7.8685 8.0290 9.0209 9.0258 10.2776 10.3053 10.9317 10.9773 k = 0.4595 0.2653-0.0000 ( 6808 PWs) bands (ev): -64.4515 -64.4515 -37.3783 -37.3783 -28.8198 -28.8198 -28.8082 -28.8081 -16.8247 -16.8176 -16.6165 -16.6081 -15.2255 -15.2195 -14.8644 -14.8639 -14.6166 -14.5989 -14.4326 -14.4231 -10.1116 -10.1115 -10.0773 -10.0772 -5.9361 -5.9355 -5.8309 -5.8306 -5.7540 -5.7428 -4.8882 -4.8707 -3.7562 -3.7543 -3.7068 -3.7048 -3.5973 -3.5962 -3.5587 -3.5453 -3.3123 -3.3106 -2.6056 -2.5927 -1.8262 -1.8046 -1.2278 -1.2099 -0.9616 -0.9309 -0.3497 -0.3487 0.2487 0.2769 0.3617 0.3789 0.5127 0.5301 0.7895 0.7940 1.1240 1.1286 1.4438 1.4480 1.4996 1.5076 1.6340 1.6354 1.9931 1.9969 2.6516 2.6521 3.8048 3.8071 4.0928 4.0951 4.2772 4.2816 4.7135 4.7188 4.8036 4.8039 4.9428 4.9502 5.1021 5.1060 5.4327 5.4338 7.4490 7.4978 7.5581 7.7249 7.8836 8.0058 9.0167 9.0205 10.2788 10.2996 10.9472 10.9804 k = 0.4730 0.2731-0.0000 ( 6800 PWs) bands (ev): -64.4515 -64.4515 -37.3783 -37.3783 -28.8198 -28.8198 -28.8081 -28.8081 -16.8235 -16.8187 -16.6113 -16.6057 -15.2318 -15.2279 -14.8644 -14.8640 -14.6135 -14.6018 -14.4283 -14.4221 -10.1104 -10.1104 -10.0783 -10.0783 -5.9361 -5.9357 -5.8311 -5.8309 -5.7566 -5.7491 -4.8706 -4.8587 -3.7562 -3.7548 -3.7068 -3.7054 -3.5974 -3.5962 -3.5703 -3.5615 -3.3115 -3.3103 -2.6019 -2.5933 -1.8126 -1.7982 -1.2043 -1.1909 -0.9585 -0.9363 -0.3715 -0.3708 0.2598 0.2787 0.3623 0.3742 0.5327 0.5476 0.7836 0.7900 1.1199 1.1226 1.4414 1.4443 1.4945 1.5003 1.6146 1.6155 1.9901 1.9926 2.6534 2.6537 3.8019 3.8034 4.0904 4.0920 4.2764 4.2793 4.7153 4.7187 4.8054 4.8056 4.9498 4.9549 5.0984 5.1011 5.4387 5.4394 7.4593 7.4923 7.5825 7.6962 7.9006 7.9829 9.0138 9.0164 10.2808 10.2946 10.9594 10.9816 k = 0.4865 0.2809-0.0000 ( 6800 PWs) bands (ev): -64.4515 -64.4515 -37.3783 -37.3783 -28.8198 -28.8198 -28.8081 -28.8081 -16.8224 -16.8200 -16.6075 -16.6047 -15.2353 -15.2333 -14.8644 -14.8642 -14.6105 -14.6047 -14.4252 -14.4221 -10.1097 -10.1096 -10.0790 -10.0789 -5.9361 -5.9359 -5.8313 -5.8311 -5.7574 -5.7537 -4.8585 -4.8525 -3.7561 -3.7553 -3.7067 -3.7059 -3.5975 -3.5966 -3.5763 -3.5721 -3.3108 -3.3102 -2.5988 -2.5945 -1.8030 -1.7958 -1.1876 -1.1803 -0.9543 -0.9425 -0.3852 -0.3848 0.2684 0.2779 0.3636 0.3697 0.5491 0.5579 0.7795 0.7841 1.1184 1.1197 1.4400 1.4415 1.4927 1.4958 1.6020 1.6025 1.9885 1.9897 2.6545 2.6547 3.8003 3.8011 4.0892 4.0900 4.2762 4.2777 4.7166 4.7184 4.8064 4.8065 4.9547 4.9573 5.0963 5.0977 5.4424 5.4428 7.4685 7.4850 7.6097 7.6671 7.9192 7.9607 9.0122 9.0135 10.2834 10.2903 10.9688 10.9797 k = 0.5000 0.2887-0.0000 ( 6816 PWs) bands (ev): -64.4515 -64.4515 -37.3783 -37.3783 -28.8199 -28.8199 -28.8081 -28.8081 -16.8212 -16.8212 -16.6053 -16.6053 -15.2358 -15.2358 -14.8643 -14.8643 -14.6076 -14.6076 -14.4231 -14.4231 -10.1094 -10.1094 -10.0792 -10.0792 -5.9360 -5.9360 -5.8313 -5.8313 -5.7565 -5.7565 -4.8524 -4.8524 -3.7557 -3.7557 -3.7064 -3.7064 -3.5972 -3.5972 -3.5769 -3.5769 -3.3104 -3.3104 -2.5963 -2.5963 -1.7974 -1.7974 -1.1793 -1.1793 -0.9488 -0.9488 -0.3897 -0.3897 0.2744 0.2744 0.3661 0.3661 0.5584 0.5584 0.7797 0.7797 1.1185 1.1185 1.4400 1.4400 1.4933 1.4933 1.5978 1.5978 1.9884 1.9884 2.6549 2.6549 3.8000 3.8000 4.0891 4.0891 4.2766 4.2766 4.7177 4.7177 4.8068 4.8068 4.9573 4.9573 5.0961 5.0961 5.4438 5.4438 7.4770 7.4770 7.6381 7.6381 7.9394 7.9394 9.0122 9.0122 10.2865 10.2865 10.9752 10.9753 k = 0.5000 0.2887-0.0000 ( 6816 PWs) bands (ev): -64.4515 -64.4515 -37.3783 -37.3783 -28.8199 -28.8199 -28.8081 -28.8081 -16.8212 -16.8212 -16.6053 -16.6053 -15.2358 -15.2358 -14.8643 -14.8643 -14.6076 -14.6076 -14.4231 -14.4231 -10.1094 -10.1094 -10.0792 -10.0792 -5.9360 -5.9360 -5.8313 -5.8313 -5.7565 -5.7565 -4.8524 -4.8524 -3.7557 -3.7557 -3.7064 -3.7064 -3.5972 -3.5972 -3.5769 -3.5769 -3.3104 -3.3104 -2.5963 -2.5963 -1.7974 -1.7974 -1.1793 -1.1793 -0.9488 -0.9488 -0.3897 -0.3897 0.2744 0.2744 0.3661 0.3661 0.5584 0.5584 0.7797 0.7797 1.1185 1.1185 1.4400 1.4400 1.4933 1.4933 1.5978 1.5978 1.9884 1.9884 2.6549 2.6549 3.8000 3.8000 4.0891 4.0891 4.2766 4.2766 4.7177 4.7177 4.8068 4.8068 4.9573 4.9573 5.0961 5.0961 5.4438 5.4438 7.4770 7.4770 7.6381 7.6381 7.9394 7.9394 9.0122 9.0122 10.2865 10.2865 10.9753 10.9755 k = 0.4921 0.3024-0.0000 ( 6808 PWs) bands (ev): -64.4515 -64.4515 -37.3783 -37.3783 -28.8199 -28.8198 -28.8081 -28.8081 -16.8208 -16.8207 -16.6060 -16.6053 -15.2360 -15.2360 -14.8649 -14.8629 -14.6083 -14.6074 -14.4232 -14.4230 -10.1094 -10.1094 -10.0792 -10.0792 -5.9360 -5.9359 -5.8313 -5.8310 -5.7556 -5.7551 -4.8554 -4.8544 -3.7557 -3.7557 -3.7064 -3.7063 -3.5972 -3.5971 -3.5769 -3.5768 -3.3080 -3.3078 -2.5976 -2.5960 -1.7973 -1.7967 -1.1796 -1.1788 -0.9490 -0.9488 -0.3917 -0.3906 0.2705 0.2744 0.3650 0.3651 0.5589 0.5597 0.7806 0.7839 1.1190 1.1192 1.4388 1.4404 1.4927 1.4935 1.5989 1.6012 1.9871 1.9872 2.6529 2.6540 3.7991 3.7997 4.0816 4.0825 4.2844 4.2844 4.7167 4.7173 4.8074 4.8077 4.9572 4.9575 5.0957 5.0958 5.4428 5.4432 7.4692 7.4849 7.6375 7.6391 7.9317 7.9470 9.0108 9.0154 10.2682 10.3014 10.9495 10.9871 k = 0.4841 0.3162-0.0000 ( 6808 PWs) bands (ev): -64.4515 -64.4515 -37.3783 -37.3783 -28.8198 -28.8198 -28.8081 -28.8081 -16.8195 -16.8195 -16.6073 -16.6059 -15.2367 -15.2367 -14.8647 -14.8608 -14.6097 -14.6079 -14.4234 -14.4230 -10.1092 -10.1092 -10.0793 -10.0793 -5.9359 -5.9358 -5.8311 -5.8306 -5.7525 -5.7515 -4.8632 -4.8613 -3.7557 -3.7557 -3.7064 -3.7061 -3.5972 -3.5969 -3.5768 -3.5766 -3.3007 -3.3001 -2.6000 -2.5968 -1.7965 -1.7951 -1.1799 -1.1782 -0.9494 -0.9489 -0.3965 -0.3943 0.2630 0.2704 0.3619 0.3620 0.5614 0.5629 0.7867 0.7930 1.1207 1.1211 1.4367 1.4397 1.4915 1.4931 1.6045 1.6088 1.9834 1.9835 2.6480 2.6502 3.7969 3.7981 4.0628 4.0646 4.3049 4.3050 4.7146 4.7157 4.8093 4.8100 4.9573 4.9579 5.0948 5.0949 5.4402 5.4412 7.4619 7.4926 7.6373 7.6402 7.9243 7.9547 9.0114 9.0206 10.2473 10.3118 10.9220 10.9766 k = 0.4762 0.3299-0.0000 ( 6820 PWs) bands (ev): -64.4515 -64.4515 -37.3783 -37.3783 -28.8199 -28.8199 -28.8082 -28.8081 -16.8174 -16.8173 -16.6092 -16.6072 -15.2378 -15.2378 -14.8637 -14.8579 -14.6117 -14.6090 -14.4237 -14.4230 -10.1091 -10.1091 -10.0794 -10.0794 -5.9358 -5.9356 -5.8308 -5.8300 -5.7471 -5.7455 -4.8755 -4.8728 -3.7556 -3.7556 -3.7062 -3.7058 -3.5971 -3.5967 -3.5766 -3.5763 -3.2887 -3.2877 -2.6035 -2.5987 -1.7948 -1.7928 -1.1798 -1.1774 -0.9500 -0.9491 -0.4041 -0.4009 0.2523 0.2628 0.3565 0.3568 0.5663 0.5680 0.7975 0.8065 1.1236 1.1242 1.4340 1.4381 1.4899 1.4922 1.6142 1.6201 1.9774 1.9775 2.6402 2.6434 3.7936 3.7953 4.0377 4.0401 4.3333 4.3336 4.7116 4.7132 4.8123 4.8134 4.9575 4.9585 5.0933 5.0933 5.4361 5.4375 7.4552 7.4997 7.6379 7.6412 7.9171 7.9621 9.0140 9.0275 10.2251 10.3170 10.8947 10.9537 k = 0.4683 0.3437-0.0000 ( 6820 PWs) bands (ev): -64.4515 -64.4515 -37.3783 -37.3783 -28.8199 -28.8199 -28.8082 -28.8081 -16.8145 -16.8144 -16.6117 -16.6091 -15.2394 -15.2394 -14.8620 -14.8544 -14.6143 -14.6108 -14.4240 -14.4231 -10.1088 -10.1088 -10.0796 -10.0796 -5.9357 -5.9354 -5.8304 -5.8294 -5.7394 -5.7373 -4.8920 -4.8887 -3.7556 -3.7555 -3.7060 -3.7054 -3.5969 -3.5965 -3.5764 -3.5760 -3.2724 -3.2710 -2.6080 -2.6016 -1.7923 -1.7896 -1.1795 -1.1762 -0.9506 -0.9496 -0.4144 -0.4103 0.2393 0.2520 0.3487 0.3494 0.5737 0.5754 0.8125 0.8238 1.1276 1.1285 1.4310 1.4357 1.4878 1.4908 1.6276 1.6346 1.9691 1.9693 2.6295 2.6338 3.7891 3.7914 4.0096 4.0127 4.3661 4.3668 4.7079 4.7099 4.8161 4.8176 4.9580 4.9592 5.0911 5.0912 5.4305 5.4324 7.4494 7.5060 7.6393 7.6420 7.9102 7.9692 9.0185 9.0360 10.2024 10.3167 10.8668 10.9235 k = 0.4603 0.3574-0.0000 ( 6832 PWs) bands (ev): -64.4515 -64.4515 -37.3783 -37.3783 -28.8199 -28.8199 -28.8082 -28.8082 -16.8108 -16.8107 -16.6147 -16.6116 -15.2414 -15.2414 -14.8595 -14.8503 -14.6174 -14.6132 -14.4243 -14.4231 -10.1085 -10.1085 -10.0799 -10.0799 -5.9355 -5.9352 -5.8298 -5.8287 -5.7295 -5.7267 -4.9122 -4.9085 -3.7555 -3.7554 -3.7057 -3.7050 -3.5967 -3.5962 -3.5760 -3.5755 -3.2522 -3.2503 -2.6137 -2.6055 -1.7890 -1.7856 -1.1786 -1.1747 -0.9515 -0.9502 -0.4274 -0.4225 0.2245 0.2388 0.3387 0.3397 0.5839 0.5852 0.8311 0.8440 1.1327 1.1339 1.4277 1.4327 1.4853 1.4889 1.6439 1.6515 1.9587 1.9591 2.6161 2.6214 3.7836 3.7864 3.9804 3.9841 4.4015 4.4025 4.7039 4.7062 4.8205 4.8223 4.9586 4.9601 5.0883 5.0887 5.4234 5.4259 7.4449 7.5113 7.6416 7.6425 7.9038 7.9757 9.0248 9.0461 10.1799 10.3111 10.8368 10.8878 k = 0.4524 0.3712-0.0000 ( 6828 PWs) bands (ev): -64.4515 -64.4515 -37.3783 -37.3783 -28.8199 -28.8199 -28.8082 -28.8082 -16.8063 -16.8062 -16.6182 -16.6147 -15.2438 -15.2438 -14.8563 -14.8456 -14.6211 -14.6162 -14.4245 -14.4231 -10.1081 -10.1081 -10.0802 -10.0801 -5.9354 -5.9350 -5.8293 -5.8282 -5.7173 -5.7139 -4.9357 -4.9317 -3.7554 -3.7553 -3.7053 -3.7045 -3.5965 -3.5960 -3.5756 -3.5750 -3.2289 -3.2263 -2.6205 -2.6105 -1.7849 -1.7808 -1.1770 -1.1724 -0.9525 -0.9511 -0.4430 -0.4373 0.2087 0.2238 0.3266 0.3280 0.5969 0.5976 0.8526 0.8667 1.1388 1.1403 1.4242 1.4291 1.4823 1.4866 1.6622 1.6701 1.9468 1.9475 2.5999 2.6062 3.7772 3.7805 3.9511 3.9555 4.4384 4.4398 4.6998 4.7023 4.8252 4.8273 4.9595 4.9612 5.0849 5.0857 5.4150 5.4180 7.4417 7.5157 7.6425 7.6447 7.8979 7.9817 9.0329 9.0574 10.1584 10.3010 10.8038 10.8479 k = 0.4444 0.3849-0.0000 ( 6822 PWs) bands (ev): -64.4515 -64.4515 -37.3783 -37.3783 -28.8199 -28.8199 -28.8082 -28.8082 -16.8012 -16.8011 -16.6221 -16.6183 -15.2466 -15.2466 -14.8524 -14.8404 -14.6253 -14.6198 -14.4247 -14.4230 -10.1076 -10.1076 -10.0805 -10.0805 -5.9352 -5.9348 -5.8288 -5.8276 -5.7029 -5.6990 -4.9617 -4.9578 -3.7553 -3.7552 -3.7049 -3.7040 -3.5962 -3.5957 -3.5752 -3.5745 -3.2030 -3.1996 -2.6284 -2.6166 -1.7800 -1.7751 -1.1744 -1.1693 -0.9537 -0.9521 -0.4611 -0.4547 0.1924 0.2078 0.3126 0.3146 0.6126 0.6126 0.8764 0.8911 1.1458 1.1478 1.4206 1.4252 1.4789 1.4839 1.6816 1.6892 1.9339 1.9350 2.5810 2.5884 3.7701 3.7737 3.9224 3.9275 4.4761 4.4778 4.6958 4.6984 4.8299 4.8322 4.9606 4.9626 5.0809 5.0823 5.4051 5.4087 7.4401 7.5192 7.6421 7.6483 7.8926 7.9869 9.0425 9.0697 10.1384 10.2875 10.7675 10.8049 k = 0.4365 0.3986-0.0000 ( 6822 PWs) bands (ev): -64.4515 -64.4515 -37.3783 -37.3783 -28.8199 -28.8199 -28.8082 -28.8082 -16.7954 -16.7954 -16.6264 -16.6224 -15.2497 -15.2497 -14.8480 -14.8349 -14.6300 -14.6240 -14.4247 -14.4228 -10.1070 -10.1070 -10.0809 -10.0809 -5.9350 -5.9346 -5.8283 -5.8271 -5.6866 -5.6820 -4.9898 -4.9863 -3.7551 -3.7551 -3.7045 -3.7035 -3.5959 -3.5954 -3.5747 -3.5740 -3.1751 -3.1708 -2.6375 -2.6238 -1.7743 -1.7687 -1.1707 -1.1651 -0.9551 -0.9534 -0.4815 -0.4747 0.1761 0.1913 0.2971 0.2996 0.6301 0.6307 0.9020 0.9168 1.1536 1.1561 1.4167 1.4208 1.4752 1.4807 1.7004 1.7073 1.9212 1.9231 2.5596 2.5680 3.7624 3.7663 3.8947 3.9005 4.5141 4.5162 4.6921 4.6947 4.8346 4.8370 4.9620 4.9642 5.0763 5.0786 5.3940 5.3982 7.4401 7.5219 7.6412 7.6522 7.8880 7.9911 9.0534 9.0828 10.1205 10.2715 10.7284 10.7594 k = 0.4286 0.4124-0.0000 ( 6818 PWs) bands (ev): -64.4515 -64.4515 -37.3783 -37.3783 -28.8199 -28.8199 -28.8083 -28.8082 -16.7892 -16.7891 -16.6310 -16.6268 -15.2532 -15.2532 -14.8430 -14.8291 -14.6351 -14.6288 -14.4246 -14.4224 -10.1064 -10.1064 -10.0814 -10.0814 -5.9348 -5.9344 -5.8278 -5.8267 -5.6683 -5.6632 -5.0195 -5.0165 -3.7550 -3.7550 -3.7041 -3.7029 -3.5956 -3.5951 -3.5743 -3.5735 -3.1458 -3.1405 -2.6477 -2.6320 -1.7678 -1.7615 -1.1657 -1.1597 -0.9566 -0.9549 -0.5043 -0.4970 0.1604 0.1750 0.2806 0.2837 0.6498 0.6510 0.9289 0.9433 1.1621 1.1652 1.4124 1.4160 1.4711 1.4773 1.7165 1.7220 1.9107 1.9138 2.5359 2.5452 3.7543 3.7584 3.8683 3.8749 4.5519 4.5545 4.6888 4.6913 4.8390 4.8414 4.9639 4.9661 5.0714 5.0748 5.3818 5.3865 7.4417 7.5241 7.6398 7.6558 7.8841 7.9942 9.0655 9.0963 10.1050 10.2543 10.6869 10.7125 k = 0.4206 0.4261-0.0000 ( 6826 PWs) bands (ev): -64.4515 -64.4515 -37.3783 -37.3783 -28.8200 -28.8200 -28.8083 -28.8082 -16.7825 -16.7824 -16.6358 -16.6316 -15.2570 -15.2570 -14.8375 -14.8231 -14.6406 -14.6340 -14.4243 -14.4220 -10.1057 -10.1057 -10.0820 -10.0820 -5.9346 -5.9342 -5.8274 -5.8263 -5.6483 -5.6428 -5.0501 -5.0480 -3.7549 -3.7548 -3.7037 -3.7024 -3.5953 -3.5948 -3.5739 -3.5731 -3.1157 -3.1094 -2.6591 -2.6413 -1.7606 -1.7536 -1.1589 -1.1526 -0.9583 -0.9565 -0.5291 -0.5216 0.1455 0.1592 0.2635 0.2671 0.6714 0.6731 0.9567 0.9703 1.1711 1.1748 1.4077 1.4107 1.4669 1.4735 1.7269 1.7304 1.9051 1.9100 2.5099 2.5201 3.7460 3.7501 3.8435 3.8508 4.5890 4.5920 4.6862 4.6884 4.8432 4.8454 4.9661 4.9684 5.0661 5.0707 5.3684 5.3738 7.4451 7.5260 7.6378 7.6590 7.8812 7.9961 9.0783 9.1099 10.0925 10.2370 10.6439 10.6648 k = 0.4127 0.4399-0.0000 ( 6834 PWs) bands (ev): -64.4515 -64.4515 -37.3783 -37.3783 -28.8200 -28.8200 -28.8083 -28.8083 -16.7755 -16.7753 -16.6406 -16.6366 -15.2610 -15.2610 -14.8317 -14.8170 -14.6463 -14.6395 -14.4239 -14.4214 -10.1049 -10.1049 -10.0826 -10.0826 -5.9344 -5.9340 -5.8271 -5.8260 -5.6269 -5.6209 -5.0813 -5.0804 -3.7548 -3.7547 -3.7032 -3.7019 -3.5949 -3.5945 -3.5737 -3.5728 -3.0853 -3.0781 -2.6715 -2.6515 -1.7526 -1.7451 -1.1504 -1.1438 -0.9601 -0.9583 -0.5560 -0.5482 0.1319 0.1445 0.2460 0.2502 0.6946 0.6967 0.9850 0.9974 1.1805 1.1849 1.4024 1.4046 1.4624 1.4695 1.7287 1.7299 1.9076 1.9145 2.4818 2.4929 3.7376 3.7416 3.8204 3.8286 4.6243 4.6280 4.6848 4.6865 4.8469 4.8489 4.9690 4.9712 5.0605 5.0667 5.3542 5.3601 7.4503 7.5277 7.6353 7.6612 7.8792 7.9966 9.0917 9.1233 10.0833 10.2205 10.6000 10.6170 k = 0.4048 0.4536-0.0000 ( 6826 PWs) bands (ev): -64.4515 -64.4515 -37.3783 -37.3783 -28.8200 -28.8200 -28.8083 -28.8083 -16.7684 -16.7680 -16.6455 -16.6418 -15.2651 -15.2651 -14.8256 -14.8110 -14.6522 -14.6453 -14.4232 -14.4206 -10.1041 -10.1041 -10.0833 -10.0833 -5.9342 -5.9339 -5.8268 -5.8257 -5.6041 -5.5979 -5.1131 -5.1126 -3.7548 -3.7546 -3.7028 -3.7014 -3.5946 -3.5941 -3.5736 -3.5727 -3.0552 -3.0470 -2.6849 -2.6625 -1.7441 -1.7361 -1.1398 -1.1331 -0.9621 -0.9602 -0.5846 -0.5767 0.1197 0.1311 0.2286 0.2334 0.7190 0.7215 1.0136 1.0244 1.1901 1.1952 1.3960 1.3975 1.4579 1.4654 1.7204 1.7211 1.9191 1.9275 2.4520 2.4638 3.7292 3.7330 3.7992 3.8084 4.6545 4.6594 4.6877 4.6881 4.8501 4.8518 4.9727 4.9747 5.0549 5.0627 5.3392 5.3455 7.4572 7.5295 7.6323 7.6622 7.8784 7.9958 9.1053 9.1359 10.0777 10.2055 10.5561 10.5696 k = 0.3968 0.4674-0.0000 ( 6816 PWs) bands (ev): -64.4515 -64.4515 -37.3783 -37.3783 -28.8200 -28.8200 -28.8083 -28.8083 -16.7612 -16.7607 -16.6503 -16.6470 -15.2694 -15.2694 -14.8194 -14.8051 -14.6581 -14.6513 -14.4225 -14.4198 -10.1032 -10.1031 -10.0840 -10.0840 -5.9341 -5.9338 -5.8265 -5.8254 -5.5804 -5.5740 -5.1458 -5.1435 -3.7547 -3.7545 -3.7024 -3.7009 -3.5943 -3.5938 -3.5736 -3.5727 -3.0258 -3.0168 -2.6991 -2.6743 -1.7352 -1.7269 -1.1271 -1.1203 -0.9641 -0.9621 -0.6148 -0.6070 0.1093 0.1193 0.2115 0.2169 0.7444 0.7471 1.0421 1.0511 1.1997 1.2055 1.3883 1.3891 1.4534 1.4612 1.7040 1.7060 1.9378 1.9472 2.4206 2.4331 3.7212 3.7246 3.7801 3.7903 4.6684 4.6730 4.7053 4.7059 4.8529 4.8541 4.9775 4.9790 5.0493 5.0591 5.3236 5.3303 7.4659 7.5313 7.6288 7.6617 7.8787 7.9936 9.1186 9.1475 10.0762 10.1928 10.5125 10.5232 k = 0.3889 0.4811-0.0000 ( 6804 PWs) bands (ev): -64.4515 -64.4515 -37.3783 -37.3783 -28.8200 -28.8200 -28.8083 -28.8083 -16.7542 -16.7535 -16.6549 -16.6521 -15.2736 -15.2736 -14.8131 -14.7996 -14.6639 -14.6573 -14.4216 -14.4189 -10.1022 -10.1021 -10.0849 -10.0849 -5.9340 -5.9337 -5.8262 -5.8252 -5.5560 -5.5497 -5.1780 -5.1737 -3.7546 -3.7545 -3.7020 -3.7004 -3.5940 -3.5935 -3.5738 -3.5730 -2.9974 -2.9879 -2.7141 -2.6865 -1.7259 -1.7175 -1.1121 -1.1053 -0.9660 -0.9638 -0.6465 -0.6387 0.1009 0.1094 0.1950 0.2010 0.7702 0.7730 1.0703 1.0774 1.2089 1.2155 1.3788 1.3789 1.4490 1.4569 1.6839 1.6868 1.9614 1.9712 2.3879 2.4010 3.7135 3.7163 3.7632 3.7745 4.6704 4.6738 4.7327 4.7341 4.8550 4.8557 4.9834 4.9843 5.0440 5.0559 5.3076 5.3145 7.4762 7.5333 7.6249 7.6596 7.8802 7.9899 9.1313 9.1578 10.0788 10.1829 10.4700 10.4782 k = 0.3810 0.4949-0.0000 ( 6792 PWs) bands (ev): -64.4515 -64.4515 -37.3783 -37.3783 -28.8200 -28.8200 -28.8083 -28.8083 -16.7475 -16.7466 -16.6591 -16.6570 -15.2777 -15.2777 -14.8069 -14.7945 -14.6694 -14.6631 -14.4206 -14.4180 -10.1011 -10.1011 -10.0858 -10.0858 -5.9339 -5.9336 -5.8260 -5.8250 -5.5312 -5.5252 -5.2094 -5.2026 -3.7546 -3.7544 -3.7016 -3.7000 -3.5937 -3.5933 -3.5741 -3.5734 -2.9704 -2.9608 -2.7297 -2.6991 -1.7166 -1.7084 -1.0949 -1.0881 -0.9678 -0.9653 -0.6792 -0.6716 0.0946 0.1016 0.1792 0.1859 0.7959 0.7988 1.0980 1.1030 1.2177 1.2249 1.3665 1.3670 1.4450 1.4528 1.6626 1.6659 1.9878 1.9976 2.3544 2.3679 3.7063 3.7085 3.7487 3.7610 4.6702 4.6729 4.7596 4.7610 4.8564 4.8566 4.9906 4.9908 5.0391 5.0533 5.2917 5.2985 7.4881 7.5356 7.6204 7.6556 7.8832 7.9847 9.1430 9.1664 10.0858 10.1764 10.4289 10.4350 k = 0.3730 0.5086-0.0000 ( 6788 PWs) bands (ev): -64.4515 -64.4515 -37.3783 -37.3783 -28.8200 -28.8200 -28.8083 -28.8083 -16.7414 -16.7402 -16.6628 -16.6615 -15.2816 -15.2816 -14.8010 -14.7900 -14.6744 -14.6686 -14.4195 -14.4171 -10.1000 -10.0999 -10.0868 -10.0868 -5.9338 -5.9335 -5.8258 -5.8248 -5.5066 -5.5011 -5.2395 -5.2299 -3.7545 -3.7544 -3.7013 -3.6996 -3.5934 -3.5930 -3.5746 -3.5740 -2.9452 -2.9359 -2.7456 -2.7117 -1.7076 -1.6998 -1.0756 -1.0688 -0.9691 -0.9661 -0.7127 -0.7055 0.0905 0.0959 0.1643 0.1717 0.8211 0.8238 1.1248 1.1277 1.2256 1.2335 1.3515 1.3525 1.4413 1.4488 1.6423 1.6457 2.0157 2.0253 2.3205 2.3343 3.6997 3.7013 3.7366 3.7499 4.6696 4.6718 4.7835 4.7845 4.8569 4.8572 4.9980 4.9995 5.0351 5.0516 5.2761 5.2826 7.5016 7.5380 7.6155 7.6498 7.8874 7.9782 9.1535 9.1733 10.0971 10.1736 10.3898 10.3941 k = 0.3651 0.5224-0.0000 ( 6784 PWs) bands (ev): -64.4515 -64.4515 -37.3783 -37.3783 -28.8201 -28.8201 -28.8083 -28.8083 -16.7360 -16.7347 -16.6659 -16.6654 -15.2851 -15.2851 -14.7955 -14.7863 -14.6788 -14.6736 -14.4184 -14.4163 -10.0987 -10.0987 -10.0879 -10.0879 -5.9337 -5.9335 -5.8257 -5.8247 -5.4826 -5.4780 -5.2679 -5.2549 -3.7545 -3.7543 -3.7010 -3.6993 -3.5931 -3.5928 -3.5753 -3.5747 -2.9221 -2.9138 -2.7614 -2.7237 -1.6991 -1.6921 -1.0546 -1.0479 -0.9698 -0.9660 -0.7466 -0.7398 0.0886 0.0926 0.1505 0.1588 0.8448 0.8474 1.1505 1.1514 1.2325 1.2408 1.3338 1.3351 1.4382 1.4450 1.6245 1.6277 2.0443 2.0535 2.2867 2.3007 3.6939 3.6949 3.7269 3.7411 4.6691 4.6708 4.8035 4.8038 4.8564 4.8571 5.0058 5.0089 5.0322 5.0513 5.2614 5.2673 7.5165 7.5405 7.6101 7.6422 7.8931 7.9704 9.1625 9.1783 10.1128 10.1746 10.3529 10.3556 k = 0.3571 0.5361-0.0000 ( 6798 PWs) bands (ev): -64.4515 -64.4515 -37.3783 -37.3783 -28.8201 -28.8201 -28.8083 -28.8083 -16.7317 -16.7303 -16.6684 -16.6682 -15.2881 -15.2881 -14.7907 -14.7836 -14.6823 -14.6778 -14.4174 -14.4157 -10.0975 -10.0975 -10.0891 -10.0891 -5.9336 -5.9335 -5.8255 -5.8245 -5.4600 -5.4570 -5.2939 -5.2768 -3.7545 -3.7543 -3.7007 -3.6991 -3.5928 -3.5926 -3.5760 -3.5755 -2.9015 -2.8951 -2.7768 -2.7346 -1.6915 -1.6858 -1.0331 -1.0265 -0.9690 -0.9642 -0.7800 -0.7739 0.0888 0.0915 0.1380 0.1472 0.8662 0.8684 1.1736 1.1744 1.2381 1.2466 1.3139 1.3154 1.4357 1.4415 1.6104 1.6131 2.0729 2.0815 2.2535 2.2677 3.6891 3.6897 3.7196 3.7344 4.6687 4.6700 4.8187 4.8193 4.8553 4.8562 5.0126 5.0180 5.0312 5.0526 5.2485 5.2533 7.5326 7.5432 7.6043 7.6327 7.9001 7.9614 9.1698 9.1815 10.1323 10.1794 10.3188 10.3200 k = 0.3492 0.5499-0.0000 ( 6786 PWs) bands (ev): -64.4515 -64.4515 -37.3783 -37.3783 -28.8201 -28.8201 -28.8083 -28.8083 -16.7285 -16.7273 -16.6705 -16.6696 -15.2905 -15.2905 -14.7868 -14.7820 -14.6849 -14.6810 -14.4165 -14.4152 -10.0961 -10.0961 -10.0904 -10.0904 -5.9336 -5.9335 -5.8255 -5.8245 -5.4404 -5.4393 -5.3162 -5.2945 -3.7545 -3.7543 -3.7005 -3.6989 -3.5926 -3.5924 -3.5766 -3.5763 -2.8842 -2.8807 -2.7908 -2.7434 -1.6853 -1.6811 -1.0134 -1.0074 -0.9651 -0.9593 -0.8113 -0.8063 0.0908 0.0926 0.1270 0.1374 0.8840 0.8857 1.1935 1.1955 1.2429 1.2509 1.2934 1.2949 1.4341 1.4385 1.6005 1.6025 2.1010 2.1084 2.2219 2.2365 3.6854 3.6857 3.7145 3.7298 4.6684 4.6693 4.8293 4.8311 4.8539 4.8546 5.0170 5.0252 5.0323 5.0557 5.2384 5.2417 7.5458 7.5496 7.5984 7.6217 7.9085 7.9514 9.1754 9.1829 10.1551 10.1870 10.2880 10.2885 k = 0.3413 0.5636-0.0000 ( 6790 PWs) bands (ev): -64.4515 -64.4515 -37.3783 -37.3783 -28.8201 -28.8201 -28.8083 -28.8083 -16.7266 -16.7257 -16.6716 -16.6703 -15.2920 -15.2920 -14.7838 -14.7815 -14.6864 -14.6831 -14.4158 -14.4151 -10.0947 -10.0947 -10.0918 -10.0918 -5.9335 -5.9335 -5.8254 -5.8244 -5.4270 -5.4263 -5.3322 -5.3060 -3.7544 -3.7544 -3.7004 -3.6988 -3.5924 -3.5923 -3.5771 -3.5769 -2.8720 -2.8714 -2.8014 -2.7492 -1.6808 -1.6785 -0.9993 -0.9958 -0.9568 -0.9507 -0.8366 -0.8336 0.0939 0.0950 0.1181 0.1301 0.8964 0.8973 1.2089 1.2104 1.2487 1.2542 1.2752 1.2761 1.4335 1.4359 1.5950 1.5961 2.1274 2.1320 2.1934 2.2095 3.6831 3.6832 3.7116 3.7271 4.6684 4.6688 4.8357 4.8388 4.8524 4.8526 5.0192 5.0301 5.0336 5.0589 5.2321 5.2337 7.5479 7.5662 7.5934 7.6094 7.9182 7.9406 9.1794 9.1830 10.1791 10.1952 10.2610 10.2645 k = 0.3333 0.5774-0.0000 ( 6798 PWs) bands (ev): -64.4515 -64.4515 -37.3783 -37.3783 -28.8201 -28.8201 -28.8083 -28.8083 -16.7256 -16.7256 -16.6719 -16.6704 -15.2925 -15.2925 -14.7821 -14.7821 -14.6869 -14.6838 -14.4153 -14.4153 -10.0932 -10.0932 -10.0932 -10.0932 -5.9335 -5.9335 -5.8254 -5.8244 -5.4219 -5.4219 -5.3381 -5.3099 -3.7544 -3.7544 -3.7004 -3.6987 -3.5923 -3.5923 -3.5772 -3.5772 -2.8679 -2.8679 -2.8055 -2.7511 -1.6784 -1.6784 -0.9933 -0.9933 -0.9513 -0.9450 -0.8467 -0.8467 0.0962 0.0962 0.1142 0.1272 0.9013 0.9013 1.2151 1.2151 1.2557 1.2574 1.2651 1.2651 1.4341 1.4341 1.5936 1.5936 2.1434 2.1434 2.1772 2.1964 3.6823 3.6823 3.7106 3.7262 4.6685 4.6685 4.8378 4.8416 4.8517 4.8517 5.0201 5.0330 5.0330 5.0602 5.2304 5.2304 7.5490 7.5747 7.5969 7.5969 7.9291 7.9291 9.1818 9.1818 10.1961 10.1961 10.2473 10.2542 k = 0.3333 0.5774-0.0000 ( 6798 PWs) bands (ev): -64.4515 -64.4515 -37.3783 -37.3783 -28.8201 -28.8201 -28.8083 -28.8083 -16.7256 -16.7256 -16.6719 -16.6704 -15.2925 -15.2925 -14.7821 -14.7821 -14.6869 -14.6838 -14.4153 -14.4153 -10.0932 -10.0932 -10.0932 -10.0932 -5.9335 -5.9335 -5.8254 -5.8244 -5.4219 -5.4219 -5.3381 -5.3099 -3.7544 -3.7544 -3.7004 -3.6987 -3.5923 -3.5923 -3.5772 -3.5772 -2.8679 -2.8679 -2.8055 -2.7511 -1.6784 -1.6784 -0.9933 -0.9933 -0.9513 -0.9450 -0.8467 -0.8467 0.0962 0.0962 0.1142 0.1272 0.9013 0.9013 1.2151 1.2151 1.2557 1.2574 1.2651 1.2651 1.4341 1.4341 1.5936 1.5936 2.1434 2.1434 2.1772 2.1964 3.6823 3.6823 3.7106 3.7262 4.6685 4.6685 4.8378 4.8416 4.8517 4.8517 5.0201 5.0330 5.0330 5.0602 5.2304 5.2304 7.5490 7.5747 7.5969 7.5969 7.9291 7.9291 9.1818 9.1818 10.1961 10.1961 10.2473 10.2542 k = 0.3254 0.5636-0.0000 ( 6790 PWs) bands (ev): -64.4515 -64.4515 -37.3783 -37.3783 -28.8201 -28.8201 -28.8083 -28.8083 -16.7266 -16.7255 -16.6718 -16.6704 -15.2920 -15.2919 -14.7837 -14.7816 -14.6864 -14.6831 -14.4159 -14.4150 -10.0948 -10.0948 -10.0917 -10.0917 -5.9335 -5.9335 -5.8254 -5.8244 -5.4280 -5.4237 -5.3333 -5.3067 -3.7544 -3.7543 -3.7004 -3.6988 -3.5925 -3.5923 -3.5770 -3.5769 -2.8728 -2.8697 -2.8019 -2.7494 -1.6811 -1.6784 -1.0007 -0.9969 -0.9557 -0.9505 -0.8355 -0.8336 0.0928 0.0957 0.1181 0.1304 0.8958 0.8968 1.2116 1.2122 1.2488 1.2527 1.2732 1.2761 1.4334 1.4363 1.5949 1.5960 2.1303 2.1320 2.1923 2.2081 3.6831 3.6832 3.7116 3.7270 4.6684 4.6688 4.8361 4.8394 4.8517 4.8526 5.0176 5.0317 5.0330 5.0594 5.2323 5.2332 7.5470 7.5701 7.5860 7.6138 7.9174 7.9414 9.1797 9.1828 10.1840 10.1894 10.2628 10.2632 k = 0.3175 0.5499-0.0000 ( 6790 PWs) bands (ev): -64.4515 -64.4515 -37.3783 -37.3783 -28.8201 -28.8201 -28.8083 -28.8083 -16.7283 -16.7259 -16.6716 -16.6706 -15.2901 -15.2900 -14.7861 -14.7822 -14.6853 -14.6811 -14.4169 -14.4152 -10.0964 -10.0964 -10.0901 -10.0901 -5.9336 -5.9335 -5.8255 -5.8245 -5.4396 -5.4297 -5.3231 -5.2993 -3.7545 -3.7543 -3.7005 -3.6989 -3.5927 -3.5924 -3.5761 -3.5758 -2.8832 -2.8757 -2.7940 -2.7451 -1.6867 -1.6811 -1.0215 -1.0149 -0.9597 -0.9560 -0.8063 -0.8040 0.0876 0.0928 0.1272 0.1392 0.8799 0.8820 1.2054 1.2078 1.2412 1.2468 1.2867 1.2908 1.4342 1.4403 1.5995 1.6017 2.1110 2.1131 2.2165 2.2299 3.6857 3.6858 3.7142 3.7296 4.6685 4.6693 4.8322 4.8346 4.8516 4.8533 5.0082 5.0274 5.0340 5.0596 5.2383 5.2394 7.5390 7.5619 7.5801 7.6343 7.9056 7.9548 9.1769 9.1828 10.1669 10.1726 10.2832 10.2937 k = 0.3095 0.5361-0.0000 ( 6794 PWs) bands (ev): -64.4515 -64.4515 -37.3783 -37.3783 -28.8201 -28.8201 -28.8083 -28.8083 -16.7305 -16.7266 -16.6719 -16.6712 -15.2868 -15.2867 -14.7890 -14.7838 -14.6836 -14.6780 -14.4185 -14.4157 -10.0982 -10.0982 -10.0884 -10.0884 -5.9336 -5.9334 -5.8255 -5.8246 -5.4524 -5.4373 -5.3118 -5.2906 -3.7545 -3.7542 -3.7008 -3.6991 -3.5930 -3.5926 -3.5743 -3.5738 -2.8958 -2.8843 -2.7848 -2.7395 -1.6956 -1.6867 -1.0520 -1.0447 -0.9593 -0.9556 -0.7681 -0.7658 0.0826 0.0894 0.1390 0.1515 0.8545 0.8576 1.1982 1.2026 1.2362 1.2426 1.3004 1.3044 1.4371 1.4464 1.6073 1.6106 2.0943 2.0955 2.2412 2.2533 3.6899 3.6901 3.7186 3.7338 4.6687 4.6699 4.8271 4.8286 4.8507 4.8531 4.9933 5.0151 5.0390 5.0629 5.2467 5.2475 7.5246 7.5524 7.5795 7.6560 7.8940 7.9692 9.1738 9.1820 10.1502 10.1561 10.3081 10.3289 k = 0.3016 0.5224-0.0000 ( 6792 PWs) bands (ev): -64.4515 -64.4515 -37.3783 -37.3783 -28.8201 -28.8200 -28.8083 -28.8083 -16.7328 -16.7274 -16.6729 -16.6726 -15.2819 -15.2818 -14.7923 -14.7860 -14.6815 -14.6741 -14.4207 -14.4166 -10.1000 -10.1000 -10.0867 -10.0867 -5.9337 -5.9334 -5.8257 -5.8247 -5.4645 -5.4445 -5.3018 -5.2828 -3.7546 -3.7541 -3.7010 -3.6993 -3.5933 -3.5929 -3.5714 -3.5708 -2.9090 -2.8943 -2.7758 -2.7336 -1.7077 -1.6953 -1.0868 -1.0795 -0.9565 -0.9522 -0.7246 -0.7226 0.0784 0.0862 0.1525 0.1659 0.8217 0.8255 1.1860 1.1919 1.2374 1.2434 1.3134 1.3167 1.4424 1.4549 1.6180 1.6222 2.0815 2.0816 2.2652 2.2765 3.6959 3.6960 3.7247 3.7396 4.6692 4.6708 4.8212 4.8218 4.8488 4.8517 4.9751 4.9981 5.0458 5.0689 5.2559 5.2562 7.5065 7.5420 7.5817 7.6783 7.8829 7.9847 9.1705 9.1805 10.1357 10.1419 10.3358 10.3657 k = 0.2937 0.5086-0.0000 ( 6808 PWs) bands (ev): -64.4515 -64.4515 -37.3783 -37.3783 -28.8200 -28.8200 -28.8084 -28.8083 -16.7353 -16.7282 -16.6749 -16.6747 -15.2753 -15.2752 -14.7959 -14.7888 -14.6793 -14.6695 -14.4235 -14.4180 -10.1019 -10.1019 -10.0850 -10.0849 -5.9337 -5.9334 -5.8258 -5.8248 -5.4750 -5.4503 -5.2942 -5.2771 -3.7546 -3.7539 -3.7014 -3.6997 -3.5937 -3.5932 -3.5672 -3.5665 -2.9221 -2.9051 -2.7674 -2.7279 -1.7230 -1.7069 -1.1235 -1.1165 -0.9525 -0.9476 -0.6774 -0.6757 0.0749 0.0836 0.1673 0.1818 0.7839 0.7883 1.1667 1.1741 1.2446 1.2498 1.3256 1.3279 1.4503 1.4656 1.6313 1.6363 2.0716 2.0732 2.2884 2.2990 3.7034 3.7036 3.7323 3.7470 4.6699 4.6718 4.8145 4.8146 4.8461 4.8495 4.9545 4.9779 5.0541 5.0767 5.2644 5.2647 7.4865 7.5308 7.5853 7.7008 7.8725 8.0010 9.1673 9.1786 10.1238 10.1308 10.3651 10.4031 k = 0.2857 0.4949-0.0000 ( 6816 PWs) bands (ev): -64.4515 -64.4515 -37.3783 -37.3783 -28.8200 -28.8200 -28.8084 -28.8083 -16.7378 -16.7290 -16.6782 -16.6774 -15.2671 -15.2670 -14.7996 -14.7918 -14.6771 -14.6645 -14.4270 -14.4200 -10.1039 -10.1039 -10.0832 -10.0831 -5.9338 -5.9334 -5.8260 -5.8250 -5.4834 -5.4544 -5.2896 -5.2742 -3.7547 -3.7538 -3.7017 -3.7000 -3.5942 -3.5937 -3.5616 -3.5609 -2.9348 -2.9160 -2.7597 -2.7228 -1.7414 -1.7214 -1.1611 -1.1543 -0.9480 -0.9426 -0.6272 -0.6259 0.0722 0.0815 0.1828 0.1986 0.7432 0.7482 1.1412 1.1506 1.2552 1.2599 1.3373 1.3386 1.4606 1.4781 1.6470 1.6528 2.0662 2.0690 2.3104 2.3206 3.7125 3.7127 3.7416 3.7560 4.6708 4.6729 4.8067 4.8076 4.8427 4.8464 4.9322 4.9558 5.0637 5.0860 5.2713 5.2721 7.4653 7.5189 7.5897 7.7231 7.8634 8.0181 9.1642 9.1765 10.1150 10.1227 10.3952 10.4403 k = 0.2778 0.4811-0.0000 ( 6816 PWs) bands (ev): -64.4515 -64.4515 -37.3783 -37.3783 -28.8200 -28.8199 -28.8084 -28.8083 -16.7403 -16.7299 -16.6822 -16.6811 -15.2570 -15.2569 -14.8032 -14.7950 -14.6749 -14.6591 -14.4312 -14.4224 -10.1060 -10.1060 -10.0813 -10.0813 -5.9339 -5.9334 -5.8262 -5.8253 -5.4895 -5.4562 -5.2882 -5.2746 -3.7547 -3.7536 -3.7021 -3.7004 -3.5947 -3.5942 -3.5545 -3.5537 -2.9468 -2.9267 -2.7529 -2.7184 -1.7629 -1.7387 -1.1991 -1.1926 -0.9435 -0.9377 -0.5746 -0.5736 0.0699 0.0797 0.1987 0.2158 0.7017 0.7072 1.1108 1.1225 1.2674 1.2718 1.3493 1.3495 1.4728 1.4922 1.6648 1.6712 2.0651 2.0689 2.3313 2.3410 3.7230 3.7231 3.7525 3.7664 4.6718 4.6742 4.7985 4.8001 4.8387 4.8425 4.9087 4.9322 5.0746 5.0964 5.2762 5.2775 7.4435 7.5065 7.5946 7.7448 7.8559 8.0358 9.1615 9.1743 10.1093 10.1180 10.4254 10.4766 k = 0.2698 0.4674-0.0000 ( 6818 PWs) bands (ev): -64.4515 -64.4515 -37.3783 -37.3783 -28.8199 -28.8199 -28.8084 -28.8083 -16.7430 -16.7313 -16.6867 -16.6854 -15.2452 -15.2451 -14.8068 -14.7982 -14.6730 -14.6536 -14.4362 -14.4253 -10.1082 -10.1082 -10.0794 -10.0794 -5.9339 -5.9334 -5.8265 -5.8255 -5.4933 -5.4557 -5.2903 -5.2784 -3.7547 -3.7535 -3.7025 -3.7008 -3.5953 -3.5948 -3.5459 -3.5449 -2.9581 -2.9371 -2.7468 -2.7148 -1.7872 -1.7586 -1.2373 -1.2310 -0.9393 -0.9332 -0.5199 -0.5193 0.0678 0.0779 0.2144 0.2327 0.6609 0.6668 1.0767 1.0907 1.2802 1.2846 1.3613 1.3619 1.4866 1.5075 1.6845 1.6914 2.0679 2.0725 2.3510 2.3602 3.7348 3.7349 3.7649 3.7784 4.6730 4.6756 4.7902 4.7923 4.8340 4.8381 4.8844 4.9077 5.0865 5.1081 5.2789 5.2806 7.4214 7.4937 7.6000 7.7649 7.8509 8.0539 9.1590 9.1720 10.1068 10.1166 10.4550 10.5112 k = 0.2619 0.4536-0.0000 ( 6822 PWs) bands (ev): -64.4515 -64.4515 -37.3783 -37.3783 -28.8198 -28.8198 -28.8084 -28.8083 -16.7463 -16.7337 -16.6911 -16.6901 -15.2316 -15.2316 -14.8102 -14.8013 -14.6713 -14.6481 -14.4420 -14.4287 -10.1104 -10.1104 -10.0775 -10.0774 -5.9340 -5.9334 -5.8268 -5.8258 -5.4946 -5.4529 -5.2960 -5.2858 -3.7547 -3.7533 -3.7029 -3.7012 -3.5959 -3.5954 -3.5356 -3.5345 -2.9685 -2.9470 -2.7414 -2.7119 -1.8143 -1.7810 -1.2754 -1.2693 -0.9357 -0.9294 -0.4638 -0.4635 0.0654 0.0758 0.2292 0.2487 0.6223 0.6287 1.0402 1.0562 1.2931 1.2975 1.3742 1.3755 1.5017 1.5238 1.7058 1.7130 2.0743 2.0793 2.3693 2.3782 3.7479 3.7479 3.7788 3.7918 4.6742 4.6770 4.7818 4.7843 4.8289 4.8328 4.8596 4.8824 5.0995 5.1207 5.2791 5.2811 7.3993 7.4806 7.6056 7.7820 7.8496 8.0723 9.1569 9.1698 10.1077 10.1186 10.4834 10.5436 k = 0.2540 0.4399-0.0000 ( 6832 PWs) bands (ev): -64.4515 -64.4515 -37.3783 -37.3783 -28.8197 -28.8197 -28.8084 -28.8083 -16.7505 -16.7378 -16.6946 -16.6944 -15.2163 -15.2163 -14.8134 -14.8043 -14.6700 -14.6426 -14.4485 -14.4326 -10.1127 -10.1127 -10.0756 -10.0755 -5.9341 -5.9334 -5.8271 -5.8262 -5.4936 -5.4477 -5.3051 -5.2966 -3.7547 -3.7532 -3.7032 -3.7015 -3.5966 -3.5961 -3.5239 -3.5227 -2.9779 -2.9562 -2.7366 -2.7098 -1.8440 -1.8057 -1.3134 -1.3074 -0.9330 -0.9265 -0.4069 -0.4067 0.0625 0.0729 0.2426 0.2631 0.5873 0.5942 1.0022 1.0199 1.3059 1.3102 1.3886 1.3906 1.5178 1.5410 1.7283 1.7359 2.0838 2.0890 2.3864 2.3949 3.7620 3.7620 3.7940 3.8065 4.6755 4.6784 4.7734 4.7762 4.8231 4.8255 4.8359 4.8568 5.1134 5.1343 5.2767 5.2788 7.3774 7.4674 7.6115 7.7939 7.8543 8.0909 9.1550 9.1675 10.1119 10.1240 10.5101 10.5730 k = 0.2460 0.4261-0.0000 ( 6836 PWs) bands (ev): -64.4515 -64.4515 -37.3783 -37.3783 -28.8197 -28.8196 -28.8084 -28.8083 -16.7563 -16.7444 -16.6984 -16.6961 -15.1995 -15.1994 -14.8164 -14.8070 -14.6691 -14.6373 -14.4557 -14.4369 -10.1151 -10.1151 -10.0736 -10.0735 -5.9342 -5.9334 -5.8274 -5.8266 -5.4904 -5.4404 -5.3173 -5.3105 -3.7547 -3.7531 -3.7035 -3.7018 -3.5974 -3.5970 -3.5108 -3.5095 -2.9862 -2.9646 -2.7324 -2.7085 -1.8761 -1.8324 -1.3511 -1.3452 -0.9312 -0.9246 -0.3504 -0.3496 0.0589 0.0690 0.2538 0.2751 0.5573 0.5648 0.9641 0.9831 1.3184 1.3227 1.4045 1.4070 1.5351 1.5590 1.7519 1.7596 2.0960 2.1011 2.4021 2.4103 3.7771 3.7772 3.8106 3.8226 4.6766 4.6795 4.7651 4.7680 4.8059 4.8159 4.8238 4.8316 5.1281 5.1487 5.2716 5.2738 7.3560 7.4543 7.6178 7.7998 7.8655 8.1093 9.1533 9.1651 10.1194 10.1328 10.5345 10.5986 k = 0.2381 0.4124-0.0000 ( 6834 PWs) bands (ev): -64.4515 -64.4515 -37.3783 -37.3783 -28.8195 -28.8195 -28.8084 -28.8083 -16.7639 -16.7536 -16.7008 -16.6958 -15.1813 -15.1810 -14.8191 -14.8095 -14.6687 -14.6321 -14.4637 -14.4416 -10.1176 -10.1176 -10.0716 -10.0715 -5.9342 -5.9334 -5.8278 -5.8270 -5.4854 -5.4316 -5.3321 -5.3267 -3.7547 -3.7530 -3.7037 -3.7021 -3.5983 -3.5979 -3.4966 -3.4951 -2.9934 -2.9720 -2.7285 -2.7078 -1.9105 -1.8611 -1.3885 -1.3827 -0.9306 -0.9238 -0.2955 -0.2940 0.0552 0.0646 0.2620 0.2838 0.5334 0.5416 0.9272 0.9468 1.3306 1.3350 1.4217 1.4247 1.5535 1.5782 1.7762 1.7839 2.1104 2.1153 2.4165 2.4244 3.7932 3.7934 3.8282 3.8397 4.6775 4.6802 4.7571 4.7599 4.7804 4.8002 4.8146 4.8171 5.1436 5.1639 5.2639 5.2661 7.3353 7.4416 7.6243 7.8018 7.8809 8.1276 9.1519 9.1627 10.1302 10.1449 10.5563 10.6198 k = 0.2302 0.3986-0.0000 ( 6834 PWs) bands (ev): -64.4515 -64.4515 -37.3783 -37.3783 -28.8194 -28.8194 -28.8084 -28.8083 -16.7736 -16.7650 -16.7017 -16.6937 -15.1617 -15.1612 -14.8215 -14.8117 -14.6689 -14.6272 -14.4724 -14.4465 -10.1201 -10.1201 -10.0696 -10.0695 -5.9343 -5.9334 -5.8282 -5.8274 -5.4795 -5.4234 -5.3483 -5.3429 -3.7546 -3.7529 -3.7039 -3.7024 -3.5993 -3.5988 -3.4815 -3.4800 -2.9992 -2.9784 -2.7252 -2.7077 -1.9469 -1.8915 -1.4255 -1.4198 -0.9312 -0.9241 -0.2450 -0.2424 0.0531 0.0612 0.2662 0.2881 0.5167 0.5257 0.8927 0.9123 1.3426 1.3469 1.4402 1.4435 1.5734 1.5987 1.8010 1.8086 2.1265 2.1311 2.4295 2.4370 3.8102 3.8105 3.8469 3.8580 4.6779 4.6801 4.7490 4.7519 4.7551 4.7751 4.8066 4.8105 5.1597 5.1797 5.2539 5.2557 7.3155 7.4293 7.6310 7.8022 7.8980 8.1455 9.1504 9.1602 10.1442 10.1603 10.5749 10.6357 k = 0.2222 0.3849-0.0000 ( 6842 PWs) bands (ev): -64.4515 -64.4515 -37.3783 -37.3783 -28.8193 -28.8193 -28.8085 -28.8083 -16.7852 -16.7782 -16.7010 -16.6903 -15.1411 -15.1403 -14.8235 -14.8135 -14.6696 -14.6228 -14.4816 -14.4517 -10.1226 -10.1226 -10.0675 -10.0674 -5.9344 -5.9334 -5.8286 -5.8279 -5.4748 -5.4213 -5.3637 -5.3534 -3.7546 -3.7529 -3.7041 -3.7026 -3.6004 -3.5999 -3.4660 -3.4644 -3.0034 -2.9834 -2.7221 -2.7083 -1.9854 -1.9234 -1.4620 -1.4564 -0.9330 -0.9256 -0.2035 -0.1992 0.0567 0.0627 0.2656 0.2870 0.5078 0.5175 0.8620 0.8808 1.3543 1.3585 1.4593 1.4628 1.5951 1.6209 1.8259 1.8334 2.1440 2.1482 2.4411 2.4483 3.8281 3.8285 3.8664 3.8771 4.6776 4.6787 4.7280 4.7420 4.7438 4.7511 4.7997 4.8037 5.1760 5.1960 5.2417 5.2430 7.2967 7.4177 7.6380 7.8024 7.9152 8.1628 9.1490 9.1574 10.1611 10.1787 10.5900 10.6454 k = 0.2143 0.3712-0.0000 ( 6844 PWs) bands (ev): -64.4515 -64.4515 -37.3783 -37.3783 -28.8192 -28.8191 -28.8085 -28.8083 -16.7985 -16.7927 -16.6989 -16.6858 -15.1196 -15.1184 -14.8251 -14.8148 -14.6711 -14.6188 -14.4912 -14.4569 -10.1252 -10.1252 -10.0655 -10.0654 -5.9345 -5.9334 -5.8291 -5.8284 -5.4751 -5.4331 -5.3740 -5.3500 -3.7546 -3.7529 -3.7043 -3.7028 -3.6015 -3.6010 -3.4504 -3.4489 -3.0059 -2.9870 -2.7194 -2.7095 -2.0257 -1.9567 -1.4981 -1.4925 -0.9359 -0.9281 -0.1773 -0.1710 0.0721 0.0753 0.2593 0.2797 0.5069 0.5174 0.8363 0.8535 1.3658 1.3700 1.4787 1.4822 1.6190 1.6450 1.8508 1.8580 2.1625 2.1663 2.4512 2.4583 3.8468 3.8473 3.8866 3.8969 4.6744 4.6761 4.7040 4.7197 4.7382 4.7404 4.7927 4.7968 5.1917 5.2122 5.2284 5.2285 7.2791 7.4071 7.6452 7.8029 7.9319 8.1794 9.1476 9.1544 10.1808 10.2000 10.6015 10.6482 k = 0.2063 0.3574-0.0000 ( 6848 PWs) bands (ev): -64.4515 -64.4515 -37.3783 -37.3782 -28.8190 -28.8190 -28.8085 -28.8083 -16.8131 -16.8083 -16.6956 -16.6804 -15.0975 -15.0958 -14.8262 -14.8156 -14.6732 -14.6156 -14.5011 -14.4621 -10.1278 -10.1278 -10.0635 -10.0634 -5.9346 -5.9334 -5.8296 -5.8290 -5.4853 -5.4567 -5.3742 -5.3346 -3.7546 -3.7530 -3.7044 -3.7030 -3.6027 -3.6023 -3.4352 -3.4340 -3.0063 -2.9889 -2.7171 -2.7113 -2.0677 -1.9912 -1.5336 -1.5281 -0.9399 -0.9316 -0.1703 -0.1622 0.1031 0.1037 0.2467 0.2656 0.5137 0.5251 0.8164 0.8314 1.3772 1.3813 1.4978 1.5012 1.6455 1.6715 1.8755 1.8824 2.1817 2.1851 2.4600 2.4668 3.8664 3.8669 3.9072 3.9172 4.6623 4.6717 4.6864 4.6950 4.7340 4.7345 4.7857 4.7897 5.1991 5.2095 5.2217 5.2311 7.2629 7.3974 7.6526 7.8039 7.9476 8.1952 9.1460 9.1512 10.2029 10.2238 10.6090 10.6436 k = 0.1984 0.3437-0.0000 ( 6848 PWs) bands (ev): -64.4515 -64.4515 -37.3782 -37.3782 -28.8189 -28.8188 -28.8085 -28.8083 -16.8287 -16.8247 -16.6913 -16.6743 -15.0751 -15.0728 -14.8267 -14.8158 -14.6760 -14.6135 -14.5107 -14.4673 -10.1304 -10.1304 -10.0615 -10.0613 -5.9347 -5.9334 -5.8302 -5.8296 -5.5057 -5.4863 -5.3636 -5.3127 -3.7546 -3.7531 -3.7045 -3.7032 -3.6040 -3.6035 -3.4209 -3.4201 -3.0045 -2.9889 -2.7151 -2.7137 -2.1111 -2.0267 -1.5685 -1.5629 -0.9448 -0.9359 -0.1796 -0.1707 0.1454 0.1468 0.2278 0.2448 0.5279 0.5402 0.8027 0.8149 1.3885 1.3924 1.5163 1.5193 1.6748 1.7006 1.8998 1.9063 2.2014 2.2044 2.4674 2.4740 3.8867 3.8872 3.9280 3.9379 4.6402 4.6576 4.6773 4.6785 4.7301 4.7311 4.7786 4.7825 5.1860 5.1908 5.2339 5.2481 7.2481 7.3889 7.6602 7.8056 7.9621 8.2101 9.1442 9.1476 10.2270 10.2497 10.6127 10.6314 k = 0.1905 0.3299-0.0000 ( 6848 PWs) bands (ev): -64.4515 -64.4515 -37.3782 -37.3782 -28.8187 -28.8187 -28.8085 -28.8083 -16.8450 -16.8417 -16.6860 -16.6674 -15.0528 -15.0497 -14.8266 -14.8152 -14.6794 -14.6128 -14.5198 -14.4721 -10.1330 -10.1330 -10.0594 -10.0593 -5.9348 -5.9334 -5.8307 -5.8302 -5.5330 -5.5193 -5.3451 -5.2866 -3.7546 -3.7532 -3.7046 -3.7034 -3.6054 -3.6049 -3.4079 -3.4076 -3.0003 -2.9870 -2.7167 -2.7136 -2.1558 -2.0630 -1.6027 -1.5971 -0.9505 -0.9408 -0.1998 -0.1908 0.1907 0.1913 0.2094 0.2221 0.5493 0.5624 0.7948 0.8040 1.3997 1.4035 1.5338 1.5363 1.7069 1.7322 1.9235 1.9295 2.2214 2.2241 2.4735 2.4799 3.9078 3.9082 3.9489 3.9586 4.6150 4.6331 4.6704 4.6710 4.7270 4.7293 4.7715 4.7752 5.1667 5.1701 5.2510 5.2656 7.2350 7.3817 7.6679 7.8080 7.9751 8.2238 9.1423 9.1436 10.2524 10.2772 10.6120 10.6126 k = 0.1825 0.3162-0.0000 ( 6849 PWs) bands (ev): -64.4515 -64.4515 -37.3782 -37.3782 -28.8185 -28.8185 -28.8086 -28.8083 -16.8620 -16.8592 -16.6800 -16.6600 -15.0309 -15.0269 -14.8258 -14.8136 -14.6834 -14.6142 -14.5276 -14.4767 -10.1356 -10.1356 -10.0575 -10.0573 -5.9350 -5.9335 -5.8314 -5.8308 -5.5644 -5.5544 -5.3214 -5.2573 -3.7546 -3.7533 -3.7047 -3.7036 -3.6068 -3.6063 -3.3970 -3.3967 -2.9936 -2.9832 -2.7202 -2.7126 -2.2015 -2.0999 -1.6361 -1.6306 -0.9567 -0.9461 -0.2263 -0.2176 0.1686 0.1783 0.2548 0.2557 0.5776 0.5914 0.7922 0.7983 1.4108 1.4145 1.5502 1.5521 1.7415 1.7662 1.9464 1.9521 2.2414 2.2437 2.4782 2.4844 3.9295 3.9299 3.9696 3.9794 4.5892 4.6066 4.6634 4.6645 4.7248 4.7283 4.7643 4.7678 5.1453 5.1480 5.2689 5.2831 7.2235 7.3758 7.6757 7.8110 7.9865 8.2364 9.1394 9.1401 10.2785 10.3053 10.5865 10.6090 k = 0.1746 0.3024-0.0000 ( 6861 PWs) bands (ev): -64.4515 -64.4515 -37.3782 -37.3782 -28.8184 -28.8183 -28.8086 -28.8084 -16.8792 -16.8770 -16.6733 -16.6520 -15.0099 -15.0048 -14.8240 -14.8107 -14.6878 -14.6182 -14.5334 -14.4809 -10.1382 -10.1382 -10.0555 -10.0554 -5.9352 -5.9336 -5.8320 -5.8315 -5.5984 -5.5910 -5.2936 -5.2251 -3.7547 -3.7535 -3.7047 -3.7038 -3.6083 -3.6077 -3.3886 -3.3876 -2.9844 -2.9776 -2.7242 -2.7124 -2.2478 -2.1371 -1.6687 -1.6632 -0.9633 -0.9517 -0.2565 -0.2481 0.1326 0.1409 0.3084 0.3106 0.6125 0.6271 0.7938 0.7972 1.4219 1.4254 1.5655 1.5668 1.7783 1.8024 1.9686 1.9737 2.2612 2.2633 2.4817 2.4878 3.9517 3.9522 3.9898 3.9998 4.5635 4.5799 4.6560 4.6577 4.7232 4.7276 4.7571 4.7603 5.1226 5.1248 5.2869 5.3006 7.2137 7.3714 7.6836 7.8146 7.9962 8.2477 9.1348 9.1377 10.3042 10.3328 10.5570 10.6023 k = 0.1667 0.2887-0.0000 ( 6857 PWs) bands (ev): -64.4515 -64.4515 -37.3782 -37.3782 -28.8182 -28.8181 -28.8086 -28.8084 -16.8967 -16.8948 -16.6659 -16.6436 -14.9905 -14.9840 -14.8213 -14.8062 -14.6924 -14.6251 -14.5370 -14.4846 -10.1408 -10.1408 -10.0535 -10.0534 -5.9355 -5.9337 -5.8327 -5.8321 -5.6339 -5.6286 -5.2626 -5.1904 -3.7547 -3.7536 -3.7048 -3.7040 -3.6097 -3.6092 -3.3824 -3.3806 -2.9730 -2.9707 -2.7286 -2.7132 -2.2941 -2.1744 -1.7004 -1.6949 -0.9699 -0.9573 -0.2885 -0.2806 0.0924 0.0988 0.3616 0.3643 0.6541 0.6690 0.7990 0.7999 1.4329 1.4362 1.5796 1.5804 1.8169 1.8404 1.9898 1.9943 2.2808 2.2827 2.4839 2.4899 3.9744 3.9748 4.0095 4.0197 4.5382 4.5535 4.6485 4.6505 4.7219 4.7271 4.7499 4.7528 5.0989 5.1008 5.3049 5.3178 7.2059 7.3685 7.6914 7.8187 8.0041 8.2577 9.1299 9.1351 10.3283 10.3572 10.5261 10.5931 k = 0.1587 0.2749-0.0000 ( 6849 PWs) bands (ev): -64.4515 -64.4515 -37.3782 -37.3782 -28.8180 -28.8179 -28.8086 -28.8084 -16.9143 -16.9127 -16.6580 -16.6347 -14.9730 -14.9651 -14.8176 -14.7999 -14.6966 -14.6347 -14.5383 -14.4878 -10.1434 -10.1434 -10.0516 -10.0515 -5.9359 -5.9338 -5.8334 -5.8328 -5.6703 -5.6667 -5.2286 -5.1533 -3.7548 -3.7538 -3.7049 -3.7042 -3.6113 -3.6107 -3.3783 -3.3758 -2.9632 -2.9597 -2.7330 -2.7157 -2.3396 -2.2113 -1.7312 -1.7257 -0.9764 -0.9627 -0.3215 -0.3141 0.0492 0.0539 0.4127 0.4155 0.7017 0.7165 0.8056 0.8069 1.4437 1.4469 1.5928 1.5931 1.8569 1.8797 2.0100 2.0139 2.2999 2.3017 2.4849 2.4908 3.9974 3.9978 4.0283 4.0389 4.5137 4.5277 4.6408 4.6430 4.7206 4.7264 4.7427 4.7452 5.0747 5.0761 5.3226 5.3348 7.1999 7.3672 7.6993 7.8234 8.0101 8.2661 9.1247 9.1323 10.3488 10.3740 10.4982 10.5819 k = 0.1508 0.2612-0.0000 ( 6861 PWs) bands (ev): -64.4515 -64.4515 -37.3782 -37.3782 -28.8178 -28.8178 -28.8087 -28.8084 -16.9317 -16.9304 -16.6496 -16.6256 -14.9579 -14.9485 -14.8134 -14.7913 -14.6998 -14.6466 -14.5378 -14.4904 -10.1459 -10.1459 -10.0498 -10.0497 -5.9363 -5.9340 -5.8341 -5.8335 -5.7071 -5.7051 -5.1919 -5.1140 -3.7549 -3.7540 -3.7050 -3.7044 -3.6128 -3.6122 -3.3763 -3.3731 -2.9562 -2.9452 -2.7369 -2.7204 -2.3834 -2.2475 -1.7609 -1.7555 -0.9825 -0.9677 -0.3546 -0.3477 0.0039 0.0071 0.4611 0.4637 0.7544 0.7680 0.8141 0.8179 1.4544 1.4574 1.6049 1.6051 1.8977 1.9199 2.0291 2.0323 2.3185 2.3202 2.4849 2.4907 4.0200 4.0206 4.0466 4.0574 4.4903 4.5029 4.6332 4.6354 4.7191 4.7253 4.7354 4.7377 5.0501 5.0512 5.3399 5.3513 7.1959 7.3674 7.7069 7.8285 8.0141 8.2730 9.1193 9.1293 10.3637 10.3754 10.4802 10.5690 k = 0.1429 0.2474-0.0000 ( 6865 PWs) bands (ev): -64.4515 -64.4515 -37.3782 -37.3781 -28.8176 -28.8176 -28.8087 -28.8085 -16.9489 -16.9478 -16.6407 -16.6162 -14.9455 -14.9347 -14.8094 -14.7803 -14.7012 -14.6600 -14.5360 -14.4925 -10.1484 -10.1484 -10.0480 -10.0479 -5.9370 -5.9343 -5.8349 -5.8342 -5.7439 -5.7432 -5.1528 -5.0726 -3.7550 -3.7542 -3.7051 -3.7046 -3.6144 -3.6138 -3.3761 -3.3722 -2.9511 -2.9302 -2.7397 -2.7282 -2.4238 -2.2825 -1.7895 -1.7841 -0.9879 -0.9720 -0.3875 -0.3810 -0.0429 -0.0409 0.5068 0.5090 0.8067 0.8130 0.8291 0.8411 1.4649 1.4678 1.6160 1.6165 1.9390 1.9606 2.0470 2.0496 2.3364 2.3381 2.4838 2.4895 4.0410 4.0426 4.0649 4.0755 4.4684 4.4794 4.6256 4.6278 4.7172 4.7235 4.7282 4.7304 5.0255 5.0263 5.3568 5.3674 7.1939 7.3693 7.7144 7.8339 8.0160 8.2781 9.1137 9.1261 10.3579 10.3711 10.4733 10.5537 k = 0.1349 0.2337-0.0000 ( 6855 PWs) bands (ev): -64.4515 -64.4515 -37.3781 -37.3781 -28.8174 -28.8174 -28.8087 -28.8085 -16.9658 -16.9649 -16.6316 -16.6067 -14.9357 -14.9236 -14.8066 -14.7673 -14.6996 -14.6744 -14.5331 -14.4941 -10.1508 -10.1508 -10.0462 -10.0461 -5.9379 -5.9347 -5.8358 -5.8349 -5.7809 -5.7800 -5.1114 -5.0294 -3.7551 -3.7544 -3.7052 -3.7048 -3.6159 -3.6153 -3.3774 -3.3731 -2.9498 -2.9162 -2.7405 -2.7400 -2.4592 -2.3159 -1.8169 -1.8116 -0.9926 -0.9756 -0.4197 -0.4137 -0.0904 -0.0896 0.5499 0.5516 0.8291 0.8319 0.8787 0.8945 1.4752 1.4779 1.6265 1.6272 1.9803 2.0014 2.0637 2.0655 2.3536 2.3553 2.4817 2.4875 4.0584 4.0622 4.0850 4.0941 4.4484 4.4576 4.6182 4.6203 4.7145 4.7195 4.7211 4.7245 5.0012 5.0017 5.3731 5.3829 7.1941 7.3728 7.7217 7.8397 8.0157 8.2814 9.1081 9.1229 10.3295 10.3697 10.4679 10.5349 k = 0.1270 0.2199-0.0000 ( 6857 PWs) bands (ev): -64.4515 -64.4515 -37.3781 -37.3781 -28.8172 -28.8172 -28.8087 -28.8085 -16.9822 -16.9815 -16.6221 -16.5971 -14.9284 -14.9152 -14.8062 -14.7531 -14.6944 -14.6889 -14.5296 -14.4951 -10.1531 -10.1531 -10.0446 -10.0444 -5.9394 -5.9354 -5.8375 -5.8357 -5.8175 -5.8143 -5.0680 -4.9844 -3.7552 -3.7546 -3.7053 -3.7050 -3.6175 -3.6168 -3.3800 -3.3752 -2.9538 -2.9054 -2.7554 -2.7382 -2.4878 -2.3471 -1.8430 -1.8379 -0.9961 -0.9782 -0.4509 -0.4455 -0.1384 -0.1383 0.5908 0.5920 0.8413 0.8448 0.9416 0.9566 1.4852 1.4878 1.6363 1.6372 2.0209 2.0418 2.0793 2.0801 2.3699 2.3718 2.4788 2.4846 4.0706 4.0775 4.1077 4.1146 4.4308 4.4382 4.6110 4.6130 4.7101 4.7124 4.7149 4.7208 4.9773 4.9775 5.3887 5.3976 7.1964 7.3780 7.7286 7.8456 8.0133 8.2828 9.1025 9.1196 10.2976 10.3601 10.4564 10.5120 k = 0.1190 0.2062-0.0000 ( 6849 PWs) bands (ev): -64.4515 -64.4515 -37.3781 -37.3781 -28.8170 -28.8170 -28.8087 -28.8085 -16.9981 -16.9975 -16.6124 -16.5875 -14.9231 -14.9088 -14.8083 -14.7399 -14.7016 -14.6856 -14.5254 -14.4955 -10.1554 -10.1554 -10.0429 -10.0428 -5.9419 -5.9367 -5.8529 -5.8516 -5.8362 -5.8342 -5.0227 -4.9380 -3.7553 -3.7549 -3.7054 -3.7052 -3.6190 -3.6183 -3.3835 -3.3785 -2.9645 -2.9021 -2.7713 -2.7324 -2.5085 -2.3758 -1.8678 -1.8628 -0.9985 -0.9796 -0.4811 -0.4761 -0.1871 -0.1861 0.6299 0.6305 0.8531 0.8571 1.0067 1.0210 1.4948 1.4973 1.6455 1.6466 2.0600 2.0811 2.0938 2.0944 2.3854 2.3874 2.4752 2.4809 4.0780 4.0874 4.1322 4.1376 4.4162 4.4217 4.6040 4.6059 4.7034 4.7043 4.7100 4.7171 4.9542 4.9542 5.4035 5.4117 7.2008 7.3848 7.7351 7.8516 8.0086 8.2819 9.0970 9.1162 10.2657 10.3441 10.4380 10.4861 k = 0.1111 0.1925-0.0000 ( 6859 PWs) bands (ev): -64.4515 -64.4515 -37.3781 -37.3781 -28.8168 -28.8168 -28.8088 -28.8086 -17.0133 -17.0129 -16.6027 -16.5780 -14.9194 -14.9041 -14.8127 -14.7362 -14.7045 -14.6742 -14.5208 -14.4953 -10.1576 -10.1576 -10.0414 -10.0413 -5.9467 -5.9396 -5.8853 -5.8801 -5.8369 -5.8364 -4.9757 -4.8904 -3.7554 -3.7551 -3.7056 -3.7054 -3.6205 -3.6197 -3.3877 -3.3825 -2.9820 -2.9126 -2.7812 -2.7236 -2.5218 -2.4015 -1.8913 -1.8864 -0.9994 -0.9798 -0.5100 -0.5055 -0.2353 -0.2335 0.6671 0.6673 0.8649 0.8690 1.0726 1.0862 1.5041 1.5064 1.6542 1.6554 2.0929 2.1038 2.1132 2.1215 2.4000 2.4021 2.4710 2.4766 4.0811 4.0922 4.1576 4.1621 4.4049 4.4087 4.5973 4.5990 4.6954 4.6956 4.7053 4.7128 4.9319 4.9320 5.4175 5.4249 7.2076 7.3932 7.7410 7.8574 8.0017 8.2788 9.0917 9.1129 10.2355 10.3239 10.4149 10.4588 k = 0.1032 0.1787-0.0000 ( 6849 PWs) bands (ev): -64.4515 -64.4515 -37.3781 -37.3781 -28.8166 -28.8166 -28.8088 -28.8086 -17.0279 -17.0275 -16.5929 -16.5687 -14.9169 -14.9007 -14.8187 -14.7465 -14.6934 -14.6611 -14.5157 -14.4946 -10.1596 -10.1596 -10.0399 -10.0398 -5.9571 -5.9480 -5.9108 -5.9030 -5.8376 -5.8373 -4.9273 -4.8417 -3.7555 -3.7553 -3.7057 -3.7056 -3.6220 -3.6212 -3.3924 -3.3872 -3.0060 -2.9399 -2.7811 -2.7123 -2.5287 -2.4241 -1.9132 -1.9086 -0.9988 -0.9786 -0.5375 -0.5335 -0.2828 -0.2803 0.7025 0.7027 0.8765 0.8806 1.1383 1.1513 1.5128 1.5151 1.6623 1.6636 2.1101 2.1141 2.1446 2.1588 2.4136 2.4158 2.4663 2.4719 4.0801 4.0923 4.1835 4.1876 4.3973 4.3995 4.5909 4.5923 4.6864 4.6866 4.6999 4.7076 4.9108 4.9110 5.4307 5.4372 7.2166 7.4031 7.7465 7.8629 7.9929 8.2733 9.0867 9.1097 10.2077 10.3014 10.3892 10.4313 k = 0.0952 0.1650-0.0000 ( 6857 PWs) bands (ev): -64.4515 -64.4515 -37.3781 -37.3781 -28.8165 -28.8165 -28.8088 -28.8086 -17.0416 -17.0414 -16.5832 -16.5596 -14.9154 -14.8982 -14.8256 -14.7610 -14.6784 -14.6475 -14.5103 -14.4931 -10.1616 -10.1616 -10.0385 -10.0384 -5.9756 -5.9681 -5.9231 -5.9163 -5.8382 -5.8381 -4.8776 -4.7924 -3.7557 -3.7555 -3.7058 -3.7058 -3.6234 -3.6226 -3.3974 -3.3921 -3.0357 -2.9798 -2.7738 -2.6998 -2.5308 -2.4433 -1.9336 -1.9292 -0.9965 -0.9758 -0.5635 -0.5599 -0.3294 -0.3262 0.7359 0.7365 0.8879 0.8919 1.2033 1.2156 1.5211 1.5233 1.6699 1.6712 2.1202 2.1223 2.1799 2.1948 2.4262 2.4285 2.4613 2.4667 4.0753 4.0881 4.2097 4.2136 4.3933 4.3942 4.5847 4.5860 4.6766 4.6773 4.6937 4.7015 4.8911 4.8915 5.4428 5.4487 7.2279 7.4145 7.7512 7.8675 7.9825 8.2653 9.0823 9.1066 10.1828 10.2785 10.3629 10.4042 k = 0.0873 0.1512-0.0000 ( 6865 PWs) bands (ev): -64.4515 -64.4515 -37.3781 -37.3780 -28.8163 -28.8163 -28.8088 -28.8086 -17.0545 -17.0543 -16.5737 -16.5510 -14.9146 -14.8963 -14.8328 -14.7763 -14.6634 -14.6342 -14.5045 -14.4910 -10.1634 -10.1634 -10.0372 -10.0372 -5.9996 -5.9946 -5.9271 -5.9225 -5.8388 -5.8387 -4.8271 -4.7427 -3.7558 -3.7557 -3.7060 -3.7060 -3.6248 -3.6239 -3.4025 -3.3973 -3.0700 -3.0268 -2.7632 -2.6871 -2.5294 -2.4591 -1.9525 -1.9483 -0.9924 -0.9715 -0.5878 -0.5848 -0.3750 -0.3711 0.7676 0.7684 0.8990 0.9027 1.2669 1.2784 1.5289 1.5310 1.6769 1.6782 2.1275 2.1287 2.2143 2.2290 2.4378 2.4399 2.4565 2.4614 4.0674 4.0803 4.2359 4.2397 4.3926 4.3927 4.5789 4.5799 4.6662 4.6673 4.6867 4.6944 4.8730 4.8735 5.4540 5.4592 7.2415 7.4271 7.7552 7.8706 7.9713 8.2547 9.0784 9.1036 10.1612 10.2562 10.3370 10.3777 k = 0.0794 0.1375-0.0000 ( 6859 PWs) bands (ev): -64.4515 -64.4515 -37.3780 -37.3780 -28.8162 -28.8162 -28.8088 -28.8087 -17.0665 -17.0663 -16.5644 -16.5428 -14.9144 -14.8950 -14.8399 -14.7914 -14.6492 -14.6217 -14.4983 -14.4882 -10.1651 -10.1651 -10.0360 -10.0360 -6.0249 -6.0214 -5.9287 -5.9256 -5.8393 -5.8393 -4.7760 -4.6931 -3.7559 -3.7559 -3.7062 -3.7061 -3.6262 -3.6252 -3.4076 -3.4025 -3.1080 -3.0774 -2.7516 -2.6751 -2.5257 -2.4715 -1.9697 -1.9659 -0.9865 -0.9655 -0.6104 -0.6079 -0.4193 -0.4147 0.7973 0.7984 0.9097 0.9130 1.3285 1.3393 1.5361 1.5383 1.6834 1.6846 2.1324 2.1331 2.2468 2.2611 2.4469 2.4478 2.4550 2.4565 4.0571 4.0697 4.2621 4.2659 4.3941 4.3949 4.5734 4.5742 4.6553 4.6566 4.6787 4.6864 4.8567 4.8572 5.4642 5.4687 7.2574 7.4409 7.7584 7.8709 7.9610 8.2417 9.0752 9.1009 10.1430 10.2355 10.3123 10.3520 k = 0.0714 0.1237-0.0000 ( 6859 PWs) bands (ev): -64.4515 -64.4515 -37.3780 -37.3780 -28.8160 -28.8160 -28.8088 -28.8087 -17.0774 -17.0773 -16.5554 -16.5353 -14.9146 -14.8941 -14.8466 -14.8060 -14.6362 -14.6105 -14.4920 -14.4847 -10.1667 -10.1667 -10.0349 -10.0349 -6.0493 -6.0469 -5.9296 -5.9273 -5.8399 -5.8398 -4.7248 -4.6442 -3.7561 -3.7560 -3.7064 -3.7063 -3.6275 -3.6264 -3.4126 -3.4076 -3.1485 -3.1294 -2.7399 -2.6646 -2.5203 -2.4806 -1.9853 -1.9818 -0.9787 -0.9578 -0.6312 -0.6291 -0.4622 -0.4569 0.8248 0.8261 0.9199 0.9228 1.3876 1.3974 1.5429 1.5452 1.6893 1.6905 2.1351 2.1355 2.2771 2.2908 2.4441 2.4494 2.4591 2.4624 4.0452 4.0572 4.2881 4.2918 4.3983 4.3995 4.5681 4.5687 4.6438 4.6454 4.6697 4.6773 4.8422 4.8426 5.4734 5.4773 7.2755 7.4555 7.7607 7.8665 7.9535 8.2262 9.0728 9.0983 10.1282 10.2169 10.2893 10.3271 k = 0.0635 0.1100-0.0000 ( 6867 PWs) bands (ev): -64.4515 -64.4515 -37.3780 -37.3780 -28.8159 -28.8159 -28.8089 -28.8087 -17.0874 -17.0873 -16.5469 -16.5284 -14.9150 -14.8935 -14.8528 -14.8199 -14.6246 -14.6010 -14.4856 -14.4806 -10.1681 -10.1681 -10.0339 -10.0339 -6.0721 -6.0704 -5.9301 -5.9283 -5.8403 -5.8403 -4.6739 -4.5965 -3.7563 -3.7562 -3.7065 -3.7065 -3.6287 -3.6276 -3.4175 -3.4124 -3.1906 -3.1813 -2.7288 -2.6563 -2.5141 -2.4865 -1.9993 -1.9960 -0.9691 -0.9484 -0.6501 -0.6485 -0.5036 -0.4976 0.8498 0.8513 0.9297 0.9320 1.4433 1.4518 1.5495 1.5523 1.6946 1.6958 2.1357 2.1358 2.3049 2.3180 2.4397 2.4446 2.4672 2.4707 4.0326 4.0436 4.3136 4.3175 4.4046 4.4060 4.5630 4.5633 4.6320 4.6337 4.6598 4.6672 4.8295 4.8298 5.4816 5.4849 7.2957 7.4705 7.7621 7.8561 7.9506 8.2086 9.0711 9.0959 10.1168 10.2007 10.2682 10.3031 k = 0.0556 0.0962-0.0000 ( 6849 PWs) bands (ev): -64.4515 -64.4515 -37.3780 -37.3780 -28.8158 -28.8158 -28.8088 -28.8087 -17.0963 -17.0963 -16.5390 -16.5222 -14.9155 -14.8932 -14.8582 -14.8328 -14.6144 -14.5931 -14.4792 -14.4760 -10.1693 -10.1693 -10.0331 -10.0330 -6.0928 -6.0916 -5.9304 -5.9291 -5.8407 -5.8407 -4.6239 -4.5508 -3.7564 -3.7563 -3.7067 -3.7066 -3.6300 -3.6287 -3.4220 -3.4170 -3.2331 -3.2316 -2.7183 -2.6505 -2.5075 -2.4895 -2.0115 -2.0086 -0.9577 -0.9375 -0.6670 -0.6659 -0.5432 -0.5366 0.8720 0.8737 0.9390 0.9408 1.4941 1.5004 1.5570 1.5610 1.6994 1.7005 2.1341 2.1342 2.3301 2.3424 2.4355 2.4398 2.4746 2.4782 4.0200 4.0299 4.3387 4.3426 4.4124 4.4139 4.5579 4.5580 4.6200 4.6218 4.6491 4.6562 4.8185 4.8188 5.4887 5.4916 7.3178 7.4852 7.7624 7.8405 7.9525 8.1890 9.0702 9.0937 10.1088 10.1870 10.2493 10.2801 k = 0.0476 0.0825-0.0000 ( 6855 PWs) bands (ev): -64.4515 -64.4515 -37.3780 -37.3780 -28.8157 -28.8157 -28.8088 -28.8087 -17.1041 -17.1041 -16.5317 -16.5169 -14.9159 -14.8933 -14.8629 -14.8445 -14.6057 -14.5870 -14.4731 -14.4712 -10.1705 -10.1705 -10.0323 -10.0322 -6.1111 -6.1103 -5.9306 -5.9296 -5.8411 -5.8411 -4.5757 -4.5080 -3.7565 -3.7564 -3.7068 -3.7068 -3.6312 -3.6298 -3.4263 -3.4212 -3.2790 -3.2748 -2.7086 -2.6472 -2.5010 -2.4901 -2.0220 -2.0195 -0.9445 -0.9250 -0.6819 -0.6813 -0.5807 -0.5736 0.8911 0.8929 0.9479 0.9492 1.5337 1.5357 1.5709 1.5782 1.7036 1.7046 2.1305 2.1306 2.3523 2.3638 2.4320 2.4354 2.4811 2.4847 4.0080 4.0167 4.3630 4.3669 4.4214 4.4228 4.5525 4.5526 4.6083 4.6102 4.6375 4.6443 4.8093 4.8095 5.4949 5.4973 7.3416 7.4990 7.7617 7.8215 7.9580 8.1679 9.0700 9.0917 10.1040 10.1758 10.2327 10.2582 k = 0.0397 0.0687-0.0000 ( 6875 PWs) bands (ev): -64.4515 -64.4515 -37.3780 -37.3780 -28.8156 -28.8156 -28.8089 -28.8088 -17.1107 -17.1107 -16.5251 -16.5125 -14.9161 -14.8938 -14.8668 -14.8548 -14.5983 -14.5824 -14.4675 -14.4665 -10.1714 -10.1714 -10.0316 -10.0316 -6.1269 -6.1263 -5.9308 -5.9300 -5.8414 -5.8414 -4.5301 -4.4694 -3.7567 -3.7565 -3.7070 -3.7069 -3.6323 -3.6309 -3.4305 -3.4250 -3.3219 -3.3145 -2.6995 -2.6463 -2.4950 -2.4890 -2.0309 -2.0288 -0.9297 -0.9113 -0.6946 -0.6946 -0.6159 -0.6085 0.9068 0.9087 0.9565 0.9572 1.5508 1.5509 1.6018 1.6102 1.7071 1.7081 2.1252 2.1255 2.3713 2.3819 2.4292 2.4317 2.4866 2.4900 3.9971 4.0044 4.3864 4.3902 4.4312 4.4325 4.5466 4.5468 4.5975 4.5993 4.6255 4.6318 4.8016 4.8018 5.5001 5.5020 7.3669 7.5107 7.7600 7.8014 7.9662 8.1457 9.0706 9.0896 10.1023 10.1667 10.2183 10.2378 k = 0.0317 0.0550-0.0000 ( 6885 PWs) bands (ev): -64.4515 -64.4515 -37.3780 -37.3780 -28.8156 -28.8156 -28.8089 -28.8088 -17.1162 -17.1162 -16.5194 -16.5091 -14.9158 -14.8950 -14.8700 -14.8633 -14.5922 -14.5793 -14.4626 -14.4621 -10.1722 -10.1722 -10.0311 -10.0310 -6.1400 -6.1396 -5.9309 -5.9303 -5.8417 -5.8417 -4.4883 -4.4363 -3.7567 -3.7566 -3.7071 -3.7071 -3.6334 -3.6320 -3.4346 -3.4286 -3.3587 -3.3505 -2.6912 -2.6473 -2.4898 -2.4869 -2.0381 -2.0363 -0.9138 -0.8966 -0.7059 -0.7051 -0.6481 -0.6408 0.9191 0.9209 0.9645 0.9649 1.5570 1.5571 1.6374 1.6447 1.7101 1.7110 2.1190 2.1193 2.3870 2.3966 2.4274 2.4287 2.4912 2.4943 3.9878 3.9937 4.4085 4.4120 4.4415 4.4425 4.5399 4.5400 4.5882 4.5897 4.6132 4.6189 4.7955 4.7957 5.5043 5.5058 7.3930 7.5189 7.7574 7.7823 7.9766 8.1230 9.0716 9.0877 10.1033 10.1593 10.2062 10.2193 k = 0.0238 0.0412-0.0000 ( 6895 PWs) bands (ev): -64.4516 -64.4516 -37.3780 -37.3780 -28.8155 -28.8155 -28.8089 -28.8088 -17.1205 -17.1205 -16.5145 -16.5066 -14.9149 -14.8972 -14.8725 -14.8695 -14.5872 -14.5774 -14.4586 -14.4584 -10.1728 -10.1728 -10.0306 -10.0306 -6.1502 -6.1500 -5.9309 -5.9305 -5.8419 -5.8419 -4.4515 -4.4101 -3.7568 -3.7567 -3.7072 -3.7072 -3.6343 -3.6330 -3.4391 -3.4322 -3.3872 -3.3810 -2.6834 -2.6498 -2.4856 -2.4844 -2.0436 -2.0423 -0.8971 -0.8820 -0.7152 -0.7134 -0.6763 -0.6698 0.9281 0.9296 0.9715 0.9717 1.5604 1.5604 1.6686 1.6744 1.7126 1.7135 2.1124 2.1128 2.3990 2.4074 2.4266 2.4269 2.4948 2.4974 3.9803 3.9848 4.4287 4.4319 4.4518 4.4525 4.5320 4.5320 4.5809 4.5820 4.6014 4.6063 4.7908 4.7909 5.5076 5.5087 7.4195 7.5221 7.7541 7.7661 7.9889 8.1004 9.0732 9.0856 10.1070 10.1528 10.1964 10.2035 k = 0.0159 0.0275-0.0000 ( 6895 PWs) bands (ev): -64.4515 -64.4515 -37.3780 -37.3780 -28.8155 -28.8155 -28.8089 -28.8088 -17.1235 -17.1235 -16.5106 -16.5053 -14.9133 -14.9004 -14.8743 -14.8734 -14.5832 -14.5766 -14.4556 -14.4555 -10.1732 -10.1732 -10.0303 -10.0303 -6.1576 -6.1575 -5.9309 -5.9306 -5.8421 -5.8421 -4.4213 -4.3924 -3.7568 -3.7568 -3.7073 -3.7073 -3.6350 -3.6340 -3.4442 -3.4368 -3.4061 -3.4033 -2.6763 -2.6536 -2.4825 -2.4822 -2.0474 -2.0465 -0.8809 -0.8689 -0.7230 -0.7198 -0.6984 -0.6942 0.9343 0.9353 0.9771 0.9771 1.5625 1.5625 1.6923 1.6965 1.7148 1.7156 2.1066 2.1070 2.4072 2.4134 2.4269 2.4271 2.4976 2.4995 3.9750 3.9780 4.4461 4.4486 4.4615 4.4620 4.5231 4.5232 4.5760 4.5766 4.5912 4.5948 4.7875 4.7876 5.5100 5.5107 7.4456 7.5187 7.7505 7.7545 8.0032 8.0782 9.0750 9.0835 10.1129 10.1462 10.1890 10.1915 k = 0.0079 0.0137-0.0000 ( 6889 PWs) bands (ev): -64.4515 -64.4515 -37.3780 -37.3780 -28.8154 -28.8154 -28.8089 -28.8088 -17.1254 -17.1254 -16.5077 -16.5050 -14.9109 -14.9041 -14.8755 -14.8753 -14.5802 -14.5769 -14.4538 -14.4538 -10.1735 -10.1735 -10.0301 -10.0301 -6.1621 -6.1620 -5.9309 -5.9308 -5.8422 -5.8422 -4.3993 -4.3844 -3.7569 -3.7568 -3.7074 -3.7074 -3.6354 -3.6348 -3.4483 -3.4431 -3.4156 -3.4152 -2.6697 -2.6582 -2.4806 -2.4806 -2.0496 -2.0492 -0.8672 -0.8601 -0.7291 -0.7253 -0.7115 -0.7106 0.9379 0.9384 0.9806 0.9806 1.5637 1.5637 1.7064 1.7085 1.7177 1.7181 2.1026 2.1028 2.4119 2.4150 2.4283 2.4284 2.4995 2.5005 3.9721 3.9736 4.4587 4.4600 4.4700 4.4701 4.5147 4.5149 4.5733 4.5734 4.5842 4.5861 4.7856 4.7856 5.5115 5.5119 7.4701 7.5083 7.7475 7.7481 8.0194 8.0571 9.0771 9.0814 10.1207 10.1384 10.1841 10.1845 k = 0.0000 0.0000 0.0000 ( 6869 PWs) bands (ev): -64.4515 -64.4515 -37.3780 -37.3780 -28.8154 -28.8154 -28.8088 -28.8088 -17.1260 -17.1260 -16.5058 -16.5058 -14.9077 -14.9077 -14.8759 -14.8759 -14.5781 -14.5781 -14.4532 -14.4532 -10.1736 -10.1736 -10.0301 -10.0301 -6.1635 -6.1635 -5.9309 -5.9309 -5.8422 -5.8422 -4.3867 -4.3867 -3.7568 -3.7568 -3.7074 -3.7074 -3.6353 -3.6353 -3.4481 -3.4481 -3.4183 -3.4183 -2.6636 -2.6636 -2.4800 -2.4800 -2.0502 -2.0502 -0.8593 -0.8593 -0.7302 -0.7302 -0.7156 -0.7156 0.9392 0.9392 0.9818 0.9818 1.5641 1.5641 1.7107 1.7107 1.7200 1.7200 2.1012 2.1012 2.4142 2.4142 2.4290 2.4290 2.5005 2.5005 3.9716 3.9716 4.4636 4.4636 4.4741 4.4741 4.5108 4.5108 4.5724 4.5724 4.5822 4.5822 4.7850 4.7850 5.5121 5.5121 7.4916 7.4916 7.7462 7.7462 8.0374 8.0374 9.0792 9.0792 10.1295 10.1295 10.1823 10.1823 k = 0.0000 0.0000 0.0000 ( 6869 PWs) bands (ev): -64.4515 -64.4515 -37.3780 -37.3780 -28.8154 -28.8154 -28.8088 -28.8088 -17.1260 -17.1260 -16.5058 -16.5058 -14.9077 -14.9077 -14.8759 -14.8759 -14.5781 -14.5781 -14.4532 -14.4532 -10.1736 -10.1736 -10.0301 -10.0301 -6.1635 -6.1635 -5.9309 -5.9309 -5.8422 -5.8422 -4.3867 -4.3867 -3.7568 -3.7568 -3.7074 -3.7074 -3.6353 -3.6353 -3.4481 -3.4481 -3.4183 -3.4183 -2.6636 -2.6636 -2.4800 -2.4800 -2.0502 -2.0502 -0.8593 -0.8593 -0.7302 -0.7302 -0.7156 -0.7156 0.9392 0.9392 0.9818 0.9818 1.5641 1.5641 1.7107 1.7107 1.7200 1.7200 2.1012 2.1012 2.4142 2.4142 2.4290 2.4290 2.5005 2.5005 3.9716 3.9716 4.4636 4.4636 4.4741 4.4741 4.5108 4.5108 4.5724 4.5724 4.5822 4.5822 4.7850 4.7850 5.5121 5.5121 7.4916 7.4916 7.7462 7.7462 8.0374 8.0374 9.0792 9.0792 10.1295 10.1295 10.1823 10.1823 k = 0.0000 0.0000 0.0156 ( 6899 PWs) bands (ev): -64.4516 -64.4516 -37.3780 -37.3780 -28.8154 -28.8154 -28.8089 -28.8089 -17.1260 -17.1260 -16.5058 -16.5058 -14.9077 -14.9077 -14.8759 -14.8759 -14.5781 -14.5781 -14.4532 -14.4532 -10.1736 -10.1736 -10.0301 -10.0301 -6.1635 -6.1635 -5.9309 -5.9309 -5.8422 -5.8422 -4.3868 -4.3867 -3.7569 -3.7566 -3.7076 -3.7072 -3.6358 -3.6348 -3.4488 -3.4475 -3.4185 -3.4182 -2.6639 -2.6633 -2.4803 -2.4798 -2.0501 -2.0501 -0.8598 -0.8597 -0.7306 -0.7298 -0.7160 -0.7152 0.9386 0.9399 0.9812 0.9825 1.5649 1.5650 1.7103 1.7113 1.7195 1.7206 2.1011 2.1011 2.4138 2.4145 2.4286 2.4294 2.5011 2.5011 3.9666 3.9667 4.4627 4.4645 4.4729 4.4752 4.5093 4.5121 4.5708 4.5740 4.5865 4.5865 4.7853 4.7853 5.5116 5.5116 7.4912 7.4916 7.7461 7.7463 8.0372 8.0376 9.0786 9.0802 10.1256 10.1349 10.1728 10.1941 k = 0.0000 0.0000 0.0312 ( 6887 PWs) bands (ev): -64.4515 -64.4515 -37.3780 -37.3780 -28.8155 -28.8154 -28.8088 -28.8088 -17.1260 -17.1260 -16.5058 -16.5058 -14.9077 -14.9077 -14.8759 -14.8759 -14.5781 -14.5781 -14.4532 -14.4532 -10.1736 -10.1736 -10.0301 -10.0301 -6.1635 -6.1635 -5.9310 -5.9309 -5.8422 -5.8422 -4.3869 -4.3867 -3.7568 -3.7562 -3.7078 -3.7070 -3.6362 -3.6342 -3.4495 -3.4470 -3.4186 -3.4181 -2.6643 -2.6630 -2.4806 -2.4796 -2.0499 -2.0499 -0.8611 -0.8611 -0.7310 -0.7294 -0.7163 -0.7148 0.9379 0.9406 0.9806 0.9831 1.5675 1.5676 1.7099 1.7119 1.7192 1.7213 2.1008 2.1008 2.4135 2.4147 2.4281 2.4298 2.5029 2.5030 3.9522 3.9524 4.4619 4.4654 4.4717 4.4761 4.5078 4.5132 4.5693 4.5755 4.5989 4.5990 4.7863 4.7863 5.5100 5.5100 7.4903 7.4911 7.7461 7.7464 8.0370 8.0377 9.0785 9.0816 10.1231 10.1418 10.1657 10.2080 k = 0.0000 0.0000 0.0467 ( 6875 PWs) bands (ev): -64.4515 -64.4515 -37.3780 -37.3780 -28.8154 -28.8154 -28.8088 -28.8088 -17.1260 -17.1260 -16.5058 -16.5058 -14.9077 -14.9077 -14.8759 -14.8759 -14.5781 -14.5781 -14.4532 -14.4532 -10.1735 -10.1735 -10.0301 -10.0301 -6.1635 -6.1635 -5.9311 -5.9310 -5.8422 -5.8421 -4.3870 -4.3868 -3.7565 -3.7557 -3.7080 -3.7069 -3.6365 -3.6336 -3.4502 -3.4466 -3.4187 -3.4180 -2.6645 -2.6628 -2.4809 -2.4794 -2.0495 -2.0495 -0.8634 -0.8633 -0.7313 -0.7290 -0.7166 -0.7144 0.9373 0.9412 0.9800 0.9837 1.5718 1.5718 1.7097 1.7126 1.7189 1.7221 2.1002 2.1002 2.4130 2.4149 2.4275 2.4300 2.5060 2.5062 3.9298 3.9300 4.4610 4.4664 4.4704 4.4769 4.5061 4.5141 4.5678 4.5769 4.6181 4.6182 4.7881 4.7881 5.5073 5.5073 7.4890 7.4901 7.7461 7.7465 8.0367 8.0378 9.0787 9.0833 10.1221 10.1502 10.1608 10.2241 k = 0.0000 0.0000 0.0623 ( 6869 PWs) bands (ev): -64.4515 -64.4515 -37.3780 -37.3780 -28.8154 -28.8154 -28.8088 -28.8088 -17.1259 -17.1259 -16.5058 -16.5058 -14.9077 -14.9077 -14.8759 -14.8759 -14.5781 -14.5781 -14.4532 -14.4532 -10.1734 -10.1734 -10.0302 -10.0302 -6.1634 -6.1634 -5.9313 -5.9311 -5.8422 -5.8421 -4.3872 -4.3870 -3.7561 -3.7551 -3.7081 -3.7067 -3.6368 -3.6330 -3.4509 -3.4463 -3.4188 -3.4179 -2.6648 -2.6625 -2.4812 -2.4793 -2.0490 -2.0490 -0.8665 -0.8664 -0.7317 -0.7287 -0.7169 -0.7140 0.9367 0.9417 0.9794 0.9842 1.5775 1.5776 1.7097 1.7134 1.7188 1.7229 2.0995 2.0995 2.4126 2.4150 2.4270 2.4302 2.5103 2.5105 3.9009 3.9012 4.4603 4.4674 4.4692 4.4775 4.5044 4.5149 4.5665 4.5782 4.6422 4.6423 4.7909 4.7910 5.5036 5.5036 7.4872 7.4887 7.7460 7.7466 8.0365 8.0378 9.0794 9.0853 10.1225 10.1582 10.1601 10.2422 k = 0.0000 0.0000 0.0779 ( 6881 PWs) bands (ev): -64.4515 -64.4515 -37.3780 -37.3780 -28.8155 -28.8155 -28.8088 -28.8088 -17.1259 -17.1259 -16.5059 -16.5059 -14.9077 -14.9077 -14.8759 -14.8759 -14.5781 -14.5781 -14.4532 -14.4532 -10.1733 -10.1733 -10.0302 -10.0302 -6.1634 -6.1634 -5.9315 -5.9312 -5.8422 -5.8421 -4.3875 -4.3872 -3.7556 -3.7543 -3.7082 -3.7065 -3.6369 -3.6324 -3.4516 -3.4460 -3.4189 -3.4178 -2.6651 -2.6623 -2.4815 -2.4792 -2.0484 -2.0484 -0.8702 -0.8701 -0.7319 -0.7283 -0.7171 -0.7136 0.9362 0.9422 0.9789 0.9846 1.5847 1.5848 1.7097 1.7142 1.7188 1.7237 2.0986 2.0986 2.4121 2.4151 2.4264 2.4302 2.5157 2.5160 3.8672 3.8676 4.4596 4.4679 4.4683 4.4779 4.5027 4.5154 4.5653 4.5793 4.6690 4.6692 4.7951 4.7952 5.4989 5.4989 7.4851 7.4869 7.7460 7.7467 8.0362 8.0377 9.0804 9.0875 10.1242 10.1579 10.1717 10.2623 k = 0.0000 0.0000 0.0935 ( 6863 PWs) bands (ev): -64.4515 -64.4515 -37.3780 -37.3780 -28.8154 -28.8154 -28.8088 -28.8088 -17.1259 -17.1259 -16.5059 -16.5059 -14.9077 -14.9077 -14.8759 -14.8759 -14.5781 -14.5781 -14.4532 -14.4532 -10.1732 -10.1732 -10.0303 -10.0303 -6.1633 -6.1633 -5.9317 -5.9314 -5.8422 -5.8421 -4.3877 -4.3874 -3.7549 -3.7534 -3.7083 -3.7064 -3.6370 -3.6319 -3.4523 -3.4459 -3.4190 -3.4178 -2.6653 -2.6621 -2.4817 -2.4791 -2.0477 -2.0477 -0.8746 -0.8745 -0.7321 -0.7280 -0.7173 -0.7133 0.9358 0.9426 0.9785 0.9850 1.5931 1.5932 1.7099 1.7150 1.7189 1.7245 2.0975 2.0976 2.4117 2.4150 2.4258 2.4302 2.5222 2.5225 3.8304 3.8308 4.4589 4.4668 4.4692 4.4780 4.5009 4.5157 4.5644 4.5802 4.6964 4.6966 4.8017 4.8018 5.4933 5.4933 7.4827 7.4847 7.7461 7.7468 8.0360 8.0377 9.0818 9.0899 10.1274 10.1600 10.1848 10.2841 k = 0.0000 0.0000 0.1091 ( 6857 PWs) bands (ev): -64.4515 -64.4515 -37.3780 -37.3780 -28.8154 -28.8154 -28.8088 -28.8088 -17.1259 -17.1259 -16.5060 -16.5060 -14.9077 -14.9077 -14.8759 -14.8759 -14.5781 -14.5781 -14.4532 -14.4532 -10.1731 -10.1731 -10.0303 -10.0303 -6.1632 -6.1632 -5.9319 -5.9316 -5.8422 -5.8421 -4.3880 -4.3876 -3.7541 -3.7525 -3.7084 -3.7062 -3.6370 -3.6313 -3.4529 -3.4459 -3.4190 -3.4177 -2.6654 -2.6620 -2.4820 -2.4791 -2.0469 -2.0469 -0.8795 -0.8794 -0.7323 -0.7278 -0.7173 -0.7130 0.9354 0.9429 0.9782 0.9853 1.6025 1.6026 1.7102 1.7158 1.7192 1.7253 2.0963 2.0964 2.4112 2.4149 2.4253 2.4301 2.5297 2.5301 3.7916 3.7920 4.4584 4.4657 4.4700 4.4779 4.4993 4.5158 4.5637 4.5809 4.7216 4.7218 4.8120 4.8121 5.4867 5.4867 7.4801 7.4822 7.7461 7.7469 8.0357 8.0376 9.0834 9.0924 10.1319 10.1644 10.1995 10.3076 k = 0.0000 0.0000 0.1247 ( 6839 PWs) bands (ev): -64.4515 -64.4515 -37.3780 -37.3780 -28.8154 -28.8154 -28.8088 -28.8088 -17.1258 -17.1258 -16.5060 -16.5060 -14.9077 -14.9077 -14.8759 -14.8759 -14.5781 -14.5781 -14.4532 -14.4532 -10.1729 -10.1729 -10.0304 -10.0304 -6.1631 -6.1631 -5.9321 -5.9319 -5.8422 -5.8421 -4.3883 -4.3879 -3.7532 -3.7515 -3.7084 -3.7061 -3.6368 -3.6309 -3.4534 -3.4460 -3.4191 -3.4177 -2.6655 -2.6619 -2.4822 -2.4792 -2.0460 -2.0460 -0.8848 -0.8846 -0.7324 -0.7276 -0.7174 -0.7127 0.9352 0.9431 0.9780 0.9855 1.6127 1.6128 1.7106 1.7166 1.7196 1.7261 2.0951 2.0951 2.4107 2.4147 2.4248 2.4299 2.5381 2.5384 3.7519 3.7523 4.4580 4.4647 4.4707 4.4776 4.4978 4.5157 4.5633 4.5815 4.7418 4.7420 4.8280 4.8281 5.4793 5.4793 7.4773 7.4796 7.7462 7.7470 8.0355 8.0374 9.0853 9.0948 10.1378 10.1711 10.2159 10.3323 k = 0.0000 0.0000 0.1402 ( 6815 PWs) bands (ev): -64.4515 -64.4515 -37.3779 -37.3779 -28.8154 -28.8154 -28.8088 -28.8088 -17.1258 -17.1258 -16.5060 -16.5060 -14.9077 -14.9077 -14.8759 -14.8758 -14.5781 -14.5781 -14.4532 -14.4532 -10.1728 -10.1728 -10.0305 -10.0305 -6.1631 -6.1631 -5.9324 -5.9321 -5.8422 -5.8421 -4.3886 -4.3882 -3.7523 -3.7506 -3.7084 -3.7061 -3.6366 -3.6305 -3.4539 -3.4462 -3.4191 -3.4177 -2.6656 -2.6619 -2.4824 -2.4793 -2.0451 -2.0450 -0.8902 -0.8901 -0.7324 -0.7275 -0.7173 -0.7126 0.9351 0.9433 0.9778 0.9856 1.6234 1.6235 1.7112 1.7173 1.7201 1.7268 2.0937 2.0937 2.4103 2.4144 2.4243 2.4296 2.5471 2.5475 3.7122 3.7126 4.4577 4.4638 4.4712 4.4770 4.4965 4.5154 4.5631 4.5817 4.7558 4.7559 4.8501 4.8502 5.4713 5.4713 7.4744 7.4767 7.7463 7.7472 8.0354 8.0373 9.0874 9.0972 10.1452 10.1800 10.2338 10.3578 k = 0.0000 0.0000 0.1558 ( 6839 PWs) bands (ev): -64.4515 -64.4515 -37.3780 -37.3780 -28.8154 -28.8154 -28.8088 -28.8088 -17.1257 -17.1257 -16.5061 -16.5061 -14.9077 -14.9077 -14.8759 -14.8758 -14.5781 -14.5781 -14.4532 -14.4532 -10.1727 -10.1727 -10.0306 -10.0306 -6.1630 -6.1630 -5.9326 -5.9324 -5.8422 -5.8421 -4.3890 -4.3885 -3.7513 -3.7496 -3.7083 -3.7060 -3.6363 -3.6302 -3.4542 -3.4466 -3.4191 -3.4177 -2.6656 -2.6619 -2.4825 -2.4794 -2.0441 -2.0441 -0.8957 -0.8956 -0.7324 -0.7275 -0.7172 -0.7124 0.9351 0.9432 0.9778 0.9855 1.6343 1.6344 1.7118 1.7180 1.7207 1.7274 2.0923 2.0923 2.4099 2.4140 2.4239 2.4293 2.5567 2.5570 3.6733 3.6737 4.4575 4.4631 4.4714 4.4762 4.4955 4.5148 4.5633 4.5818 4.7648 4.7650 4.8762 4.8763 5.4626 5.4626 7.4715 7.4738 7.7463 7.7472 8.0352 8.0371 9.0896 9.0994 10.1539 10.1911 10.2532 10.3833 k = 0.0000 0.0000 0.1714 ( 6839 PWs) bands (ev): -64.4515 -64.4515 -37.3780 -37.3780 -28.8154 -28.8154 -28.8088 -28.8088 -17.1257 -17.1257 -16.5061 -16.5061 -14.9077 -14.9077 -14.8758 -14.8758 -14.5781 -14.5781 -14.4532 -14.4532 -10.1725 -10.1725 -10.0306 -10.0306 -6.1629 -6.1629 -5.9329 -5.9326 -5.8422 -5.8421 -4.3893 -4.3889 -3.7503 -3.7486 -3.7083 -3.7060 -3.6360 -3.6299 -3.4545 -3.4470 -3.4191 -3.4177 -2.6656 -2.6620 -2.4826 -2.4796 -2.0432 -2.0432 -0.9012 -0.9010 -0.7322 -0.7275 -0.7170 -0.7124 0.9352 0.9431 0.9779 0.9854 1.6451 1.6452 1.7125 1.7185 1.7214 1.7280 2.0909 2.0909 2.4096 2.4136 2.4236 2.4288 2.5666 2.5669 3.6359 3.6363 4.4574 4.4625 4.4713 4.4752 4.4950 4.5141 4.5637 4.5816 4.7709 4.7711 4.9039 4.9039 5.4534 5.4535 7.4687 7.4709 7.7464 7.7473 8.0351 8.0369 9.0918 9.1014 10.1641 10.2044 10.2740 10.4079 k = 0.0000 0.0000 0.1870 ( 6839 PWs) bands (ev): -64.4515 -64.4515 -37.3780 -37.3780 -28.8154 -28.8154 -28.8088 -28.8088 -17.1257 -17.1257 -16.5062 -16.5062 -14.9077 -14.9077 -14.8758 -14.8758 -14.5781 -14.5781 -14.4532 -14.4532 -10.1724 -10.1724 -10.0307 -10.0307 -6.1628 -6.1628 -5.9331 -5.9329 -5.8422 -5.8421 -4.3895 -4.3892 -3.7493 -3.7478 -3.7082 -3.7060 -3.6355 -3.6298 -3.4546 -3.4475 -3.4191 -3.4178 -2.6655 -2.6621 -2.4827 -2.4798 -2.0423 -2.0423 -0.9063 -0.9062 -0.7321 -0.7276 -0.7168 -0.7124 0.9354 0.9429 0.9781 0.9852 1.6555 1.6557 1.7132 1.7190 1.7221 1.7284 2.0895 2.0896 2.4093 2.4131 2.4234 2.4283 2.5765 2.5768 3.6008 3.6012 4.4575 4.4622 4.4709 4.4740 4.4949 4.5131 4.5644 4.5812 4.7753 4.7754 4.9313 4.9313 5.4441 5.4441 7.4660 7.4681 7.7465 7.7473 8.0350 8.0367 9.0941 9.1032 10.1758 10.2198 10.2957 10.4298 k = 0.0000 0.0000 0.2026 ( 6827 PWs) bands (ev): -64.4515 -64.4515 -37.3780 -37.3780 -28.8154 -28.8154 -28.8088 -28.8088 -17.1256 -17.1256 -16.5062 -16.5062 -14.9077 -14.9077 -14.8758 -14.8758 -14.5781 -14.5781 -14.4532 -14.4532 -10.1723 -10.1723 -10.0308 -10.0308 -6.1628 -6.1628 -5.9333 -5.9331 -5.8422 -5.8421 -4.3898 -4.3895 -3.7484 -3.7470 -3.7081 -3.7061 -3.6350 -3.6298 -3.4546 -3.4481 -3.4190 -3.4178 -2.6654 -2.6623 -2.4827 -2.4801 -2.0415 -2.0414 -0.9111 -0.9110 -0.7318 -0.7277 -0.7165 -0.7125 0.9357 0.9425 0.9784 0.9848 1.6653 1.6655 1.7140 1.7193 1.7229 1.7286 2.0882 2.0883 2.4091 2.4126 2.4233 2.4278 2.5862 2.5865 3.5686 3.5689 4.4578 4.4620 4.4701 4.4727 4.4952 4.5120 4.5653 4.5806 4.7786 4.7787 4.9573 4.9573 5.4347 5.4348 7.4636 7.4655 7.7466 7.7474 8.0350 8.0365 9.0963 9.1046 10.1891 10.2372 10.3176 10.4464 k = 0.0000 0.0000 0.2181 ( 6845 PWs) bands (ev): -64.4515 -64.4515 -37.3780 -37.3780 -28.8154 -28.8154 -28.8088 -28.8088 -17.1256 -17.1256 -16.5063 -16.5063 -14.9077 -14.9077 -14.8758 -14.8758 -14.5781 -14.5781 -14.4532 -14.4532 -10.1721 -10.1721 -10.0308 -10.0308 -6.1627 -6.1627 -5.9335 -5.9333 -5.8422 -5.8421 -4.3900 -4.3897 -3.7475 -3.7463 -3.7079 -3.7062 -3.6345 -3.6299 -3.4545 -3.4488 -3.4190 -3.4179 -2.6653 -2.6625 -2.4826 -2.4804 -2.0407 -2.0407 -0.9154 -0.9154 -0.7315 -0.7279 -0.7162 -0.7127 0.9361 0.9421 0.9787 0.9844 1.6742 1.6743 1.7148 1.7195 1.7237 1.7288 2.0870 2.0871 2.4090 2.4121 2.4233 2.4272 2.5953 2.5956 3.5399 3.5402 4.4582 4.4620 4.4691 4.4714 4.4959 4.5107 4.5664 4.5798 4.7812 4.7812 4.9810 4.9810 5.4257 5.4257 7.4614 7.4630 7.7467 7.7474 8.0350 8.0362 9.0984 9.1057 10.2038 10.2565 10.3378 10.4559 k = 0.0000 0.0000 0.2337 ( 6845 PWs) bands (ev): -64.4515 -64.4515 -37.3780 -37.3780 -28.8154 -28.8154 -28.8088 -28.8088 -17.1256 -17.1256 -16.5063 -16.5063 -14.9077 -14.9077 -14.8758 -14.8758 -14.5781 -14.5781 -14.4532 -14.4532 -10.1720 -10.1720 -10.0309 -10.0309 -6.1626 -6.1626 -5.9337 -5.9335 -5.8422 -5.8421 -4.3902 -4.3900 -3.7468 -3.7457 -3.7077 -3.7063 -3.6339 -3.6300 -3.4542 -3.4495 -3.4189 -3.4180 -2.6650 -2.6628 -2.4825 -2.4806 -2.0400 -2.0400 -0.9191 -0.9191 -0.7312 -0.7282 -0.7158 -0.7129 0.9366 0.9416 0.9792 0.9839 1.6818 1.6819 1.7156 1.7196 1.7246 1.7288 2.0860 2.0860 2.4090 2.4115 2.4233 2.4267 2.6035 2.6037 3.5154 3.5156 4.4588 4.4622 4.4679 4.4700 4.4969 4.5093 4.5677 4.5788 4.7832 4.7832 5.0017 5.0017 5.4173 5.4173 7.4596 7.4610 7.7468 7.7474 8.0350 8.0361 9.1003 9.1065 10.2201 10.2776 10.3517 10.4531 k = 0.0000 0.0000 0.2493 ( 6839 PWs) bands (ev): -64.4515 -64.4515 -37.3780 -37.3780 -28.8154 -28.8154 -28.8088 -28.8088 -17.1256 -17.1256 -16.5063 -16.5063 -14.9077 -14.9077 -14.8758 -14.8758 -14.5781 -14.5781 -14.4532 -14.4532 -10.1720 -10.1720 -10.0309 -10.0309 -6.1626 -6.1626 -5.9338 -5.9336 -5.8422 -5.8421 -4.3903 -4.3902 -3.7461 -3.7453 -3.7076 -3.7064 -3.6333 -3.6303 -3.4539 -3.4502 -3.4188 -3.4181 -2.6648 -2.6630 -2.4824 -2.4809 -2.0395 -2.0395 -0.9221 -0.9220 -0.7308 -0.7285 -0.7154 -0.7132 0.9372 0.9411 0.9797 0.9834 1.6880 1.6881 1.7164 1.7195 1.7254 1.7286 2.0852 2.0852 2.4090 2.4110 2.4235 2.4261 2.6104 2.6105 3.4956 3.4958 4.4595 4.4626 4.4666 4.4686 4.4982 4.5078 4.5691 4.5776 4.7847 4.7847 5.0187 5.0187 5.4101 5.4101 7.4582 7.4593 7.7469 7.7474 8.0351 8.0359 9.1021 9.1069 10.2378 10.3003 10.3523 10.4410 k = 0.0000 0.0000 0.2649 ( 6845 PWs) bands (ev): -64.4515 -64.4515 -37.3780 -37.3780 -28.8154 -28.8154 -28.8088 -28.8088 -17.1256 -17.1256 -16.5063 -16.5063 -14.9077 -14.9077 -14.8758 -14.8758 -14.5781 -14.5781 -14.4532 -14.4532 -10.1719 -10.1719 -10.0309 -10.0309 -6.1626 -6.1626 -5.9339 -5.9338 -5.8422 -5.8421 -4.3904 -4.3903 -3.7456 -3.7450 -3.7074 -3.7066 -3.6327 -3.6307 -3.4534 -3.4509 -3.4187 -3.4182 -2.6645 -2.6633 -2.4822 -2.4812 -2.0391 -2.0391 -0.9243 -0.9242 -0.7304 -0.7288 -0.7150 -0.7135 0.9378 0.9404 0.9803 0.9828 1.6926 1.6926 1.7172 1.7193 1.7261 1.7283 2.0845 2.0845 2.4092 2.4105 2.4238 2.4255 2.6156 2.6157 3.4810 3.4812 4.4605 4.4632 4.4653 4.4673 4.4997 4.5062 4.5705 4.5764 4.7858 4.7858 5.0314 5.0314 5.4045 5.4045 7.4573 7.4580 7.7470 7.7473 8.0352 8.0357 9.1037 9.1069 10.2570 10.3243 10.3396 10.4223 k = 0.0000 0.0000 0.2805 ( 6845 PWs) bands (ev): -64.4515 -64.4515 -37.3780 -37.3780 -28.8154 -28.8154 -28.8088 -28.8088 -17.1255 -17.1255 -16.5064 -16.5064 -14.9077 -14.9077 -14.8758 -14.8758 -14.5781 -14.5781 -14.4532 -14.4532 -10.1719 -10.1719 -10.0310 -10.0310 -6.1626 -6.1625 -5.9339 -5.9339 -5.8421 -5.8421 -4.3905 -4.3904 -3.7452 -3.7449 -3.7072 -3.7068 -3.6321 -3.6311 -3.4529 -3.4516 -3.4186 -3.4183 -2.6642 -2.6636 -2.4820 -2.4815 -2.0389 -2.0388 -0.9256 -0.9256 -0.7300 -0.7292 -0.7146 -0.7138 0.9384 0.9398 0.9809 0.9822 1.6954 1.6954 1.7179 1.7189 1.7268 1.7279 2.0841 2.0841 2.4094 2.4101 2.4241 2.4250 2.6188 2.6189 3.4722 3.4722 4.4615 4.4639 4.4640 4.4661 4.5012 4.5045 4.5720 4.5750 4.7864 4.7864 5.0392 5.0392 5.4009 5.4009 7.4567 7.4571 7.7471 7.7473 8.0353 8.0355 9.1049 9.1066 10.2774 10.3201 10.3492 10.3994 k = 0.0000 0.0000 0.2960 ( 6840 PWs) bands (ev): -64.4515 -64.4515 -37.3780 -37.3780 -28.8154 -28.8154 -28.8088 -28.8088 -17.1255 -17.1255 -16.5064 -16.5064 -14.9077 -14.9077 -14.8758 -14.8758 -14.5781 -14.5781 -14.4532 -14.4532 -10.1719 -10.1719 -10.0310 -10.0310 -6.1625 -6.1625 -5.9339 -5.9339 -5.8421 -5.8421 -4.3905 -4.3905 -3.7450 -3.7450 -3.7070 -3.7070 -3.6316 -3.6316 -3.4523 -3.4523 -3.4184 -3.4184 -2.6639 -2.6639 -2.4818 -2.4818 -2.0388 -2.0388 -0.9260 -0.9260 -0.7296 -0.7296 -0.7142 -0.7142 0.9391 0.9391 0.9815 0.9815 1.6963 1.6963 1.7184 1.7184 1.7274 1.7274 2.0840 2.0840 2.4097 2.4097 2.4245 2.4245 2.6200 2.6200 3.4692 3.4692 4.4627 4.4627 4.4650 4.4650 4.5029 4.5029 4.5735 4.5735 4.7866 4.7866 5.0419 5.0419 5.3997 5.3997 7.4566 7.4566 7.7472 7.7472 8.0354 8.0354 9.1059 9.1059 10.2988 10.2988 10.3746 10.3746 k = 0.0000 0.0000 0.2960 ( 6840 PWs) bands (ev): -64.4515 -64.4515 -37.3780 -37.3780 -28.8154 -28.8154 -28.8088 -28.8088 -17.1255 -17.1255 -16.5064 -16.5064 -14.9077 -14.9077 -14.8758 -14.8758 -14.5781 -14.5781 -14.4532 -14.4532 -10.1719 -10.1719 -10.0310 -10.0310 -6.1625 -6.1625 -5.9339 -5.9339 -5.8421 -5.8421 -4.3905 -4.3905 -3.7450 -3.7450 -3.7070 -3.7070 -3.6316 -3.6316 -3.4523 -3.4523 -3.4184 -3.4184 -2.6639 -2.6639 -2.4818 -2.4818 -2.0388 -2.0388 -0.9260 -0.9260 -0.7296 -0.7296 -0.7142 -0.7142 0.9391 0.9391 0.9815 0.9815 1.6963 1.6963 1.7184 1.7184 1.7274 1.7274 2.0840 2.0840 2.4097 2.4097 2.4245 2.4245 2.6200 2.6200 3.4692 3.4692 4.4627 4.4627 4.4650 4.4650 4.5029 4.5029 4.5735 4.5735 4.7866 4.7866 5.0419 5.0419 5.3997 5.3997 7.4566 7.4566 7.7472 7.7472 8.0354 8.0354 9.1059 9.1059 10.2988 10.2988 10.3746 10.3746 k = 0.0135 0.0078 0.2960 ( 6844 PWs) bands (ev): -64.4515 -64.4515 -37.3780 -37.3780 -28.8154 -28.8154 -28.8088 -28.8088 -17.1250 -17.1249 -16.5082 -16.5056 -14.9108 -14.9041 -14.8754 -14.8753 -14.5802 -14.5769 -14.4538 -14.4538 -10.1718 -10.1718 -10.0310 -10.0310 -6.1611 -6.1611 -5.9339 -5.9339 -5.8421 -5.8421 -4.4027 -4.3880 -3.7453 -3.7451 -3.7070 -3.7069 -3.6316 -3.6314 -3.4526 -3.4469 -3.4157 -3.4154 -2.6698 -2.6586 -2.4823 -2.4823 -2.0381 -2.0377 -0.9305 -0.9260 -0.7287 -0.7264 -0.7117 -0.7108 0.9379 0.9381 0.9803 0.9803 1.6956 1.6958 1.7138 1.7166 1.7255 1.7257 2.0856 2.0860 2.4088 2.4095 2.4240 2.4240 2.6182 2.6196 3.4701 3.4706 4.4588 4.4593 4.4612 4.4616 4.5085 4.5088 4.5754 4.5755 4.7871 4.7871 5.0417 5.0424 5.3984 5.3984 7.4394 7.4711 7.7480 7.7483 8.0211 8.0505 9.1058 9.1064 10.2883 10.3058 10.3763 10.3770 k = 0.0270 0.0156 0.2960 ( 6848 PWs) bands (ev): -64.4515 -64.4515 -37.3780 -37.3780 -28.8155 -28.8155 -28.8088 -28.8088 -17.1232 -17.1232 -16.5110 -16.5058 -14.9132 -14.9004 -14.8743 -14.8734 -14.5831 -14.5767 -14.4556 -14.4555 -10.1715 -10.1715 -10.0312 -10.0312 -6.1568 -6.1567 -5.9339 -5.9339 -5.8420 -5.8420 -4.4239 -4.3955 -3.7458 -3.7455 -3.7069 -3.7069 -3.6315 -3.6310 -3.4485 -3.4399 -3.4064 -3.4040 -2.6763 -2.6540 -2.4842 -2.4837 -2.0357 -2.0350 -0.9386 -0.9301 -0.7253 -0.7187 -0.7050 -0.6994 0.9343 0.9348 0.9765 0.9767 1.6931 1.6939 1.6993 1.7042 1.7244 1.7245 2.0904 2.0912 2.4064 2.4075 2.4227 2.4231 2.6145 2.6173 3.4733 3.4744 4.4470 4.4485 4.4561 4.4572 4.5205 4.5213 4.5806 4.5811 4.7884 4.7884 5.0418 5.0431 5.3947 5.3947 7.4202 7.4819 7.7499 7.7520 8.0077 8.0665 9.1059 9.1072 10.2760 10.3088 10.3800 10.3850 k = 0.0405 0.0234 0.2960 ( 6856 PWs) bands (ev): -64.4515 -64.4515 -37.3780 -37.3780 -28.8155 -28.8155 -28.8089 -28.8088 -17.1202 -17.1202 -16.5148 -16.5071 -14.9148 -14.8973 -14.8725 -14.8697 -14.5870 -14.5774 -14.4585 -14.4582 -10.1711 -10.1711 -10.0315 -10.0315 -6.1495 -6.1494 -5.9339 -5.9338 -5.8418 -5.8418 -4.4529 -4.4121 -3.7466 -3.7460 -3.7069 -3.7068 -3.6311 -3.6306 -3.4431 -3.4346 -3.3881 -3.3823 -2.6832 -2.6502 -2.4873 -2.4855 -2.0316 -2.0306 -0.9490 -0.9373 -0.7210 -0.7069 -0.6935 -0.6811 0.9281 0.9290 0.9706 0.9711 1.6740 1.6798 1.6912 1.6920 1.7241 1.7248 2.0973 2.0983 2.4015 2.4026 2.4217 2.4231 2.6088 2.6129 3.4788 3.4804 4.4330 4.4361 4.4487 4.4512 4.5343 4.5362 4.5882 4.5896 4.7907 4.7908 5.0422 5.0442 5.3886 5.3887 7.3997 7.4886 7.7521 7.7590 7.9951 8.0831 9.1062 9.1083 10.2627 10.3085 10.3845 10.3980 k = 0.0541 0.0312 0.2960 ( 6852 PWs) bands (ev): -64.4515 -64.4515 -37.3780 -37.3780 -28.8156 -28.8156 -28.8088 -28.8088 -17.1161 -17.1160 -16.5196 -16.5094 -14.9157 -14.8951 -14.8701 -14.8637 -14.5919 -14.5791 -14.4624 -14.4618 -10.1705 -10.1705 -10.0319 -10.0319 -6.1395 -6.1393 -5.9339 -5.9338 -5.8416 -5.8416 -4.4883 -4.4370 -3.7473 -3.7466 -3.7068 -3.7067 -3.6307 -3.6300 -3.4383 -3.4306 -3.3601 -3.3523 -2.6908 -2.6476 -2.4917 -2.4875 -2.0258 -2.0245 -0.9608 -0.9462 -0.7150 -0.6939 -0.6758 -0.6579 0.9190 0.9204 0.9628 0.9639 1.6415 1.6490 1.6874 1.6879 1.7239 1.7252 2.1052 2.1062 2.3935 2.3946 2.4220 2.4242 2.6012 2.6066 3.4863 3.4885 4.4183 4.4235 4.4402 4.4446 4.5485 4.5519 4.5974 4.6001 4.7939 4.7941 5.0428 5.0455 5.3803 5.3805 7.3786 7.4908 7.7543 7.7695 7.9834 8.1004 9.1064 9.1095 10.2492 10.3069 10.3894 10.4141 k = 0.0676 0.0390 0.2960 ( 6848 PWs) bands (ev): -64.4515 -64.4515 -37.3780 -37.3780 -28.8156 -28.8156 -28.8088 -28.8088 -17.1108 -17.1107 -16.5251 -16.5127 -14.9161 -14.8937 -14.8671 -14.8556 -14.5978 -14.5821 -14.4672 -14.4660 -10.1698 -10.1697 -10.0324 -10.0324 -6.1266 -6.1264 -5.9338 -5.9337 -5.8413 -5.8413 -4.5287 -4.4686 -3.7481 -3.7473 -3.7067 -3.7066 -3.6301 -3.6294 -3.4341 -3.4269 -3.3241 -3.3168 -2.6989 -2.6463 -2.4972 -2.4889 -2.0183 -2.0166 -0.9729 -0.9558 -0.7068 -0.6799 -0.6526 -0.6312 0.9066 0.9088 0.9538 0.9557 1.6027 1.6114 1.6829 1.6834 1.7234 1.7251 2.1126 2.1137 2.3825 2.3837 2.4233 2.4262 2.5920 2.5985 3.4958 3.4984 4.4031 4.4107 4.4315 4.4381 4.5625 4.5678 4.6075 4.6120 4.7980 4.7984 5.0436 5.0470 5.3700 5.3703 7.3572 7.4890 7.7559 7.7834 7.9726 8.1182 9.1064 9.1106 10.2359 10.3052 10.3949 10.4316 k = 0.0811 0.0468 0.2960 ( 6852 PWs) bands (ev): -64.4515 -64.4515 -37.3780 -37.3780 -28.8157 -28.8157 -28.8088 -28.8087 -17.1044 -17.1043 -16.5315 -16.5169 -14.9160 -14.8931 -14.8634 -14.8457 -14.6050 -14.5864 -14.4727 -14.4706 -10.1689 -10.1688 -10.0331 -10.0331 -6.1111 -6.1108 -5.9338 -5.9336 -5.8410 -5.8410 -4.5728 -4.5057 -3.7487 -3.7478 -3.7066 -3.7065 -3.6294 -3.6286 -3.4300 -3.4230 -3.2821 -3.2777 -2.7078 -2.6467 -2.5038 -2.4892 -2.0090 -2.0069 -0.9848 -0.9651 -0.6965 -0.6644 -0.6257 -0.6016 0.8908 0.8937 0.9441 0.9468 1.5586 1.5684 1.6776 1.6782 1.7221 1.7244 2.1187 2.1201 2.3690 2.3703 2.4254 2.4288 2.5813 2.5888 3.5068 3.5098 4.3877 4.3976 4.4235 4.4325 4.5761 4.5834 4.6180 4.6246 4.8030 4.8038 5.0447 5.0487 5.3578 5.3583 7.3362 7.4835 7.7567 7.8000 7.9625 8.1364 9.1059 9.1115 10.2232 10.3038 10.4010 10.4498 k = 0.0946 0.0546 0.2960 ( 6848 PWs) bands (ev): -64.4515 -64.4515 -37.3780 -37.3780 -28.8158 -28.8158 -28.8088 -28.8087 -17.0970 -17.0967 -16.5386 -16.5220 -14.9156 -14.8928 -14.8589 -14.8345 -14.6134 -14.5922 -14.4788 -14.4752 -10.1678 -10.1678 -10.0338 -10.0338 -6.0931 -6.0926 -5.9337 -5.9336 -5.8406 -5.8405 -4.6196 -4.5468 -3.7492 -3.7483 -3.7065 -3.7063 -3.6286 -3.6278 -3.4258 -3.4188 -3.2368 -3.2356 -2.7174 -2.6491 -2.5110 -2.4876 -1.9979 -1.9955 -0.9961 -0.9738 -0.6837 -0.6469 -0.5961 -0.5699 0.8718 0.8754 0.9340 0.9374 1.5101 1.5210 1.6715 1.6724 1.7200 1.7228 2.1229 2.1247 2.3533 2.3548 2.4280 2.4315 2.5695 2.5778 3.5192 3.5226 4.3720 4.3840 4.4169 4.4279 4.5892 4.5985 4.6288 4.6374 4.8089 4.8101 5.0459 5.0505 5.3442 5.3450 7.3157 7.4752 7.7564 7.8186 7.9533 8.1547 9.1047 9.1118 10.2115 10.3031 10.4077 10.4686 k = 0.1081 0.0624 0.2960 ( 6848 PWs) bands (ev): -64.4515 -64.4515 -37.3780 -37.3780 -28.8159 -28.8159 -28.8088 -28.8087 -17.0884 -17.0880 -16.5463 -16.5280 -14.9152 -14.8928 -14.8537 -14.8222 -14.6233 -14.5996 -14.4851 -14.4796 -10.1666 -10.1666 -10.0347 -10.0347 -6.0726 -6.0719 -5.9336 -5.9334 -5.8401 -5.8401 -4.6681 -4.5909 -3.7495 -3.7488 -3.7064 -3.7062 -3.6277 -3.6269 -3.4213 -3.4142 -3.1951 -3.1867 -2.7279 -2.6535 -2.5185 -2.4836 -1.9851 -1.9823 -1.0066 -0.9816 -0.6686 -0.6274 -0.5643 -0.5363 0.8498 0.8538 0.9236 0.9275 1.4580 1.4699 1.6646 1.6657 1.7167 1.7200 2.1249 2.1272 2.3360 2.3376 2.4306 2.4337 2.5573 2.5660 3.5325 3.5362 4.3561 4.3700 4.4119 4.4247 4.6017 4.6128 4.6397 4.6500 4.8157 4.8174 5.0472 5.0524 5.3295 5.3305 7.2961 7.4649 7.7550 7.8383 7.9450 8.1731 9.1026 9.1114 10.2010 10.3031 10.4147 10.4885 k = 0.1216 0.0702 0.2960 ( 6856 PWs) bands (ev): -64.4515 -64.4515 -37.3780 -37.3780 -28.8160 -28.8160 -28.8088 -28.8087 -17.0789 -17.0783 -16.5545 -16.5346 -14.9149 -14.8930 -14.8479 -14.8091 -14.6345 -14.6085 -14.4916 -14.4835 -10.1653 -10.1652 -10.0356 -10.0356 -6.0499 -6.0489 -5.9335 -5.9333 -5.8395 -5.8395 -4.7175 -4.6370 -3.7498 -3.7491 -3.7062 -3.7060 -3.6267 -3.6259 -3.4166 -3.4094 -3.1541 -3.1366 -2.7393 -2.6597 -2.5257 -2.4767 -1.9705 -1.9673 -1.0159 -0.9882 -0.6511 -0.6059 -0.5308 -0.5012 0.8250 0.8293 0.9129 0.9172 1.4028 1.4158 1.6567 1.6582 1.7121 1.7159 2.1244 2.1273 2.3173 2.3190 2.4322 2.4346 2.5455 2.5540 3.5466 3.5505 4.3401 4.3555 4.4087 4.4230 4.6136 4.6261 4.6505 4.6623 4.8231 4.8255 5.0485 5.0543 5.3140 5.3155 7.2777 7.4534 7.7525 7.8579 7.9378 8.1912 9.0996 9.1101 10.1918 10.3041 10.4218 10.5104 k = 0.1351 0.0780 0.2960 ( 6852 PWs) bands (ev): -64.4515 -64.4515 -37.3781 -37.3780 -28.8162 -28.8162 -28.8088 -28.8086 -17.0684 -17.0676 -16.5632 -16.5419 -14.9148 -14.8933 -14.8415 -14.7956 -14.6472 -14.6187 -14.4980 -14.4868 -10.1638 -10.1637 -10.0367 -10.0367 -6.0252 -6.0237 -5.9333 -5.9330 -5.8389 -5.8389 -4.7672 -4.6842 -3.7500 -3.7494 -3.7061 -3.7059 -3.6257 -3.6249 -3.4116 -3.4042 -3.1149 -3.0871 -2.7511 -2.6673 -2.5321 -2.4666 -1.9541 -1.9504 -1.0241 -0.9937 -0.6313 -0.5824 -0.4958 -0.4648 0.7980 0.8024 0.9019 0.9063 1.3450 1.3591 1.6478 1.6497 1.7058 1.7101 2.1216 2.1251 2.2977 2.2994 2.4311 2.4335 2.5355 2.5429 3.5612 3.5651 4.3240 4.3408 4.4072 4.4227 4.6249 4.6382 4.6614 4.6740 4.8311 4.8342 5.0499 5.0563 5.2983 5.3002 7.2608 7.4412 7.7487 7.8757 7.9328 8.2089 9.0956 9.1079 10.1843 10.3061 10.4286 10.5350 k = 0.1486 0.0858 0.2960 ( 6850 PWs) bands (ev): -64.4515 -64.4515 -37.3781 -37.3780 -28.8163 -28.8163 -28.8088 -28.8086 -17.0570 -17.0558 -16.5722 -16.5497 -14.9150 -14.8939 -14.8349 -14.7822 -14.6609 -14.6298 -14.5042 -14.4894 -10.1622 -10.1621 -10.0379 -10.0379 -5.9987 -5.9968 -5.9329 -5.9325 -5.8382 -5.8381 -4.8166 -4.7319 -3.7502 -3.7497 -3.7059 -3.7057 -3.6245 -3.6237 -3.4063 -3.3989 -3.0789 -3.0404 -2.7628 -2.6755 -2.5369 -2.4531 -1.9360 -1.9317 -1.0311 -0.9979 -0.6093 -0.5570 -0.4596 -0.4273 0.7690 0.7734 0.8905 0.8951 1.2852 1.3004 1.6377 1.6401 1.6976 1.7025 2.1165 2.1204 2.2776 2.2795 2.4250 2.4295 2.5288 2.5343 3.5758 3.5798 4.3078 4.3258 4.4073 4.4238 4.6356 4.6492 4.6724 4.6850 4.8394 4.8433 5.0514 5.0583 5.2829 5.2852 7.2455 7.4288 7.7438 7.8883 7.9327 8.2256 9.0906 9.1047 10.1785 10.3092 10.4350 10.5625 k = 0.1622 0.0936 0.2960 ( 6846 PWs) bands (ev): -64.4515 -64.4515 -37.3781 -37.3781 -28.8165 -28.8165 -28.8088 -28.8086 -17.0447 -17.0432 -16.5815 -16.5580 -14.9158 -14.8947 -14.8283 -14.7697 -14.6754 -14.6409 -14.5102 -14.4913 -10.1604 -10.1603 -10.0391 -10.0391 -5.9712 -5.9689 -5.9321 -5.9312 -5.8374 -5.8373 -4.8653 -4.7795 -3.7503 -3.7499 -3.7058 -3.7056 -3.6233 -3.6225 -3.4009 -3.3933 -3.0474 -2.9997 -2.7726 -2.6828 -2.5391 -2.4361 -1.9160 -1.9112 -1.0368 -1.0010 -0.5850 -0.5296 -0.4224 -0.3888 0.7382 0.7425 0.8787 0.8834 1.2237 1.2402 1.6262 1.6290 1.6874 1.6928 2.1092 2.1134 2.2575 2.2596 2.4133 2.4209 2.5260 2.5297 3.5904 3.5943 4.2916 4.3107 4.4086 4.4260 4.6458 4.6589 4.6833 4.6954 4.8478 4.8525 5.0528 5.0602 5.2682 5.2710 7.2319 7.4168 7.7378 7.8917 7.9408 8.2411 9.0848 9.1006 10.1743 10.3135 10.4410 10.5926 k = 0.1757 0.1014 0.2960 ( 6846 PWs) bands (ev): -64.4515 -64.4515 -37.3781 -37.3781 -28.8166 -28.8166 -28.8088 -28.8086 -17.0317 -17.0297 -16.5908 -16.5666 -14.9172 -14.8958 -14.8225 -14.7598 -14.6892 -14.6510 -14.5159 -14.4924 -10.1586 -10.1585 -10.0404 -10.0404 -5.9457 -5.9446 -5.9280 -5.9249 -5.8365 -5.8362 -4.9126 -4.8263 -3.7503 -3.7501 -3.7056 -3.7054 -3.6220 -3.6213 -3.3953 -3.3877 -3.0220 -2.9696 -2.7780 -2.6875 -2.5377 -2.4156 -1.8944 -1.8889 -1.0412 -1.0029 -0.5586 -0.5005 -0.3845 -0.3496 0.7061 0.7100 0.8666 0.8715 1.1609 1.1791 1.6131 1.6163 1.6749 1.6809 2.0998 2.1043 2.2379 2.2404 2.3968 2.4071 2.5267 2.5295 3.6046 3.6084 4.2754 4.2955 4.4109 4.4290 4.6555 4.6677 4.6941 4.7053 4.8560 4.8614 5.0541 5.0621 5.2547 5.2581 7.2204 7.4053 7.7307 7.8883 7.9541 8.2551 9.0784 9.0957 10.1718 10.3189 10.4470 10.6251 k = 0.1892 0.1092 0.2960 ( 6852 PWs) bands (ev): -64.4515 -64.4515 -37.3781 -37.3781 -28.8168 -28.8168 -28.8088 -28.8085 -17.0179 -17.0155 -16.6002 -16.5755 -14.9194 -14.8974 -14.8180 -14.7558 -14.7002 -14.6580 -14.5212 -14.4929 -10.1566 -10.1565 -10.0419 -10.0419 -5.9370 -5.9364 -5.9069 -5.9011 -5.8352 -5.8348 -4.9582 -4.8718 -3.7504 -3.7503 -3.7055 -3.7053 -3.6207 -3.6199 -3.3897 -3.3820 -3.0045 -2.9547 -2.7768 -2.6874 -2.5312 -2.3916 -1.8710 -1.8647 -1.0444 -1.0037 -0.5302 -0.4697 -0.3459 -0.3097 0.6727 0.6763 0.8541 0.8593 1.0974 1.1174 1.5981 1.6016 1.6602 1.6666 2.0884 2.0930 2.2193 2.2223 2.3765 2.3888 2.5298 2.5327 3.6183 3.6220 4.2592 4.2804 4.4138 4.4325 4.6647 4.6756 4.7047 4.7147 4.8637 4.8699 5.0555 5.0639 5.2430 5.2469 7.2108 7.3948 7.7227 7.8819 7.9684 8.2671 9.0716 9.0902 10.1710 10.3253 10.4530 10.6593 k = 0.2027 0.1170 0.2960 ( 6844 PWs) bands (ev): -64.4515 -64.4515 -37.3781 -37.3781 -28.8170 -28.8170 -28.8087 -28.8085 -17.0036 -17.0005 -16.6095 -16.5844 -14.9227 -14.8997 -14.8157 -14.7610 -14.7057 -14.6594 -14.5262 -14.4927 -10.1545 -10.1544 -10.0434 -10.0434 -5.9356 -5.9350 -5.8784 -5.8714 -5.8329 -5.8321 -5.0016 -4.9155 -3.7505 -3.7503 -3.7054 -3.7051 -3.6193 -3.6186 -3.3840 -3.3763 -2.9964 -2.9556 -2.7699 -2.6811 -2.5179 -2.3643 -1.8460 -1.8388 -1.0463 -1.0034 -0.5000 -0.4374 -0.3068 -0.2693 0.6383 0.6415 0.8410 0.8470 1.0337 1.0561 1.5809 1.5844 1.6434 1.6501 2.0753 2.0799 2.2021 2.2058 2.3535 2.3672 2.5349 2.5381 3.6313 3.6350 4.2431 4.2652 4.4169 4.4360 4.6734 4.6831 4.7151 4.7239 4.8708 4.8777 5.0567 5.0657 5.2335 5.2380 7.2035 7.3855 7.7138 7.8742 7.9815 8.2767 9.0648 9.0844 10.1717 10.3324 10.4594 10.6946 k = 0.2162 0.1248 0.2960 ( 6848 PWs) bands (ev): -64.4515 -64.4515 -37.3781 -37.3781 -28.8172 -28.8171 -28.8087 -28.8085 -16.9888 -16.9850 -16.6186 -16.5933 -14.9274 -14.9031 -14.8165 -14.7740 -14.7070 -14.6543 -14.5309 -14.4919 -10.1524 -10.1523 -10.0449 -10.0449 -5.9350 -5.9345 -5.8531 -5.8472 -5.8263 -5.8227 -5.0421 -4.9567 -3.7506 -3.7504 -3.7052 -3.7049 -3.6178 -3.6172 -3.3784 -3.3707 -2.9989 -2.9682 -2.7605 -2.6704 -2.4960 -2.3340 -1.8193 -1.8112 -1.0471 -1.0022 -0.4681 -0.4037 -0.2675 -0.2287 0.6030 0.6057 0.8270 0.8343 0.9703 0.9961 1.5611 1.5643 1.6246 1.6315 2.0604 2.0652 2.1865 2.1910 2.3287 2.3431 2.5411 2.5446 3.6435 3.6472 4.2271 4.2501 4.4198 4.4390 4.6816 4.6901 4.7251 4.7328 4.8774 4.8848 5.0580 5.0675 5.2265 5.2316 7.1984 7.3775 7.7043 7.8658 7.9924 8.2836 9.0582 9.0785 10.1738 10.3398 10.4663 10.7303 k = 0.2297 0.1326 0.2960 ( 6862 PWs) bands (ev): -64.4515 -64.4515 -37.3781 -37.3781 -28.8174 -28.8173 -28.8087 -28.8085 -16.9737 -16.9690 -16.6274 -16.6020 -14.9340 -14.9079 -14.8203 -14.7902 -14.7060 -14.6441 -14.5353 -14.4906 -10.1502 -10.1500 -10.0466 -10.0466 -5.9347 -5.9343 -5.8412 -5.8389 -5.8067 -5.7974 -5.0791 -4.9948 -3.7507 -3.7504 -3.7052 -3.7047 -3.6163 -3.6157 -3.3729 -3.3652 -3.0119 -2.9874 -2.7501 -2.6587 -2.4653 -2.3010 -1.7911 -1.7819 -1.0467 -1.0000 -0.4348 -0.3689 -0.2281 -0.1878 0.5668 0.5693 0.8112 0.8210 0.9085 0.9391 1.5382 1.5408 1.6044 1.6111 2.0440 2.0489 2.1728 2.1780 2.3027 2.3174 2.5481 2.5517 3.6547 3.6588 4.2111 4.2351 4.4219 4.4411 4.6894 4.6969 4.7346 4.7414 4.8835 4.8913 5.0593 5.0693 5.2221 5.2279 7.1955 7.3709 7.6941 7.8570 8.0005 8.2875 9.0521 9.0728 10.1772 10.3473 10.4740 10.7656 k = 0.2432 0.1404 0.2960 ( 6846 PWs) bands (ev): -64.4515 -64.4515 -37.3781 -37.3781 -28.8175 -28.8175 -28.8087 -28.8084 -16.9584 -16.9527 -16.6358 -16.6104 -14.9429 -14.9151 -14.8264 -14.8066 -14.7027 -14.6310 -14.5393 -14.4886 -10.1478 -10.1477 -10.0483 -10.0483 -5.9346 -5.9341 -5.8377 -5.8365 -5.7800 -5.7670 -5.1119 -5.0291 -3.7508 -3.7504 -3.7051 -3.7045 -3.6148 -3.6142 -3.3676 -3.3599 -3.0341 -3.0104 -2.7391 -2.6485 -2.4271 -2.2659 -1.7613 -1.7510 -1.0453 -0.9970 -0.4002 -0.3332 -0.1887 -0.1470 0.5298 0.5322 0.7911 0.8044 0.8515 0.8885 1.5119 1.5139 1.5829 1.5895 2.0262 2.0314 2.1608 2.1669 2.2760 2.2907 2.5555 2.5591 3.6650 3.6697 4.1952 4.2201 4.4229 4.4421 4.6968 4.7034 4.7434 4.7497 4.8895 4.8976 5.0606 5.0713 5.2205 5.2270 7.1949 7.3658 7.6834 7.8479 8.0056 8.2881 9.0468 9.0676 10.1818 10.3543 10.4827 10.7995 k = 0.2568 0.1482 0.2960 ( 6834 PWs) bands (ev): -64.4515 -64.4515 -37.3781 -37.3781 -28.8177 -28.8177 -28.8086 -28.8084 -16.9430 -16.9362 -16.6436 -16.6183 -14.9545 -14.9255 -14.8334 -14.8215 -14.6976 -14.6166 -14.5429 -14.4861 -10.1455 -10.1454 -10.0500 -10.0500 -5.9344 -5.9340 -5.8359 -5.8351 -5.7537 -5.7375 -5.1396 -5.0586 -3.7510 -3.7504 -3.7050 -3.7042 -3.6133 -3.6127 -3.3624 -3.3547 -3.0626 -3.0367 -2.7276 -2.6401 -2.3837 -2.2293 -1.7300 -1.7185 -1.0429 -0.9933 -0.3647 -0.2971 -0.1496 -0.1064 0.4918 0.4944 0.7620 0.7712 0.8135 0.8496 1.4814 1.4839 1.5604 1.5671 2.0071 2.0128 2.1504 2.1574 2.2490 2.2637 2.5630 2.5665 3.6743 3.6799 4.1795 4.2051 4.4227 4.4415 4.7037 4.7098 4.7514 4.7573 4.8958 4.9038 5.0621 5.0735 5.2215 5.2288 7.1966 7.3622 7.6723 7.8387 8.0074 8.2853 9.0424 9.0629 10.1874 10.3603 10.4926 10.8305 k = 0.2703 0.1560 0.2960 ( 6830 PWs) bands (ev): -64.4515 -64.4515 -37.3782 -37.3781 -28.8179 -28.8179 -28.8086 -28.8083 -16.9279 -16.9197 -16.6507 -16.6255 -14.9690 -14.9395 -14.8402 -14.8335 -14.6913 -14.6021 -14.5459 -14.4830 -10.1431 -10.1429 -10.0518 -10.0518 -5.9343 -5.9339 -5.8347 -5.8340 -5.7304 -5.7106 -5.1611 -5.0824 -3.7511 -3.7503 -3.7049 -3.7040 -3.6118 -3.6112 -3.3575 -3.3499 -3.0950 -3.0662 -2.7161 -2.6332 -2.3373 -2.1917 -1.6974 -1.6846 -1.0396 -0.9888 -0.3286 -0.2610 -0.1109 -0.0662 0.4529 0.4559 0.7202 0.7230 0.7966 0.8247 1.4469 1.4510 1.5368 1.5440 1.9867 1.9929 2.1412 2.1495 2.2222 2.2369 2.5706 2.5739 3.6827 3.6894 4.1638 4.1902 4.4211 4.4395 4.7101 4.7158 4.7585 4.7640 4.9026 4.9105 5.0636 5.0758 5.2249 5.2334 7.2006 7.3602 7.6609 7.8294 8.0058 8.2789 9.0390 9.0590 10.1939 10.3652 10.5037 10.8547 k = 0.2838 0.1638 0.2960 ( 6836 PWs) bands (ev): -64.4515 -64.4515 -37.3782 -37.3782 -28.8181 -28.8181 -28.8086 -28.8083 -16.9131 -16.9034 -16.6569 -16.6319 -14.9862 -14.9573 -14.8460 -14.8426 -14.6843 -14.5885 -14.5477 -14.4794 -10.1406 -10.1405 -10.0537 -10.0537 -5.9343 -5.9338 -5.8337 -5.8331 -5.7112 -5.6878 -5.1754 -5.0994 -3.7512 -3.7503 -3.7049 -3.7038 -3.6103 -3.6097 -3.3529 -3.3453 -3.1299 -3.0985 -2.7048 -2.6273 -2.2894 -2.1536 -1.6634 -1.6494 -1.0355 -0.9839 -0.2925 -0.2256 -0.0728 -0.0268 0.4132 0.4166 0.6691 0.6792 0.7851 0.8090 1.4091 1.4153 1.5121 1.5204 1.9650 1.9717 2.1328 2.1428 2.1962 2.2112 2.5780 2.5812 3.6902 3.6981 4.1483 4.1754 4.4182 4.4359 4.7160 4.7216 4.7644 4.7697 4.9102 4.9178 5.0653 5.0783 5.2308 5.2404 7.2067 7.3596 7.6493 7.8201 8.0007 8.2692 9.0367 9.0559 10.2012 10.3686 10.5158 10.8499 k = 0.2973 0.1716 0.2960 ( 6842 PWs) bands (ev): -64.4515 -64.4515 -37.3782 -37.3782 -28.8183 -28.8183 -28.8086 -28.8083 -16.8990 -16.8877 -16.6620 -16.6372 -15.0056 -14.9780 -14.8507 -14.8489 -14.6771 -14.5777 -14.5467 -14.4753 -10.1381 -10.1380 -10.0556 -10.0556 -5.9342 -5.9338 -5.8328 -5.8322 -5.6971 -5.6704 -5.1815 -5.1088 -3.7513 -3.7503 -3.7049 -3.7036 -3.6088 -3.6083 -3.3486 -3.3410 -3.1664 -3.1330 -2.6938 -2.6220 -2.2413 -2.1156 -1.6282 -1.6130 -1.0307 -0.9784 -0.2569 -0.1919 -0.0353 0.0115 0.3729 0.3768 0.6217 0.6363 0.7756 0.7982 1.3687 1.3770 1.4866 1.4962 1.9418 1.9492 2.1242 2.1369 2.1718 2.1879 2.5852 2.5882 3.6970 3.7061 4.1330 4.1606 4.4140 4.4311 4.7214 4.7269 4.7692 4.7742 4.9185 4.9259 5.0670 5.0808 5.2388 5.2497 7.2150 7.3604 7.6376 7.8111 7.9922 8.2561 9.0354 9.0535 10.2090 10.3706 10.5286 10.8303 k = 0.3108 0.1794 0.2960 ( 6838 PWs) bands (ev): -64.4515 -64.4515 -37.3782 -37.3782 -28.8185 -28.8184 -28.8085 -28.8083 -16.8858 -16.8729 -16.6660 -16.6412 -15.0266 -15.0007 -14.8542 -14.8534 -14.6700 -14.5723 -14.5404 -14.4708 -10.1357 -10.1355 -10.0575 -10.0575 -5.9341 -5.9337 -5.8319 -5.8314 -5.6887 -5.6591 -5.1789 -5.1101 -3.7514 -3.7503 -3.7048 -3.7034 -3.6074 -3.6068 -3.3447 -3.3371 -3.2042 -3.1691 -2.6832 -2.6171 -2.1937 -2.0782 -1.5919 -1.5756 -1.0253 -0.9727 -0.2229 -0.1615 0.0014 0.0483 0.3326 0.3375 0.5795 0.5971 0.7677 0.7903 1.3262 1.3366 1.4603 1.4713 1.9172 1.9250 2.1142 2.1298 2.1510 2.1684 2.5922 2.5950 3.7030 3.7133 4.1180 4.1458 4.4090 4.4252 4.7263 4.7317 4.7729 4.7776 4.9274 4.9344 5.0687 5.0834 5.2489 5.2612 7.2254 7.3626 7.6259 7.8025 7.9804 8.2399 9.0349 9.0518 10.2173 10.3713 10.5416 10.8075 k = 0.3243 0.1872 0.2960 ( 6836 PWs) bands (ev): -64.4515 -64.4515 -37.3782 -37.3782 -28.8186 -28.8186 -28.8085 -28.8082 -16.8737 -16.8592 -16.6684 -16.6437 -15.0486 -15.0245 -14.8570 -14.8565 -14.6631 -14.5717 -14.5297 -14.4659 -10.1331 -10.1330 -10.0594 -10.0594 -5.9341 -5.9337 -5.8312 -5.8307 -5.6859 -5.6543 -5.1679 -5.1034 -3.7516 -3.7503 -3.7048 -3.7032 -3.6060 -3.6054 -3.3413 -3.3334 -3.2425 -3.2062 -2.6731 -2.6125 -2.1474 -2.0417 -1.5546 -1.5372 -1.0194 -0.9668 -0.1919 -0.1363 0.0376 0.0829 0.2937 0.3004 0.5430 0.5626 0.7616 0.7847 1.2820 1.2946 1.4334 1.4460 1.8910 1.8991 2.1015 2.1164 2.1391 2.1544 2.5989 2.6015 3.7084 3.7199 4.1032 4.1312 4.4033 4.4186 4.7305 4.7360 4.7757 4.7800 4.9367 4.9432 5.0703 5.0858 5.2610 5.2745 7.2379 7.3660 7.6143 7.7945 7.9655 8.2210 9.0351 9.0507 10.2260 10.3709 10.5543 10.7831 k = 0.3378 0.1951 0.2960 ( 6840 PWs) bands (ev): -64.4515 -64.4515 -37.3782 -37.3782 -28.8188 -28.8188 -28.8085 -28.8082 -16.8631 -16.8472 -16.6691 -16.6446 -15.0710 -15.0488 -14.8591 -14.8585 -14.6566 -14.5734 -14.5174 -14.4608 -10.1307 -10.1305 -10.0614 -10.0614 -5.9340 -5.9336 -5.8304 -5.8299 -5.6879 -5.6553 -5.1494 -5.0896 -3.7517 -3.7502 -3.7048 -3.7029 -3.6046 -3.6040 -3.3386 -3.3302 -3.2811 -3.2437 -2.6635 -2.6083 -2.1027 -2.0065 -1.5165 -1.4981 -1.0132 -0.9608 -0.1660 -0.1191 0.0733 0.1144 0.2591 0.2679 0.5125 0.5334 0.7574 0.7811 1.2366 1.2514 1.4063 1.4202 1.8633 1.8714 2.0863 2.0984 2.1346 2.1457 2.6052 2.6076 3.7132 3.7258 4.0889 4.1168 4.3972 4.4116 4.7342 4.7398 4.7778 4.7818 4.9458 4.9519 5.0718 5.0879 5.2750 5.2895 7.2523 7.3704 7.6027 7.7872 7.9479 8.1995 9.0358 9.0500 10.2350 10.3696 10.5661 10.7584 k = 0.3514 0.2029 0.2960 ( 6826 PWs) bands (ev): -64.4515 -64.4515 -37.3782 -37.3782 -28.8190 -28.8189 -28.8084 -28.8082 -16.8539 -16.8370 -16.6679 -16.6439 -15.0933 -15.0730 -14.8607 -14.8600 -14.6506 -14.5758 -14.5049 -14.4555 -10.1282 -10.1280 -10.0633 -10.0633 -5.9340 -5.9336 -5.8298 -5.8293 -5.6937 -5.6611 -5.1250 -5.0697 -3.7518 -3.7502 -3.7048 -3.7027 -3.6034 -3.6027 -3.3377 -3.3274 -3.3193 -3.2803 -2.6543 -2.6043 -2.0601 -1.9731 -1.4778 -1.4585 -1.0068 -0.9550 -0.1483 -0.1127 0.1087 0.1404 0.2342 0.2425 0.4878 0.5099 0.7553 0.7795 1.1905 1.2073 1.3792 1.3944 1.8344 1.8421 2.0705 2.0805 2.1326 2.1406 2.6112 2.6134 3.7174 3.7309 4.0751 4.1027 4.3911 4.4044 4.7374 4.7429 4.7794 4.7830 4.9546 4.9603 5.0730 5.0895 5.2905 5.3056 7.2685 7.3759 7.5914 7.7808 7.9278 8.1760 9.0368 9.0497 10.2441 10.3676 10.5765 10.7345 k = 0.3649 0.2107 0.2960 ( 6826 PWs) bands (ev): -64.4515 -64.4515 -37.3782 -37.3782 -28.8191 -28.8191 -28.8084 -28.8082 -16.8464 -16.8289 -16.6648 -16.6415 -15.1152 -15.0966 -14.8619 -14.8610 -14.6451 -14.5786 -14.4928 -14.4502 -10.1257 -10.1256 -10.0653 -10.0653 -5.9339 -5.9335 -5.8291 -5.8286 -5.7021 -5.6703 -5.0962 -5.0455 -3.7519 -3.7502 -3.7048 -3.7025 -3.6022 -3.6014 -3.3583 -3.3425 -3.3246 -3.3102 -2.6457 -2.6006 -2.0198 -1.9417 -1.4387 -1.4186 -1.0004 -0.9495 -0.1423 -0.1190 0.1424 0.1579 0.2262 0.2269 0.4687 0.4920 0.7556 0.7797 1.1439 1.1628 1.3526 1.3687 1.8044 1.8114 2.0553 2.0641 2.1316 2.1376 2.6168 2.6188 3.7212 3.7354 4.0620 4.0889 4.3851 4.3973 4.7400 4.7455 4.7806 4.7840 4.9629 4.9683 5.0737 5.0904 5.3071 5.3226 7.2866 7.3821 7.5803 7.7752 7.9058 8.1508 9.0380 9.0495 10.2533 10.3653 10.5850 10.7119 k = 0.3784 0.2185 0.2960 ( 6822 PWs) bands (ev): -64.4515 -64.4515 -37.3782 -37.3782 -28.8192 -28.8192 -28.8083 -28.8082 -16.8403 -16.8231 -16.6598 -16.6378 -15.1361 -15.1193 -14.8628 -14.8618 -14.6400 -14.5815 -14.4814 -14.4450 -10.1234 -10.1232 -10.0672 -10.0672 -5.9339 -5.9335 -5.8285 -5.8281 -5.7119 -5.6818 -5.0646 -5.0185 -3.7520 -3.7501 -3.7049 -3.7023 -3.6011 -3.6002 -3.3949 -3.3678 -3.3227 -3.3200 -2.6376 -2.5974 -1.9822 -1.9126 -1.3995 -1.3787 -0.9941 -0.9445 -0.1501 -0.1374 0.1607 0.1802 0.2199 0.2381 0.4550 0.4800 0.7582 0.7815 1.0974 1.1180 1.3270 1.3438 1.7738 1.7798 2.0416 2.0494 2.1313 2.1360 2.6220 2.6238 3.7246 3.7392 4.0497 4.0757 4.3795 4.3905 4.7421 4.7474 4.7817 4.7847 4.9706 4.9756 5.0741 5.0907 5.3246 5.3400 7.3063 7.3890 7.5696 7.7703 7.8827 8.1242 9.0392 9.0495 10.2625 10.3627 10.5915 10.6910 k = 0.3919 0.2263 0.2960 ( 6826 PWs) bands (ev): -64.4515 -64.4515 -37.3783 -37.3782 -28.8194 -28.8193 -28.8083 -28.8081 -16.8357 -16.8192 -16.6534 -16.6330 -15.1559 -15.1408 -14.8634 -14.8624 -14.6354 -14.5844 -14.4708 -14.4400 -10.1210 -10.1209 -10.0692 -10.0691 -5.9338 -5.9334 -5.8280 -5.8275 -5.7223 -5.6944 -5.0317 -4.9901 -3.7520 -3.7501 -3.7049 -3.7021 -3.6002 -3.5991 -3.4302 -3.4018 -3.3216 -3.3196 -2.6300 -2.5945 -1.9474 -1.8862 -1.3606 -1.3393 -0.9881 -0.9402 -0.1707 -0.1650 0.1691 0.2028 0.2285 0.2579 0.4469 0.4741 0.7630 0.7845 1.0513 1.0734 1.3029 1.3199 1.7430 1.7480 2.0295 2.0365 2.1314 2.1352 2.6268 2.6284 3.7277 3.7422 4.0384 4.0630 4.3745 4.3842 4.7438 4.7489 4.7827 4.7854 4.9776 4.9823 5.0741 5.0902 5.3423 5.3572 7.3275 7.3965 7.5593 7.7652 7.8599 8.0966 9.0404 9.0494 10.2715 10.3601 10.5960 10.6722 k = 0.4054 0.2341 0.2960 ( 6826 PWs) bands (ev): -64.4515 -64.4515 -37.3783 -37.3783 -28.8195 -28.8195 -28.8083 -28.8081 -16.8322 -16.8169 -16.6460 -16.6275 -15.1740 -15.1607 -14.8638 -14.8628 -14.6311 -14.5874 -14.4611 -14.4355 -10.1188 -10.1187 -10.0710 -10.0710 -5.9337 -5.9334 -5.8275 -5.8271 -5.7325 -5.7072 -4.9988 -4.9616 -3.7521 -3.7500 -3.7049 -3.7020 -3.5993 -3.5981 -3.4633 -3.4360 -3.3204 -3.3181 -2.6230 -2.5921 -1.9158 -1.8626 -1.3223 -1.3008 -0.9825 -0.9368 -0.2002 -0.1981 0.1795 0.2098 0.2544 0.2796 0.4447 0.4747 0.7697 0.7881 1.0062 1.0293 1.2809 1.2977 1.7128 1.7165 2.0191 2.0253 2.1318 2.1348 2.6311 2.6324 3.7305 3.7446 4.0284 4.0512 4.3700 4.3785 4.7451 4.7498 4.7836 4.7860 4.9839 4.9883 5.0738 5.0891 5.3597 5.3736 7.3499 7.4044 7.5495 7.7581 7.8398 8.0684 9.0415 9.0493 10.2805 10.3574 10.5986 10.6555 k = 0.4189 0.2419 0.2960 ( 6834 PWs) bands (ev): -64.4515 -64.4515 -37.3783 -37.3783 -28.8196 -28.8196 -28.8083 -28.8081 -16.8295 -16.8160 -16.6381 -16.6219 -15.1903 -15.1787 -14.8641 -14.8632 -14.6272 -14.5903 -14.4525 -14.4314 -10.1167 -10.1166 -10.0728 -10.0727 -5.9337 -5.9333 -5.8271 -5.8266 -5.7419 -5.7197 -4.9671 -4.9344 -3.7521 -3.7500 -3.7049 -3.7019 -3.5986 -3.5972 -3.4937 -3.4684 -3.3190 -3.3167 -2.6165 -2.5902 -1.8875 -1.8422 -1.2852 -1.2639 -0.9775 -0.9345 -0.2343 -0.2330 0.1905 0.2136 0.2813 0.3003 0.4492 0.4825 0.7776 0.7912 0.9630 0.9860 1.2615 1.2775 1.6838 1.6862 2.0103 2.0157 2.1323 2.1348 2.6348 2.6360 3.7330 3.7463 4.0196 4.0403 4.3661 4.3734 4.7462 4.7503 4.7845 4.7866 4.9895 4.9938 5.0732 5.0874 5.3763 5.3889 7.3731 7.4128 7.5405 7.7454 7.8264 8.0399 9.0424 9.0491 10.2892 10.3548 10.5997 10.6411 k = 0.4324 0.2497 0.2960 ( 6836 PWs) bands (ev): -64.4515 -64.4515 -37.3783 -37.3783 -28.8197 -28.8197 -28.8082 -28.8081 -16.8276 -16.8160 -16.6302 -16.6165 -15.2044 -15.1947 -14.8643 -14.8634 -14.6235 -14.5933 -14.4449 -14.4280 -10.1148 -10.1147 -10.0744 -10.0744 -5.9336 -5.9333 -5.8267 -5.8263 -5.7501 -5.7313 -4.9375 -4.9096 -3.7520 -3.7500 -3.7049 -3.7018 -3.5981 -3.5964 -3.5205 -3.4982 -3.3177 -3.3156 -2.6107 -2.5888 -1.8627 -1.8251 -1.2501 -1.2294 -0.9731 -0.9336 -0.2690 -0.2675 0.2005 0.2167 0.3037 0.3179 0.4612 0.4976 0.7854 0.7918 0.9234 0.9444 1.2453 1.2599 1.6567 1.6580 2.0031 2.0077 2.1329 2.1349 2.6381 2.6391 3.7354 3.7474 4.0123 4.0304 4.3630 4.3690 4.7470 4.7505 4.7854 4.7871 4.9946 4.9985 5.0724 5.0852 5.3914 5.4025 7.3961 7.4218 7.5329 7.7252 7.8223 8.0117 9.0433 9.0488 10.2976 10.3520 10.5997 10.6289 k = 0.4459 0.2575 0.2960 ( 6836 PWs) bands (ev): -64.4515 -64.4515 -37.3783 -37.3783 -28.8198 -28.8198 -28.8082 -28.8081 -16.8260 -16.8166 -16.6229 -16.6118 -15.2161 -15.2083 -14.8644 -14.8637 -14.6200 -14.5962 -14.4384 -14.4253 -10.1131 -10.1130 -10.0759 -10.0759 -5.9335 -5.9333 -5.8264 -5.8260 -5.7568 -5.7415 -4.9110 -4.8882 -3.7519 -3.7500 -3.7048 -3.7019 -3.5977 -3.5957 -3.5431 -3.5245 -3.3165 -3.3148 -2.6055 -2.5880 -1.8415 -1.8115 -1.2179 -1.1985 -0.9692 -0.9343 -0.3012 -0.2998 0.2085 0.2193 0.3206 0.3311 0.4809 0.5191 0.7863 0.7918 0.8903 0.9064 1.2325 1.2452 1.6324 1.6329 1.9974 2.0011 2.1336 2.1351 2.6408 2.6416 3.7376 3.7479 4.0066 4.0217 4.3606 4.3654 4.7476 4.7505 4.7861 4.7875 4.9990 5.0026 5.0717 5.0826 5.4048 5.4140 7.4164 7.4325 7.5279 7.6993 7.8260 7.9839 9.0440 9.0484 10.3057 10.3490 10.5990 10.6189 k = 0.4595 0.2653 0.2960 ( 6842 PWs) bands (ev): -64.4515 -64.4515 -37.3783 -37.3783 -28.8198 -28.8198 -28.8082 -28.8081 -16.8247 -16.8176 -16.6164 -16.6081 -15.2252 -15.2193 -14.8644 -14.8639 -14.6168 -14.5990 -14.4330 -14.4234 -10.1117 -10.1116 -10.0771 -10.0771 -5.9334 -5.9332 -5.8261 -5.8258 -5.7619 -5.7502 -4.8886 -4.8712 -3.7517 -3.7501 -3.7047 -3.7020 -3.5975 -3.5951 -3.5608 -3.5466 -3.3155 -3.3142 -2.6010 -2.5879 -1.8240 -1.8016 -1.1895 -1.1726 -0.9656 -0.9367 -0.3286 -0.3275 0.2145 0.2213 0.3323 0.3397 0.5068 0.5445 0.7725 0.7913 0.8667 0.8767 1.2233 1.2335 1.6118 1.6121 1.9932 1.9959 2.1341 2.1353 2.6430 2.6436 3.7397 3.7478 4.0026 4.0143 4.3588 4.3624 4.7481 4.7503 4.7867 4.7878 5.0027 5.0057 5.0713 5.0800 5.4159 5.4230 7.4305 7.4457 7.5279 7.6704 7.8354 7.9570 9.0447 9.0479 10.3132 10.3457 10.5981 10.6110 k = 0.4730 0.2731 0.2960 ( 6844 PWs) bands (ev): -64.4515 -64.4515 -37.3783 -37.3783 -28.8199 -28.8199 -28.8082 -28.8081 -16.8235 -16.8187 -16.6112 -16.6056 -15.2316 -15.2276 -14.8644 -14.8640 -14.6137 -14.6019 -14.4287 -14.4224 -10.1106 -10.1105 -10.0781 -10.0781 -5.9334 -5.9332 -5.8258 -5.8256 -5.7650 -5.7572 -4.8711 -4.8592 -3.7515 -3.7503 -3.7044 -3.7024 -3.5974 -3.5948 -3.5730 -3.5638 -3.3148 -3.3139 -2.5971 -2.5884 -1.8104 -1.7955 -1.1664 -1.1536 -0.9617 -0.9407 -0.3497 -0.3490 0.2186 0.2225 0.3399 0.3446 0.5359 0.5693 0.7524 0.7786 0.8532 0.8615 1.2176 1.2248 1.5960 1.5964 1.9903 1.9922 2.1347 2.1354 2.6446 2.6450 3.7416 3.7472 4.0004 4.0083 4.3577 4.3601 4.7486 4.7500 4.7873 4.7879 5.0057 5.0079 5.0713 5.0774 5.4245 5.4293 7.4401 7.4555 7.5368 7.6402 7.8489 7.9313 9.0453 9.0474 10.3203 10.3419 10.5975 10.6051 k = 0.4865 0.2809 0.2960 ( 6832 PWs) bands (ev): -64.4515 -64.4515 -37.3783 -37.3783 -28.8199 -28.8199 -28.8082 -28.8081 -16.8224 -16.8200 -16.6075 -16.6047 -15.2351 -15.2331 -14.8643 -14.8641 -14.6106 -14.6048 -14.4255 -14.4224 -10.1099 -10.1098 -10.0787 -10.0787 -5.9333 -5.9333 -5.8257 -5.8256 -5.7661 -5.7622 -4.8590 -4.8531 -3.7512 -3.7505 -3.7039 -3.7029 -3.5969 -3.5950 -3.5796 -3.5753 -3.3142 -3.3137 -2.5939 -2.5895 -1.8008 -1.7933 -1.1500 -1.1430 -0.9571 -0.9459 -0.3629 -0.3625 0.2212 0.2230 0.3444 0.3467 0.5639 0.5855 0.7370 0.7565 0.8499 0.8549 1.2152 1.2189 1.5862 1.5865 1.9888 1.9897 2.1350 2.1354 2.6456 2.6458 3.7433 3.7462 3.9998 4.0039 4.3573 4.3585 4.7490 4.7497 4.7877 4.7880 5.0078 5.0090 5.0719 5.0750 5.4302 5.4326 7.4479 7.4575 7.5558 7.6101 7.8657 7.9073 9.0459 9.0469 10.3267 10.3375 10.5975 10.6011 k = 0.5000 0.2887 0.2960 ( 6828 PWs) bands (ev): -64.4515 -64.4515 -37.3783 -37.3783 -28.8199 -28.8199 -28.8081 -28.8081 -16.8212 -16.8212 -16.6052 -16.6052 -15.2356 -15.2356 -14.8643 -14.8643 -14.6077 -14.6077 -14.4234 -14.4234 -10.1096 -10.1096 -10.0789 -10.0789 -5.9333 -5.9333 -5.8256 -5.8256 -5.7652 -5.7652 -4.8530 -4.8530 -3.7508 -3.7508 -3.7034 -3.7034 -3.5959 -3.5959 -3.5805 -3.5805 -3.3139 -3.3139 -2.5913 -2.5913 -1.7950 -1.7950 -1.1418 -1.1418 -0.9517 -0.9517 -0.3673 -0.3673 0.2226 0.2226 0.3466 0.3466 0.5836 0.5836 0.7385 0.7385 0.8514 0.8514 1.2157 1.2157 1.5830 1.5830 1.9886 1.9886 2.1353 2.1353 2.6460 2.6460 3.7449 3.7449 4.0010 4.0010 4.3576 4.3576 4.7493 4.7493 4.7879 4.7879 5.0089 5.0089 5.0732 5.0732 5.4329 5.4329 7.4541 7.4541 7.5813 7.5813 7.8853 7.8853 9.0464 9.0464 10.3324 10.3324 10.5986 10.5986 k = 0.5000 0.2887 0.2960 ( 6828 PWs) bands (ev): -64.4515 -64.4515 -37.3783 -37.3783 -28.8199 -28.8199 -28.8081 -28.8081 -16.8212 -16.8212 -16.6052 -16.6052 -15.2356 -15.2356 -14.8643 -14.8643 -14.6077 -14.6077 -14.4234 -14.4234 -10.1096 -10.1096 -10.0789 -10.0789 -5.9333 -5.9333 -5.8256 -5.8256 -5.7652 -5.7652 -4.8530 -4.8530 -3.7508 -3.7508 -3.7034 -3.7034 -3.5959 -3.5959 -3.5805 -3.5805 -3.3139 -3.3139 -2.5913 -2.5913 -1.7950 -1.7950 -1.1418 -1.1418 -0.9517 -0.9517 -0.3673 -0.3673 0.2226 0.2226 0.3466 0.3466 0.5836 0.5836 0.7385 0.7385 0.8514 0.8514 1.2157 1.2157 1.5830 1.5830 1.9886 1.9886 2.1353 2.1353 2.6460 2.6460 3.7449 3.7449 4.0010 4.0010 4.3576 4.3576 4.7493 4.7493 4.7879 4.7879 5.0089 5.0089 5.0732 5.0732 5.4329 5.4329 7.4541 7.4541 7.5813 7.5813 7.8853 7.8853 9.0464 9.0464 10.3324 10.3324 10.5986 10.5986 k = 0.4921 0.3024 0.2960 ( 6836 PWs) bands (ev): -64.4515 -64.4515 -37.3783 -37.3783 -28.8199 -28.8199 -28.8082 -28.8082 -16.8208 -16.8208 -16.6059 -16.6052 -15.2358 -15.2358 -14.8649 -14.8629 -14.6085 -14.6075 -14.4236 -14.4233 -10.1096 -10.1096 -10.0789 -10.0789 -5.9333 -5.9333 -5.8256 -5.8255 -5.7643 -5.7635 -4.8559 -4.8550 -3.7508 -3.7508 -3.7034 -3.7034 -3.5959 -3.5959 -3.5805 -3.5804 -3.3114 -3.3111 -2.5927 -2.5911 -1.7950 -1.7943 -1.1421 -1.1414 -0.9519 -0.9514 -0.3692 -0.3681 0.2189 0.2225 0.3453 0.3455 0.5849 0.5851 0.7392 0.7413 0.8512 0.8522 1.2154 1.2160 1.5848 1.5849 1.9868 1.9871 2.1355 2.1358 2.6442 2.6453 3.7449 3.7450 3.9968 3.9989 4.3607 4.3621 4.7477 4.7480 4.7883 4.7886 5.0087 5.0088 5.0727 5.0735 5.4316 5.4327 7.4453 7.4640 7.5762 7.5867 7.8812 7.8897 9.0466 9.0478 10.3310 10.3313 10.5972 10.6006 k = 0.4841 0.3162 0.2960 ( 6836 PWs) bands (ev): -64.4515 -64.4515 -37.3783 -37.3783 -28.8199 -28.8199 -28.8082 -28.8082 -16.8195 -16.8195 -16.6072 -16.6059 -15.2365 -15.2365 -14.8647 -14.8607 -14.6098 -14.6080 -14.4238 -14.4233 -10.1095 -10.1095 -10.0790 -10.0790 -5.9333 -5.9333 -5.8257 -5.8255 -5.7609 -5.7593 -4.8635 -4.8618 -3.7509 -3.7508 -3.7034 -3.7034 -3.5958 -3.5958 -3.5803 -3.5803 -3.3039 -3.3033 -2.5952 -2.5918 -1.7941 -1.7928 -1.1423 -1.1409 -0.9521 -0.9511 -0.3739 -0.3716 0.2118 0.2187 0.3415 0.3420 0.5892 0.5894 0.7432 0.7471 0.8516 0.8539 1.2152 1.2165 1.5903 1.5906 1.9818 1.9825 2.1364 2.1371 2.6400 2.6423 3.7451 3.7453 3.9867 3.9908 4.3710 4.3737 4.7434 4.7439 4.7895 4.7900 5.0083 5.0084 5.0722 5.0737 5.4288 5.4310 7.4376 7.4746 7.5715 7.5923 7.8774 7.8944 9.0484 9.0507 10.3272 10.3278 10.5964 10.6031 k = 0.4762 0.3299 0.2960 ( 6832 PWs) bands (ev): -64.4515 -64.4515 -37.3783 -37.3783 -28.8199 -28.8199 -28.8082 -28.8082 -16.8174 -16.8173 -16.6091 -16.6072 -15.2376 -15.2376 -14.8637 -14.8579 -14.6118 -14.6091 -14.4240 -14.4233 -10.1093 -10.1093 -10.0792 -10.0792 -5.9333 -5.9333 -5.8257 -5.8254 -5.7550 -5.7527 -4.8757 -4.8733 -3.7509 -3.7509 -3.7035 -3.7034 -3.5958 -3.5957 -3.5801 -3.5800 -3.2916 -3.2906 -2.5987 -2.5937 -1.7923 -1.7905 -1.1424 -1.1403 -0.9523 -0.9507 -0.3812 -0.3779 0.2017 0.2113 0.3352 0.3361 0.5965 0.5966 0.7499 0.7548 0.8531 0.8570 1.2151 1.2170 1.5993 1.5996 1.9737 1.9748 2.1381 2.1391 2.6333 2.6368 3.7454 3.7457 3.9719 3.9776 4.3877 4.3911 4.7368 4.7375 4.7912 4.7919 5.0075 5.0077 5.0716 5.0739 5.4245 5.4278 7.4313 7.4858 7.5674 7.5977 7.8740 7.8994 9.0518 9.0552 10.3211 10.3221 10.5960 10.6055 k = 0.4683 0.3437 0.2960 ( 6832 PWs) bands (ev): -64.4515 -64.4515 -37.3783 -37.3783 -28.8199 -28.8199 -28.8082 -28.8082 -16.8145 -16.8144 -16.6116 -16.6091 -15.2392 -15.2391 -14.8620 -14.8544 -14.6144 -14.6109 -14.4243 -14.4234 -10.1090 -10.1090 -10.0794 -10.0794 -5.9333 -5.9333 -5.8257 -5.8254 -5.7467 -5.7436 -4.8921 -4.8892 -3.7510 -3.7509 -3.7035 -3.7033 -3.5957 -3.5956 -3.5797 -3.5796 -3.2749 -3.2735 -2.6034 -2.5967 -1.7898 -1.7873 -1.1421 -1.1394 -0.9525 -0.9504 -0.3911 -0.3868 0.1893 0.2011 0.3266 0.3278 0.6066 0.6071 0.7578 0.7628 0.8566 0.8626 1.2153 1.2178 1.6112 1.6114 1.9628 1.9644 2.1404 2.1418 2.6242 2.6288 3.7458 3.7462 3.9537 3.9606 4.4092 4.4132 4.7285 4.7292 4.7931 4.7937 5.0066 5.0068 5.0708 5.0740 5.4187 5.4231 7.4264 7.4971 7.5642 7.6030 7.8709 7.9046 9.0566 9.0610 10.3131 10.3145 10.5954 10.6072 k = 0.4603 0.3574 0.2960 ( 6834 PWs) bands (ev): -64.4515 -64.4515 -37.3783 -37.3783 -28.8199 -28.8199 -28.8082 -28.8082 -16.8108 -16.8107 -16.6146 -16.6116 -15.2411 -15.2411 -14.8595 -14.8502 -14.6175 -14.6133 -14.4246 -14.4234 -10.1087 -10.1087 -10.0796 -10.0796 -5.9333 -5.9333 -5.8257 -5.8253 -5.7360 -5.7322 -4.9122 -4.9089 -3.7510 -3.7510 -3.7035 -3.7033 -3.5956 -3.5955 -3.5792 -3.5792 -3.2544 -3.2525 -2.6092 -2.6007 -1.7865 -1.7833 -1.1413 -1.1380 -0.9526 -0.9501 -0.4035 -0.3983 0.1753 0.1886 0.3158 0.3173 0.6196 0.6207 0.7650 0.7692 0.8633 0.8719 1.2157 1.2189 1.6253 1.6253 1.9495 1.9517 2.1433 2.1452 2.6127 2.6185 3.7462 3.7468 3.9333 3.9412 4.4345 4.4386 4.7188 4.7195 4.7949 4.7955 5.0054 5.0057 5.0699 5.0741 5.4117 5.4170 7.4230 7.5081 7.5623 7.6079 7.8681 7.9099 9.0628 9.0682 10.3034 10.3053 10.5941 10.6075 k = 0.4524 0.3712 0.2960 ( 6826 PWs) bands (ev): -64.4515 -64.4515 -37.3783 -37.3783 -28.8199 -28.8199 -28.8082 -28.8082 -16.8063 -16.8062 -16.6181 -16.6147 -15.2435 -15.2435 -14.8563 -14.8455 -14.6212 -14.6163 -14.4248 -14.4234 -10.1082 -10.1082 -10.0800 -10.0799 -5.9333 -5.9332 -5.8257 -5.8253 -5.7231 -5.7187 -4.9354 -4.9320 -3.7511 -3.7510 -3.7034 -3.7033 -3.5954 -3.5953 -3.5787 -3.5787 -3.2307 -3.2280 -2.6162 -2.6058 -1.7824 -1.7785 -1.1399 -1.1361 -0.9527 -0.9498 -0.4183 -0.4124 0.1604 0.1746 0.3029 0.3049 0.6356 0.6375 0.7698 0.7726 0.8745 0.8857 1.2165 1.2203 1.6401 1.6405 1.9345 1.9375 2.1469 2.1491 2.5987 2.6056 3.7467 3.7474 3.9118 3.9204 4.4623 4.4663 4.7080 4.7087 4.7966 4.7971 5.0042 5.0046 5.0689 5.0740 5.4033 5.4095 7.4211 7.5179 7.5620 7.6123 7.8658 7.9153 9.0702 9.0764 10.2925 10.2949 10.5915 10.6057 k = 0.4444 0.3849 0.2960 ( 6834 PWs) bands (ev): -64.4515 -64.4515 -37.3783 -37.3783 -28.8200 -28.8199 -28.8082 -28.8082 -16.8012 -16.8011 -16.6221 -16.6183 -15.2463 -15.2463 -14.8524 -14.8404 -14.6254 -14.6199 -14.4250 -14.4233 -10.1077 -10.1077 -10.0804 -10.0803 -5.9333 -5.9332 -5.8257 -5.8252 -5.7080 -5.7030 -4.9613 -4.9580 -3.7511 -3.7510 -3.7034 -3.7032 -3.5952 -3.5952 -3.5782 -3.5781 -3.2043 -3.2009 -2.6243 -2.6121 -1.7775 -1.7729 -1.1376 -1.1334 -0.9529 -0.9497 -0.4355 -0.4289 0.1451 0.1598 0.2884 0.2907 0.6544 0.6571 0.7711 0.7728 0.8904 0.9037 1.2177 1.2222 1.6542 1.6553 1.9190 1.9231 2.1510 2.1536 2.5822 2.5904 3.7471 3.7478 3.8899 3.8991 4.4918 4.4954 4.6963 4.6970 4.7981 4.7984 5.0030 5.0035 5.0677 5.0739 5.3937 5.4008 7.4209 7.5256 7.5643 7.6161 7.8638 7.9206 9.0787 9.0856 10.2808 10.2837 10.5872 10.6013 k = 0.4365 0.3986 0.2960 ( 6830 PWs) bands (ev): -64.4515 -64.4515 -37.3783 -37.3783 -28.8200 -28.8199 -28.8082 -28.8082 -16.7954 -16.7954 -16.6264 -16.6223 -15.2495 -15.2495 -14.8480 -14.8349 -14.6301 -14.6241 -14.4250 -14.4231 -10.1072 -10.1072 -10.0808 -10.0808 -5.9333 -5.9332 -5.8256 -5.8252 -5.6910 -5.6854 -4.9893 -4.9864 -3.7511 -3.7511 -3.7033 -3.7031 -3.5950 -3.5949 -3.5776 -3.5776 -3.1761 -3.1717 -2.6336 -2.6194 -1.7717 -1.7665 -1.1342 -1.1296 -0.9532 -0.9497 -0.4548 -0.4478 0.1301 0.1447 0.2725 0.2753 0.6759 0.6795 0.7691 0.7700 0.9106 0.9250 1.2194 1.2247 1.6652 1.6674 1.9052 1.9106 2.1555 2.1585 2.5634 2.5727 3.7474 3.7482 3.8681 3.8779 4.5222 4.5253 4.6841 4.6848 4.7994 4.7996 5.0020 5.0025 5.0663 5.0737 5.3831 5.3909 7.4222 7.5308 7.5693 7.6192 7.8623 7.9257 9.0880 9.0955 10.2687 10.2720 10.5807 10.5939 k = 0.4286 0.4124 0.2960 ( 6830 PWs) bands (ev): -64.4515 -64.4515 -37.3783 -37.3783 -28.8200 -28.8200 -28.8083 -28.8082 -16.7892 -16.7891 -16.6309 -16.6268 -15.2530 -15.2530 -14.8430 -14.8291 -14.6352 -14.6288 -14.4249 -14.4228 -10.1065 -10.1065 -10.0813 -10.0813 -5.9333 -5.9332 -5.8255 -5.8251 -5.6720 -5.6660 -5.0188 -5.0166 -3.7511 -3.7511 -3.7032 -3.7030 -3.5948 -3.5947 -3.5771 -3.5770 -3.1464 -3.1412 -2.6440 -2.6278 -1.7652 -1.7594 -1.1295 -1.1245 -0.9536 -0.9498 -0.4763 -0.4688 0.1157 0.1299 0.2557 0.2590 0.6997 0.7042 0.7646 0.7653 0.9339 0.9487 1.2216 1.2277 1.6701 1.6736 1.8957 1.9026 2.1604 2.1637 2.5422 2.5526 3.7475 3.7482 3.8471 3.8575 4.5528 4.5553 4.6717 4.6725 4.8004 4.8005 5.0014 5.0018 5.0649 5.0735 5.3715 5.3799 7.4252 7.5337 7.5764 7.6214 7.8613 7.9305 9.0979 9.1058 10.2565 10.2603 10.5719 10.5834 k = 0.4206 0.4261 0.2960 ( 6830 PWs) bands (ev): -64.4515 -64.4515 -37.3783 -37.3783 -28.8200 -28.8200 -28.8083 -28.8082 -16.7825 -16.7824 -16.6357 -16.6316 -15.2567 -15.2567 -14.8375 -14.8231 -14.6407 -14.6340 -14.4246 -14.4223 -10.1058 -10.1058 -10.0819 -10.0819 -5.9333 -5.9332 -5.8255 -5.8250 -5.6515 -5.6450 -5.0493 -5.0480 -3.7511 -3.7511 -3.7031 -3.7029 -3.5945 -3.5945 -3.5766 -3.5765 -3.1160 -3.1097 -2.6556 -2.6373 -1.7580 -1.7515 -1.1232 -1.1180 -0.9541 -0.9501 -0.4997 -0.4919 0.1025 0.1159 0.2384 0.2422 0.7248 0.7307 0.7587 0.7599 0.9593 0.9738 1.2243 1.2313 1.6658 1.6704 1.8939 1.9021 2.1656 2.1693 2.5187 2.5303 3.7472 3.7477 3.8273 3.8382 4.5827 4.5845 4.6597 4.6607 4.8011 4.8014 5.0012 5.0015 5.0633 5.0733 5.3591 5.3679 7.4297 7.5355 7.5841 7.6228 7.8608 7.9347 9.1082 9.1163 10.2447 10.2488 10.5609 10.5702 k = 0.4127 0.4399 0.2960 ( 6836 PWs) bands (ev): -64.4515 -64.4515 -37.3783 -37.3783 -28.8200 -28.8200 -28.8083 -28.8083 -16.7756 -16.7753 -16.6406 -16.6366 -15.2607 -15.2607 -14.8317 -14.8170 -14.6464 -14.6396 -14.4242 -14.4217 -10.1050 -10.1050 -10.0826 -10.0825 -5.9332 -5.9331 -5.8254 -5.8249 -5.6295 -5.6227 -5.0804 -5.0803 -3.7511 -3.7511 -3.7030 -3.7027 -3.5943 -3.5942 -3.5763 -3.5761 -3.0854 -3.0781 -2.6682 -2.6477 -1.7501 -1.7431 -1.1152 -1.1099 -0.9548 -0.9506 -0.5249 -0.5170 0.0906 0.1031 0.2209 0.2251 0.7415 0.7464 0.7636 0.7642 0.9860 0.9997 1.2276 1.2354 1.6508 1.6561 1.9012 1.9102 2.1710 2.1751 2.4930 2.5057 3.7465 3.7465 3.8089 3.8207 4.6101 4.6109 4.6496 4.6511 4.8014 4.8020 5.0019 5.0019 5.0617 5.0730 5.3460 5.3552 7.4358 7.5369 7.5915 7.6233 7.8609 7.9382 9.1187 9.1268 10.2337 10.2380 10.5478 10.5546 k = 0.4048 0.4536 0.2960 ( 6824 PWs) bands (ev): -64.4515 -64.4515 -37.3783 -37.3783 -28.8200 -28.8200 -28.8083 -28.8083 -16.7684 -16.7681 -16.6455 -16.6418 -15.2649 -15.2648 -14.8256 -14.8109 -14.6523 -14.6454 -14.4236 -14.4210 -10.1042 -10.1042 -10.0833 -10.0833 -5.9332 -5.9331 -5.8253 -5.8248 -5.6063 -5.5992 -5.1130 -5.1115 -3.7511 -3.7511 -3.7029 -3.7026 -3.5940 -3.5940 -3.5760 -3.5759 -3.0550 -3.0469 -2.6818 -2.6589 -1.7417 -1.7342 -1.1053 -1.0999 -0.9555 -0.9513 -0.5517 -0.5437 0.0805 0.0918 0.2034 0.2082 0.7371 0.7392 0.7896 0.7936 1.0135 1.0259 1.2313 1.2399 1.6260 1.6314 1.9169 1.9261 2.1765 2.1809 2.4652 2.4791 3.7444 3.7449 3.7926 3.8054 4.6237 4.6241 4.6521 4.6544 4.8016 4.8023 5.0031 5.0035 5.0601 5.0728 5.3324 5.3417 7.4435 7.5383 7.5979 7.6229 7.8616 7.9409 9.1290 9.1370 10.2237 10.2281 10.5331 10.5373 k = 0.3968 0.4674 0.2960 ( 6828 PWs) bands (ev): -64.4515 -64.4515 -37.3783 -37.3783 -28.8200 -28.8200 -28.8083 -28.8083 -16.7612 -16.7607 -16.6503 -16.6470 -15.2691 -15.2691 -14.8194 -14.8051 -14.6582 -14.6514 -14.4228 -14.4202 -10.1032 -10.1032 -10.0841 -10.0841 -5.9332 -5.9331 -5.8252 -5.8247 -5.5821 -5.5750 -5.1457 -5.1423 -3.7511 -3.7510 -3.7028 -3.7024 -3.5938 -3.5937 -3.5759 -3.5758 -3.0254 -3.0164 -2.6963 -2.6709 -1.7328 -1.7251 -1.0935 -1.0880 -0.9564 -0.9520 -0.5799 -0.5720 0.0723 0.0822 0.1864 0.1918 0.7284 0.7298 0.8209 0.8260 1.0413 1.0521 1.2352 1.2448 1.5933 1.5986 1.9384 1.9477 2.1820 2.1868 2.4357 2.4506 3.7410 3.7423 3.7789 3.7928 4.6180 4.6180 4.6735 4.6751 4.8014 4.8024 5.0053 5.0064 5.0585 5.0726 5.3186 5.3279 7.4526 7.5399 7.6029 7.6215 7.8630 7.9424 9.1389 9.1466 10.2151 10.2195 10.5174 10.5189 k = 0.3889 0.4811 0.2960 ( 6820 PWs) bands (ev): -64.4515 -64.4515 -37.3783 -37.3783 -28.8201 -28.8200 -28.8083 -28.8083 -16.7542 -16.7535 -16.6549 -16.6521 -15.2733 -15.2733 -14.8131 -14.7995 -14.6639 -14.6573 -14.4219 -14.4193 -10.1022 -10.1022 -10.0850 -10.0849 -5.9331 -5.9331 -5.8251 -5.8246 -5.5574 -5.5503 -5.1780 -5.1724 -3.7510 -3.7510 -3.7026 -3.7022 -3.5935 -3.5935 -3.5760 -3.5758 -2.9968 -2.9873 -2.7115 -2.6834 -1.7237 -1.7158 -1.0797 -1.0742 -0.9573 -0.9527 -0.6093 -0.6015 0.0661 0.0747 0.1699 0.1759 0.7189 0.7200 0.8542 0.8598 1.0690 1.0781 1.2394 1.2497 1.5549 1.5599 1.9638 1.9728 2.1875 2.1926 2.4045 2.4204 3.7363 3.7380 3.7683 3.7830 4.6086 4.6090 4.6967 4.6979 4.8010 4.8021 5.0087 5.0108 5.0570 5.0725 5.3047 5.3137 7.4631 7.5417 7.6060 7.6192 7.8651 7.9427 9.1482 9.1554 10.2081 10.2124 10.5001 10.5011 k = 0.3810 0.4949 0.2960 ( 6816 PWs) bands (ev): -64.4515 -64.4515 -37.3783 -37.3783 -28.8201 -28.8201 -28.8083 -28.8083 -16.7475 -16.7466 -16.6591 -16.6570 -15.2774 -15.2774 -14.8069 -14.7945 -14.6694 -14.6632 -14.4209 -14.4184 -10.1011 -10.1011 -10.0859 -10.0859 -5.9331 -5.9330 -5.8250 -5.8245 -5.5323 -5.5255 -5.2094 -5.2013 -3.7510 -3.7510 -3.7025 -3.7021 -3.5933 -3.5933 -3.5763 -3.5761 -2.9697 -2.9600 -2.7272 -2.6962 -1.7145 -1.7068 -1.0639 -1.0585 -0.9581 -0.9531 -0.6395 -0.6320 0.0621 0.0692 0.1542 0.1609 0.7094 0.7104 0.8886 0.8947 1.0964 1.1035 1.2434 1.2545 1.5121 1.5169 1.9914 2.0002 2.1927 2.1982 2.3721 2.3890 3.7307 3.7323 3.7608 3.7758 4.5997 4.6002 4.7176 4.7189 4.8003 4.8015 5.0132 5.0167 5.0556 5.0726 5.2910 5.2995 7.4750 7.5438 7.6071 7.6160 7.8680 7.9417 9.1567 9.1632 10.2027 10.2067 10.4817 10.4851 k = 0.3730 0.5086 0.2960 ( 6812 PWs) bands (ev): -64.4515 -64.4515 -37.3783 -37.3783 -28.8201 -28.8201 -28.8083 -28.8083 -16.7414 -16.7402 -16.6628 -16.6615 -15.2813 -15.2813 -14.8010 -14.7900 -14.6744 -14.6686 -14.4199 -14.4175 -10.1000 -10.1000 -10.0869 -10.0869 -5.9331 -5.9330 -5.8249 -5.8245 -5.5073 -5.5012 -5.2396 -5.2285 -3.7510 -3.7509 -3.7024 -3.7019 -3.5931 -3.5930 -3.5767 -3.5765 -2.9443 -2.9350 -2.7433 -2.7090 -1.7055 -1.6983 -1.0466 -1.0413 -0.9586 -0.9531 -0.6700 -0.6630 0.0602 0.0659 0.1395 0.1469 0.7004 0.7011 0.9237 0.9302 1.1231 1.1283 1.2473 1.2589 1.4664 1.4708 2.0203 2.0287 2.1977 2.2034 2.3388 2.3566 3.7249 3.7261 3.7556 3.7705 4.5918 4.5924 4.7356 4.7372 4.7993 4.8006 5.0187 5.0240 5.0546 5.0729 5.2779 5.2856 7.4881 7.5461 7.6060 7.6119 7.8718 7.9392 9.1642 9.1698 10.1991 10.2026 10.4644 10.4698 k = 0.3651 0.5224 0.2960 ( 6814 PWs) bands (ev): -64.4515 -64.4515 -37.3783 -37.3783 -28.8201 -28.8201 -28.8083 -28.8083 -16.7360 -16.7347 -16.6659 -16.6654 -15.2848 -15.2848 -14.7956 -14.7863 -14.6788 -14.6736 -14.4188 -14.4167 -10.0988 -10.0988 -10.0881 -10.0880 -5.9331 -5.9330 -5.8248 -5.8244 -5.4831 -5.4780 -5.2681 -5.2534 -3.7509 -3.7509 -3.7023 -3.7018 -3.5929 -3.5929 -3.5772 -3.5771 -2.9210 -2.9127 -2.7593 -2.7212 -1.6972 -1.6907 -1.0285 -1.0232 -0.9583 -0.9521 -0.7004 -0.6940 0.0604 0.0647 0.1260 0.1342 0.6921 0.6927 0.9591 0.9656 1.1490 1.1522 1.2505 1.2625 1.4188 1.4228 2.0497 2.0576 2.2023 2.2082 2.3051 2.3238 3.7198 3.7205 3.7517 3.7663 4.5853 4.5859 4.7503 4.7524 4.7981 4.7992 5.0246 5.0321 5.0539 5.0737 5.2659 5.2725 7.5025 7.5486 7.6026 7.6070 7.8765 7.9352 9.1705 9.1751 10.1969 10.2000 10.4488 10.4560 k = 0.3571 0.5361 0.2960 ( 6812 PWs) bands (ev): -64.4515 -64.4515 -37.3783 -37.3783 -28.8201 -28.8201 -28.8083 -28.8083 -16.7317 -16.7303 -16.6684 -16.6682 -15.2878 -15.2878 -14.7907 -14.7836 -14.6823 -14.6778 -14.4178 -14.4160 -10.0975 -10.0975 -10.0892 -10.0892 -5.9330 -5.9330 -5.8248 -5.8243 -5.4603 -5.4568 -5.2943 -5.2753 -3.7509 -3.7509 -3.7022 -3.7017 -3.5927 -3.5927 -3.5779 -3.5777 -2.9003 -2.8939 -2.7748 -2.7323 -1.6898 -1.6844 -1.0108 -1.0057 -0.9565 -0.9494 -0.7294 -0.7240 0.0624 0.0654 0.1137 0.1230 0.6851 0.6855 0.9938 1.0003 1.1735 1.1750 1.2530 1.2649 1.3711 1.3742 2.0791 2.0862 2.2063 2.2121 2.2719 2.2914 3.7159 3.7162 3.7483 3.7630 4.5802 4.5808 4.7616 4.7646 4.7966 4.7976 5.0302 5.0402 5.0538 5.0749 5.2557 5.2608 7.5181 7.5513 7.5969 7.6012 7.8823 7.9299 9.1756 9.1791 10.1960 10.1984 10.4357 10.4444 k = 0.3492 0.5499 0.2960 ( 6816 PWs) bands (ev): -64.4515 -64.4515 -37.3783 -37.3783 -28.8201 -28.8201 -28.8083 -28.8083 -16.7285 -16.7273 -16.6705 -16.6696 -15.2902 -15.2902 -14.7868 -14.7820 -14.6849 -14.6810 -14.4169 -14.4156 -10.0962 -10.0962 -10.0905 -10.0905 -5.9330 -5.9330 -5.8247 -5.8243 -5.4403 -5.4391 -5.3167 -5.2929 -3.7509 -3.7509 -3.7021 -3.7016 -3.5926 -3.5926 -3.5785 -3.5784 -2.8829 -2.8794 -2.7888 -2.7413 -1.6837 -1.6797 -0.9960 -0.9917 -0.9521 -0.9440 -0.7553 -0.7512 0.0657 0.0677 0.1030 0.1136 0.6796 0.6799 1.0263 1.0322 1.1957 1.1962 1.2546 1.2656 1.3259 1.3276 2.1079 2.1136 2.2091 2.2134 2.2416 2.2609 3.7134 3.7136 3.7454 3.7602 4.5766 4.5771 4.7695 4.7738 4.7952 4.7956 5.0344 5.0470 5.0544 5.0768 5.2478 5.2512 7.5346 7.5540 7.5888 7.5947 7.8890 7.9230 9.1794 9.1818 10.1960 10.1977 10.4258 10.4356 k = 0.3413 0.5636 0.2960 ( 6828 PWs) bands (ev): -64.4515 -64.4515 -37.3783 -37.3783 -28.8202 -28.8201 -28.8084 -28.8083 -16.7266 -16.7258 -16.6716 -16.6703 -15.2917 -15.2917 -14.7839 -14.7815 -14.6864 -14.6831 -14.4161 -14.4155 -10.0948 -10.0948 -10.0919 -10.0919 -5.9330 -5.9330 -5.8247 -5.8242 -5.4267 -5.4260 -5.3330 -5.3044 -3.7509 -3.7509 -3.7021 -3.7016 -3.5925 -3.5925 -3.5789 -3.5789 -2.8707 -2.8701 -2.7995 -2.7471 -1.6793 -1.6771 -0.9863 -0.9839 -0.9454 -0.9370 -0.7744 -0.7722 0.0695 0.0708 0.0948 0.1068 0.6761 0.6762 1.0532 1.0573 1.2123 1.2132 1.2562 1.2637 1.2896 1.2897 2.1348 2.1376 2.2007 2.2088 2.2273 2.2366 3.7123 3.7124 3.7431 3.7582 4.5746 4.5749 4.7742 4.7798 4.7938 4.7939 5.0367 5.0518 5.0549 5.0788 5.2430 5.2446 7.5517 7.5568 7.5786 7.5878 7.8969 7.9150 9.1819 9.1831 10.1965 10.1973 10.4196 10.4300 k = 0.3333 0.5774 0.2960 ( 6828 PWs) bands (ev): -64.4515 -64.4515 -37.3783 -37.3783 -28.8201 -28.8201 -28.8084 -28.8084 -16.7256 -16.7256 -16.6719 -16.6704 -15.2922 -15.2922 -14.7822 -14.7822 -14.6869 -14.6838 -14.4156 -14.4156 -10.0933 -10.0933 -10.0933 -10.0933 -5.9330 -5.9330 -5.8247 -5.8242 -5.4216 -5.4216 -5.3390 -5.3083 -3.7509 -3.7509 -3.7020 -3.7016 -3.5925 -3.5925 -3.5791 -3.5791 -2.8665 -2.8665 -2.8036 -2.7491 -1.6770 -1.6770 -0.9822 -0.9822 -0.9420 -0.9333 -0.7812 -0.7812 0.0719 0.0719 0.0912 0.1042 0.6749 0.6749 1.0667 1.0667 1.2183 1.2183 1.2584 1.2597 1.2755 1.2755 2.1503 2.1503 2.1849 2.2048 2.2276 2.2276 3.7121 3.7121 3.7422 3.7574 4.5741 4.5741 4.7757 4.7820 4.7932 4.7932 5.0375 5.0543 5.0543 5.0798 5.2418 5.2418 7.5588 7.5671 7.5671 7.5828 7.9059 7.9059 9.1831 9.1831 10.1970 10.1970 10.4174 10.4281 k = 0.3333 0.5774 0.2960 ( 6828 PWs) bands (ev): -64.4515 -64.4515 -37.3783 -37.3783 -28.8201 -28.8201 -28.8084 -28.8084 -16.7256 -16.7256 -16.6719 -16.6704 -15.2922 -15.2922 -14.7822 -14.7822 -14.6869 -14.6838 -14.4156 -14.4156 -10.0933 -10.0933 -10.0933 -10.0933 -5.9330 -5.9330 -5.8247 -5.8242 -5.4216 -5.4216 -5.3390 -5.3083 -3.7509 -3.7509 -3.7020 -3.7016 -3.5925 -3.5925 -3.5791 -3.5791 -2.8665 -2.8665 -2.8036 -2.7491 -1.6770 -1.6770 -0.9822 -0.9822 -0.9420 -0.9333 -0.7812 -0.7812 0.0719 0.0719 0.0912 0.1042 0.6749 0.6749 1.0667 1.0667 1.2183 1.2183 1.2584 1.2597 1.2755 1.2755 2.1503 2.1503 2.1849 2.2048 2.2276 2.2276 3.7121 3.7121 3.7422 3.7574 4.5741 4.5741 4.7757 4.7820 4.7932 4.7932 5.0375 5.0543 5.0543 5.0798 5.2418 5.2418 7.5588 7.5671 7.5671 7.5828 7.9059 7.9059 9.1831 9.1831 10.1970 10.1970 10.4174 10.4281 k = 0.3254 0.5636 0.2960 ( 6824 PWs) bands (ev): -64.4515 -64.4515 -37.3783 -37.3783 -28.8201 -28.8201 -28.8084 -28.8083 -16.7266 -16.7255 -16.6718 -16.6704 -15.2916 -15.2916 -14.7837 -14.7816 -14.6864 -14.6831 -14.4162 -14.4154 -10.0949 -10.0949 -10.0918 -10.0918 -5.9330 -5.9330 -5.8247 -5.8242 -5.4278 -5.4233 -5.3341 -5.3051 -3.7509 -3.7509 -3.7021 -3.7016 -3.5925 -3.5925 -3.5789 -3.5788 -2.8714 -2.8684 -2.8000 -2.7474 -1.6796 -1.6770 -0.9871 -0.9845 -0.9450 -0.9369 -0.7735 -0.7720 0.0688 0.0715 0.0944 0.1069 0.6762 0.6763 1.0505 1.0555 1.2163 1.2221 1.2591 1.2630 1.2819 1.2870 2.1335 2.1400 2.2003 2.2125 2.2296 2.2301 3.7118 3.7122 3.7435 3.7585 4.5745 4.5749 4.7745 4.7802 4.7931 4.7942 5.0367 5.0519 5.0548 5.0786 5.2433 5.2442 7.5502 7.5644 7.5666 7.5938 7.8959 7.9161 9.1819 9.1831 10.1964 10.1973 10.4196 10.4300 k = 0.3175 0.5499 0.2960 ( 6824 PWs) bands (ev): -64.4515 -64.4515 -37.3783 -37.3783 -28.8201 -28.8201 -28.8084 -28.8083 -16.7283 -16.7259 -16.6716 -16.6706 -15.2898 -15.2897 -14.7861 -14.7822 -14.6853 -14.6811 -14.4173 -14.4155 -10.0965 -10.0965 -10.0902 -10.0902 -5.9330 -5.9330 -5.8247 -5.8243 -5.4396 -5.4293 -5.3237 -5.2977 -3.7509 -3.7509 -3.7021 -3.7016 -3.5926 -3.5926 -3.5780 -3.5778 -2.8818 -2.8744 -2.7921 -2.7430 -1.6851 -1.6798 -1.0020 -0.9967 -0.9491 -0.9427 -0.7507 -0.7487 0.0641 0.0691 0.1015 0.1137 0.6805 0.6808 1.0131 1.0209 1.2169 1.2235 1.2725 1.2732 1.2982 1.3054 2.1090 2.1187 2.2210 2.2236 2.2326 2.2439 3.7105 3.7118 3.7482 3.7623 4.5761 4.5771 4.7712 4.7763 4.7930 4.7955 5.0337 5.0487 5.0531 5.0755 5.2485 5.2497 7.5341 7.5578 7.5673 7.6132 7.8853 7.9274 9.1796 9.1819 10.1957 10.1974 10.4257 10.4355 k = 0.3095 0.5361 0.2960 ( 6814 PWs) bands (ev): -64.4515 -64.4515 -37.3783 -37.3783 -28.8201 -28.8201 -28.8083 -28.8083 -16.7305 -16.7266 -16.6719 -16.6712 -15.2865 -15.2864 -14.7890 -14.7838 -14.6836 -14.6780 -14.4189 -14.4160 -10.0982 -10.0982 -10.0886 -10.0886 -5.9330 -5.9330 -5.8248 -5.8243 -5.4527 -5.4368 -5.3124 -5.2891 -3.7509 -3.7509 -3.7022 -3.7017 -3.5928 -3.5928 -3.5763 -3.5760 -2.8943 -2.8831 -2.7829 -2.7374 -1.6938 -1.6854 -1.0266 -1.0200 -0.9501 -0.9446 -0.7178 -0.7159 0.0597 0.0662 0.1099 0.1226 0.6881 0.6885 0.9654 0.9741 1.2103 1.2161 1.2959 1.3004 1.3176 1.3249 2.0860 2.0966 2.2240 2.2315 2.2509 2.2653 3.7080 3.7104 3.7564 3.7695 4.5786 4.5803 4.7667 4.7712 4.7926 4.7962 5.0273 5.0465 5.0485 5.0720 5.2564 5.2573 7.5161 7.5475 7.5707 7.6341 7.8745 7.9400 9.1764 9.1797 10.1950 10.1973 10.4355 10.4442 k = 0.3016 0.5224 0.2960 ( 6824 PWs) bands (ev): -64.4515 -64.4515 -37.3783 -37.3783 -28.8201 -28.8201 -28.8084 -28.8083 -16.7329 -16.7274 -16.6729 -16.6726 -15.2816 -15.2815 -14.7924 -14.7860 -14.6815 -14.6741 -14.4211 -14.4170 -10.1000 -10.1000 -10.0869 -10.0869 -5.9331 -5.9330 -5.8249 -5.8244 -5.4650 -5.4440 -5.3024 -5.2813 -3.7510 -3.7509 -3.7023 -3.7018 -3.5930 -3.5930 -3.5736 -3.5731 -2.9075 -2.8932 -2.7739 -2.7314 -1.7057 -1.6939 -1.0571 -1.0502 -0.9487 -0.9434 -0.6785 -0.6768 0.0561 0.0636 0.1189 0.1324 0.6991 0.6996 0.9134 0.9226 1.1962 1.2028 1.3246 1.3348 1.3401 1.3444 2.0658 2.0767 2.2254 2.2328 2.2747 2.2880 3.7047 3.7080 3.7678 3.7800 4.5817 4.5843 4.7611 4.7653 4.7919 4.7964 5.0177 5.0404 5.0456 5.0696 5.2657 5.2660 7.4965 7.5362 7.5744 7.6558 7.8636 7.9538 9.1722 9.1764 10.1946 10.1974 10.4484 10.4556 k = 0.2937 0.5086 0.2960 ( 6828 PWs) bands (ev): -64.4515 -64.4515 -37.3783 -37.3783 -28.8201 -28.8201 -28.8084 -28.8083 -16.7353 -16.7282 -16.6749 -16.6747 -15.2751 -15.2749 -14.7959 -14.7888 -14.6793 -14.6695 -14.4239 -14.4184 -10.1019 -10.1018 -10.0852 -10.0852 -5.9331 -5.9330 -5.8250 -5.8246 -5.4756 -5.4499 -5.2948 -5.2756 -3.7510 -3.7509 -3.7025 -3.7019 -3.5933 -3.5933 -3.5696 -3.5688 -2.9205 -2.9039 -2.7656 -2.7257 -1.7208 -1.7054 -1.0907 -1.0839 -0.9462 -0.9408 -0.6346 -0.6333 0.0534 0.0617 0.1279 0.1424 0.7136 0.7143 0.8602 0.8696 1.1769 1.1856 1.3491 1.3633 1.3705 1.3721 2.0491 2.0598 2.2261 2.2334 2.2977 2.3102 3.7009 3.7049 3.7819 3.7935 4.5853 4.5890 4.7547 4.7589 4.7908 4.7960 5.0062 5.0295 5.0456 5.0684 5.2751 5.2755 7.4757 7.5241 7.5785 7.6781 7.8531 7.9687 9.1672 9.1722 10.1948 10.1978 10.4637 10.4689 k = 0.2857 0.4949 0.2960 ( 6828 PWs) bands (ev): -64.4515 -64.4515 -37.3783 -37.3783 -28.8200 -28.8200 -28.8084 -28.8083 -16.7378 -16.7290 -16.6782 -16.6774 -15.2668 -15.2667 -14.7996 -14.7918 -14.6771 -14.6645 -14.4274 -14.4203 -10.1038 -10.1038 -10.0834 -10.0834 -5.9332 -5.9330 -5.8252 -5.8248 -5.4841 -5.4540 -5.2901 -5.2728 -3.7511 -3.7509 -3.7026 -3.7021 -3.5937 -3.5937 -3.5643 -3.5632 -2.9331 -2.9148 -2.7580 -2.7206 -1.7391 -1.7197 -1.1261 -1.1195 -0.9433 -0.9378 -0.5873 -0.5863 0.0515 0.0604 0.1364 0.1520 0.7313 0.7323 0.8075 0.8170 1.1541 1.1652 1.3692 1.3818 1.4066 1.4105 2.0360 2.0466 2.2265 2.2336 2.3195 2.3315 3.6971 3.7014 3.7985 3.8096 4.5889 4.5939 4.7478 4.7520 4.7893 4.7953 4.9935 5.0170 5.0461 5.0680 5.2838 5.2849 7.4540 7.5114 7.5828 7.7008 7.8434 7.9847 9.1615 9.1671 10.1958 10.1989 10.4808 10.4838 k = 0.2778 0.4811 0.2960 ( 6824 PWs) bands (ev): -64.4515 -64.4515 -37.3783 -37.3783 -28.8200 -28.8200 -28.8084 -28.8083 -16.7403 -16.7299 -16.6822 -16.6811 -15.2568 -15.2566 -14.8032 -14.7950 -14.6750 -14.6591 -14.4316 -14.4227 -10.1058 -10.1058 -10.0816 -10.0816 -5.9332 -5.9331 -5.8254 -5.8250 -5.4904 -5.4559 -5.2888 -5.2732 -3.7511 -3.7509 -3.7028 -3.7022 -3.5942 -3.5942 -3.5574 -3.5560 -2.9450 -2.9256 -2.7512 -2.7162 -1.7603 -1.7369 -1.1624 -1.1561 -0.9405 -0.9348 -0.5374 -0.5367 0.0502 0.0595 0.1441 0.1607 0.7482 0.7533 0.7603 0.7659 1.1289 1.1424 1.3879 1.3995 1.4445 1.4494 2.0264 2.0370 2.2266 2.2337 2.3402 2.3517 3.6933 3.6978 3.8172 3.8280 4.5921 4.5987 4.7404 4.7451 4.7877 4.7942 4.9804 5.0037 5.0469 5.0680 5.2916 5.2933 7.4317 7.4981 7.5876 7.7237 7.8347 8.0017 9.1552 9.1612 10.1980 10.2007 10.4992 10.4994 k = 0.2698 0.4674 0.2960 ( 6828 PWs) bands (ev): -64.4515 -64.4515 -37.3783 -37.3783 -28.8199 -28.8199 -28.8084 -28.8083 -16.7431 -16.7313 -16.6867 -16.6854 -15.2450 -15.2448 -14.8068 -14.7982 -14.6730 -14.6537 -14.4366 -14.4256 -10.1080 -10.1079 -10.0798 -10.0798 -5.9333 -5.9331 -5.8257 -5.8252 -5.4942 -5.4554 -5.2911 -5.2771 -3.7511 -3.7509 -3.7030 -3.7023 -3.5947 -3.5947 -3.5489 -3.5471 -2.9562 -2.9360 -2.7452 -2.7125 -1.7845 -1.7567 -1.1993 -1.1933 -0.9382 -0.9324 -0.4853 -0.4850 0.0493 0.0588 0.1507 0.1682 0.7063 0.7173 0.7768 0.7769 1.1025 1.1183 1.4059 1.4166 1.4830 1.4884 2.0203 2.0310 2.2266 2.2336 2.3595 2.3706 3.6897 3.6942 3.8378 3.8484 4.5943 4.6029 4.7330 4.7383 4.7859 4.7929 4.9672 4.9903 5.0479 5.0682 5.2980 5.3002 7.4089 7.4843 7.5928 7.7463 7.8276 8.0197 9.1482 9.1546 10.2012 10.2034 10.5156 10.5184 k = 0.2619 0.4536 0.2960 ( 6836 PWs) bands (ev): -64.4515 -64.4515 -37.3783 -37.3783 -28.8198 -28.8198 -28.8084 -28.8083 -16.7463 -16.7336 -16.6911 -16.6901 -15.2314 -15.2313 -14.8102 -14.8013 -14.6714 -14.6481 -14.4423 -14.4290 -10.1101 -10.1101 -10.0779 -10.0779 -5.9333 -5.9331 -5.8259 -5.8255 -5.4956 -5.4526 -5.2968 -5.2845 -3.7512 -3.7509 -3.7032 -3.7025 -3.5954 -3.5954 -3.5389 -3.5367 -2.9665 -2.9458 -2.7400 -2.7097 -1.8114 -1.7789 -1.2366 -1.2308 -0.9365 -0.9307 -0.4319 -0.4317 0.0484 0.0579 0.1558 0.1742 0.6612 0.6724 0.8015 0.8016 1.0769 1.0945 1.4232 1.4329 1.5215 1.5272 2.0173 2.0283 2.2267 2.2335 2.3775 2.3883 3.6864 3.6908 3.8601 3.8705 4.5951 4.6058 4.7259 4.7322 4.7838 4.7912 4.9544 4.9770 5.0491 5.0685 5.3029 5.3055 7.3861 7.4703 7.5984 7.7676 7.8233 8.0386 9.1408 9.1473 10.2057 10.2070 10.5318 10.5379 k = 0.2540 0.4399 0.2960 ( 6838 PWs) bands (ev): -64.4515 -64.4515 -37.3783 -37.3783 -28.8198 -28.8197 -28.8084 -28.8083 -16.7505 -16.7377 -16.6946 -16.6945 -15.2161 -15.2161 -14.8134 -14.8043 -14.6701 -14.6427 -14.4488 -14.4329 -10.1124 -10.1123 -10.0760 -10.0759 -5.9334 -5.9332 -5.8263 -5.8259 -5.4946 -5.4474 -5.3060 -5.2954 -3.7512 -3.7509 -3.7033 -3.7026 -3.5961 -3.5961 -3.5273 -3.5247 -2.9758 -2.9549 -2.7353 -2.7077 -1.8409 -1.8034 -1.2740 -1.2684 -0.9358 -0.9300 -0.3780 -0.3774 0.0473 0.0566 0.1592 0.1782 0.6205 0.6320 0.8254 0.8259 1.0547 1.0733 1.4400 1.4487 1.5598 1.5656 2.0171 2.0287 2.2270 2.2336 2.3942 2.4046 3.6835 3.6877 3.8839 3.8941 4.5939 4.6068 4.7197 4.7272 4.7816 4.7892 4.9421 4.9642 5.0504 5.0690 5.3061 5.3089 7.3634 7.4562 7.6046 7.7846 7.8245 8.0583 9.1329 9.1393 10.2112 10.2113 10.5477 10.5576 k = 0.2460 0.4261 0.2960 ( 6842 PWs) bands (ev): -64.4515 -64.4515 -37.3783 -37.3783 -28.8197 -28.8197 -28.8084 -28.8083 -16.7562 -16.7443 -16.6984 -16.6961 -15.1993 -15.1992 -14.8164 -14.8070 -14.6692 -14.6373 -14.4561 -14.4372 -10.1147 -10.1146 -10.0740 -10.0740 -5.9334 -5.9332 -5.8267 -5.8263 -5.4914 -5.4401 -5.3183 -5.3094 -3.7512 -3.7509 -3.7035 -3.7027 -3.5969 -3.5969 -3.5144 -3.5114 -2.9841 -2.9632 -2.7312 -2.7063 -1.8728 -1.8300 -1.3114 -1.3060 -0.9362 -0.9303 -0.3246 -0.3233 0.0461 0.0548 0.1604 0.1799 0.5855 0.5975 0.8445 0.8466 1.0402 1.0584 1.4564 1.4639 1.5977 1.6034 2.0195 2.0318 2.2278 2.2342 2.4094 2.4195 3.6809 3.6850 3.9089 3.9189 4.5901 4.6052 4.7150 4.7237 4.7792 4.7869 4.9306 4.9521 5.0517 5.0695 5.3075 5.3104 7.3411 7.4421 7.6112 7.7926 7.8360 8.0785 9.1247 9.1309 10.2162 10.2176 10.5632 10.5769 k = 0.2381 0.4124 0.2960 ( 6848 PWs) bands (ev): -64.4515 -64.4515 -37.3783 -37.3783 -28.8196 -28.8195 -28.8084 -28.8083 -16.7638 -16.7535 -16.7008 -16.6958 -15.1811 -15.1808 -14.8191 -14.8095 -14.6688 -14.6321 -14.4641 -14.4418 -10.1171 -10.1170 -10.0720 -10.0720 -5.9335 -5.9333 -5.8271 -5.8267 -5.4864 -5.4313 -5.3331 -5.3257 -3.7512 -3.7509 -3.7036 -3.7028 -3.5979 -3.5978 -3.5002 -3.4969 -2.9911 -2.9706 -2.7275 -2.7057 -1.9070 -1.8585 -1.3487 -1.3435 -0.9377 -0.9317 -0.2733 -0.2712 0.0454 0.0530 0.1591 0.1789 0.5572 0.5698 0.8542 0.8593 1.0388 1.0547 1.4722 1.4785 1.6349 1.6407 2.0239 2.0370 2.2293 2.2353 2.4233 2.4331 3.6787 3.6826 3.9349 3.9447 4.5837 4.6005 4.7122 4.7217 4.7765 4.7841 4.9203 4.9410 5.0530 5.0700 5.3070 5.3100 7.3195 7.4284 7.6183 7.7943 7.8550 8.0993 9.1163 9.1219 10.2215 10.2248 10.5781 10.5958 k = 0.2302 0.3986 0.2960 ( 6852 PWs) bands (ev): -64.4515 -64.4515 -37.3783 -37.3783 -28.8195 -28.8194 -28.8085 -28.8083 -16.7735 -16.7648 -16.7017 -16.6938 -15.1615 -15.1610 -14.8215 -14.8117 -14.6690 -14.6273 -14.4727 -14.4468 -10.1195 -10.1194 -10.0701 -10.0701 -5.9336 -5.9333 -5.8276 -5.8272 -5.4806 -5.4230 -5.3494 -5.3421 -3.7512 -3.7509 -3.7038 -3.7029 -3.5989 -3.5988 -3.4853 -3.4818 -2.9968 -2.9768 -2.7243 -2.7057 -1.9433 -1.8887 -1.3858 -1.3807 -0.9404 -0.9343 -0.2272 -0.2239 0.0471 0.0530 0.1548 0.1746 0.5366 0.5499 0.8523 0.8609 1.0532 1.0658 1.4876 1.4927 1.6715 1.6771 2.0301 2.0438 2.2318 2.2373 2.4357 2.4452 3.6769 3.6805 3.9616 3.9711 4.5746 4.5927 4.7112 4.7212 4.7736 4.7809 4.9112 4.9311 5.0543 5.0705 5.3048 5.3077 7.2988 7.4152 7.6258 7.7944 7.8763 8.1203 9.1079 9.1127 10.2269 10.2325 10.5921 10.6138 k = 0.2222 0.3849 0.2960 ( 6840 PWs) bands (ev): -64.4515 -64.4515 -37.3783 -37.3783 -28.8193 -28.8193 -28.8085 -28.8083 -16.7851 -16.7780 -16.7011 -16.6905 -15.1409 -15.1401 -14.8235 -14.8135 -14.6698 -14.6228 -14.4819 -14.4519 -10.1219 -10.1218 -10.0681 -10.0681 -5.9336 -5.9334 -5.8281 -5.8278 -5.4758 -5.4207 -5.3649 -5.3528 -3.7512 -3.7509 -3.7039 -3.7030 -3.6000 -3.5999 -3.4698 -3.4662 -3.0009 -2.9818 -2.7214 -2.7064 -1.9816 -1.9204 -1.4227 -1.4177 -0.9443 -0.9378 -0.1913 -0.1863 0.0554 0.0588 0.1473 0.1668 0.5244 0.5384 0.8421 0.8533 1.0805 1.0901 1.5027 1.5064 1.7072 1.7127 2.0375 2.0518 2.2357 2.2404 2.4468 2.4560 3.6753 3.6787 3.9889 3.9981 4.5633 4.5820 4.7118 4.7218 4.7702 4.7771 4.9035 4.9224 5.0555 5.0710 5.3009 5.3036 7.2793 7.4028 7.6337 7.7947 7.8979 8.1413 9.0995 9.1034 10.2321 10.2404 10.6051 10.6307 k = 0.2143 0.3712 0.2960 ( 6852 PWs) bands (ev): -64.4515 -64.4515 -37.3783 -37.3783 -28.8192 -28.8192 -28.8085 -28.8083 -16.7983 -16.7925 -16.6990 -16.6860 -15.1194 -15.1183 -14.8251 -14.8148 -14.6712 -14.6189 -14.4916 -14.4571 -10.1244 -10.1243 -10.0661 -10.0661 -5.9337 -5.9334 -5.8287 -5.8284 -5.4763 -5.4324 -5.3751 -5.3496 -3.7512 -3.7508 -3.7040 -3.7031 -3.6012 -3.6011 -3.4542 -3.4507 -3.0033 -2.9853 -2.7189 -2.7077 -2.0218 -1.9536 -1.4592 -1.4543 -0.9492 -0.9424 -0.1711 -0.1642 0.0750 0.0753 0.1366 0.1555 0.5208 0.5356 0.8288 0.8411 1.1157 1.1233 1.5174 1.5199 1.7421 1.7474 2.0458 2.0604 2.2411 2.2448 2.4565 2.4654 3.6740 3.6772 4.0163 4.0251 4.5501 4.5690 4.7133 4.7231 4.7666 4.7727 4.8974 4.9151 5.0566 5.0713 5.2954 5.2980 7.2611 7.3913 7.6420 7.7958 7.9188 8.1621 9.0915 9.0940 10.2367 10.2481 10.6168 10.6461 k = 0.2063 0.3574 0.2960 ( 6840 PWs) bands (ev): -64.4515 -64.4515 -37.3782 -37.3782 -28.8190 -28.8190 -28.8085 -28.8083 -16.8129 -16.8081 -16.6957 -16.6806 -15.0973 -15.0957 -14.8262 -14.8156 -14.6733 -14.6157 -14.5014 -14.4623 -10.1270 -10.1269 -10.0641 -10.0641 -5.9338 -5.9335 -5.8293 -5.8290 -5.4867 -5.4560 -5.3752 -5.3343 -3.7512 -3.7508 -3.7041 -3.7032 -3.6024 -3.6024 -3.4391 -3.4358 -3.0037 -2.9871 -2.7167 -2.7096 -2.0637 -1.9879 -1.4954 -1.4906 -0.9551 -0.9477 -0.1685 -0.1603 0.1016 0.1019 0.1282 0.1444 0.5257 0.5413 0.8160 0.8281 1.1555 1.1619 1.5318 1.5331 1.7760 1.7811 2.0547 2.0692 2.2484 2.2509 2.4648 2.4734 3.6728 3.6759 4.0438 4.0522 4.5355 4.5543 4.7152 4.7247 4.7625 4.7679 4.8927 4.9093 5.0575 5.0716 5.2886 5.2909 7.2443 7.3811 7.6505 7.7978 7.9388 8.1825 9.0840 9.0849 10.2406 10.2556 10.6268 10.6595 k = 0.1984 0.3437 0.2960 ( 6836 PWs) bands (ev): -64.4515 -64.4515 -37.3782 -37.3782 -28.8189 -28.8188 -28.8085 -28.8083 -16.8285 -16.8245 -16.6914 -16.6744 -15.0750 -15.0727 -14.8267 -14.8158 -14.6761 -14.6135 -14.5110 -14.4674 -10.1295 -10.1294 -10.0621 -10.0621 -5.9338 -5.9336 -5.8299 -5.8296 -5.5073 -5.4856 -5.3644 -5.3124 -3.7511 -3.7508 -3.7042 -3.7034 -3.6038 -3.6037 -3.4248 -3.4219 -3.0018 -2.9871 -2.7149 -2.7121 -2.1070 -2.0233 -1.5310 -1.5263 -0.9618 -0.9537 -0.1802 -0.1717 0.0951 0.1056 0.1599 0.1623 0.5388 0.5551 0.8054 0.8166 1.1976 1.2033 1.5461 1.5462 1.8088 1.8136 2.0638 2.0780 2.2578 2.2588 2.4717 2.4801 3.6717 3.6746 4.0710 4.0789 4.5199 4.5385 4.7171 4.7262 4.7580 4.7626 4.8895 4.9049 5.0583 5.0718 5.2808 5.2828 7.2293 7.3722 7.6593 7.8006 7.9571 8.2019 9.0763 9.0772 10.2434 10.2623 10.6348 10.6706 k = 0.1905 0.3299 0.2960 ( 6844 PWs) bands (ev): -64.4515 -64.4515 -37.3782 -37.3782 -28.8187 -28.8187 -28.8085 -28.8083 -16.8448 -16.8415 -16.6862 -16.6676 -15.0526 -15.0496 -14.8266 -14.8151 -14.6795 -14.6129 -14.5201 -14.4723 -10.1321 -10.1320 -10.0601 -10.0601 -5.9339 -5.9336 -5.8306 -5.8304 -5.5348 -5.5186 -5.3458 -5.2863 -3.7511 -3.7507 -3.7043 -3.7035 -3.6051 -3.6050 -3.4118 -3.4096 -2.9976 -2.9852 -2.7151 -2.7134 -2.1517 -2.0595 -1.5662 -1.5614 -0.9690 -0.9602 -0.2013 -0.1929 0.0721 0.0834 0.2084 0.2093 0.5597 0.5767 0.7980 0.8077 1.2408 1.2460 1.5592 1.5602 1.8405 1.8450 2.0730 2.0866 2.2687 2.2694 2.4773 2.4854 3.6704 3.6732 4.0976 4.1050 4.5039 4.5220 4.7187 4.7274 4.7532 4.7570 4.8876 4.9019 5.0589 5.0718 5.2722 5.2738 7.2161 7.3648 7.6681 7.8042 7.9736 8.2202 9.0684 9.0713 10.2450 10.2682 10.6404 10.6789 k = 0.1825 0.3162 0.2960 ( 6832 PWs) bands (ev): -64.4515 -64.4515 -37.3782 -37.3782 -28.8185 -28.8185 -28.8086 -28.8083 -16.8617 -16.8590 -16.6802 -16.6602 -15.0308 -15.0267 -14.8257 -14.8135 -14.6836 -14.6143 -14.5278 -14.4769 -10.1346 -10.1345 -10.0581 -10.0581 -5.9339 -5.9337 -5.8314 -5.8311 -5.5664 -5.5538 -5.3219 -5.2569 -3.7510 -3.7507 -3.7044 -3.7036 -3.6066 -3.6065 -3.4005 -3.3991 -2.9909 -2.9814 -2.7187 -2.7126 -2.1973 -2.0963 -1.6006 -1.5959 -0.9766 -0.9669 -0.2281 -0.2200 0.0441 0.0543 0.2598 0.2619 0.5880 0.6056 0.7941 0.8021 1.2839 1.2890 1.5722 1.5743 1.8709 1.8752 2.0823 2.0949 2.2806 2.2831 2.4816 2.4895 3.6688 3.6715 4.1234 4.1304 4.4876 4.5052 4.7197 4.7279 4.7481 4.7511 4.8868 4.9000 5.0593 5.0718 5.2632 5.2645 7.2048 7.3592 7.6770 7.8085 7.9879 8.2369 9.0615 9.0667 10.2452 10.2731 10.6432 10.6839 k = 0.1746 0.3024 0.2960 ( 6832 PWs) bands (ev): -64.4515 -64.4515 -37.3782 -37.3782 -28.8183 -28.8183 -28.8086 -28.8083 -16.8790 -16.8767 -16.6735 -16.6522 -15.0098 -15.0047 -14.8240 -14.8107 -14.6880 -14.6183 -14.5336 -14.4810 -10.1372 -10.1371 -10.0562 -10.0562 -5.9340 -5.9338 -5.8322 -5.8319 -5.6005 -5.5904 -5.2941 -5.2248 -3.7510 -3.7507 -3.7045 -3.7038 -3.6081 -3.6079 -3.3912 -3.3908 -2.9817 -2.9759 -2.7228 -2.7124 -2.2436 -2.1335 -1.6344 -1.6297 -0.9844 -0.9737 -0.2583 -0.2506 0.0124 0.0210 0.3121 0.3147 0.6233 0.6413 0.7935 0.7997 1.3263 1.3314 1.5852 1.5884 1.9001 1.9040 2.0917 2.1032 2.2943 2.2988 2.4846 2.4923 3.6668 3.6695 4.1483 4.1547 4.4716 4.4884 4.7199 4.7277 4.7428 4.7452 4.8866 4.8989 5.0595 5.0715 5.2542 5.2552 7.1957 7.3553 7.6858 7.8135 7.9995 8.2516 9.0560 9.0634 10.2441 10.2768 10.6428 10.6854 k = 0.1667 0.2887 0.2960 ( 6830 PWs) bands (ev): -64.4515 -64.4515 -37.3782 -37.3782 -28.8181 -28.8181 -28.8086 -28.8083 -16.8964 -16.8945 -16.6662 -16.6438 -14.9904 -14.9839 -14.8213 -14.8062 -14.6925 -14.6252 -14.5372 -14.4847 -10.1397 -10.1396 -10.0543 -10.0543 -5.9341 -5.9338 -5.8330 -5.8327 -5.6362 -5.6280 -5.2630 -5.1900 -3.7509 -3.7506 -3.7046 -3.7040 -3.6096 -3.6094 -3.3847 -3.3841 -2.9704 -2.9691 -2.7271 -2.7133 -2.2899 -2.1708 -1.6673 -1.6626 -0.9921 -0.9804 -0.2903 -0.2831 -0.0224 -0.0153 0.3632 0.3661 0.6653 0.6833 0.7960 0.8003 1.3672 1.3723 1.5984 1.6025 1.9280 1.9315 2.1014 2.1118 2.3098 2.3160 2.4864 2.4939 3.6641 3.6669 4.1720 4.1779 4.4561 4.4721 4.7192 4.7266 4.7374 4.7393 4.8868 4.8984 5.0596 5.0711 5.2458 5.2465 7.1886 7.3532 7.6944 7.8190 8.0083 8.2639 9.0519 9.0617 10.2416 10.2793 10.6392 10.6832 k = 0.1587 0.2749 0.2960 ( 6834 PWs) bands (ev): -64.4515 -64.4515 -37.3782 -37.3781 -28.8180 -28.8179 -28.8086 -28.8084 -16.9139 -16.9124 -16.6583 -16.6350 -14.9729 -14.9650 -14.8176 -14.7998 -14.6967 -14.6349 -14.5385 -14.4879 -10.1422 -10.1421 -10.0524 -10.0524 -5.9342 -5.9339 -5.8339 -5.8336 -5.6729 -5.6661 -5.2289 -5.1529 -3.7508 -3.7506 -3.7047 -3.7041 -3.6111 -3.6109 -3.3807 -3.3791 -2.9617 -2.9572 -2.7315 -2.7157 -2.3356 -2.2077 -1.6994 -1.6947 -0.9996 -0.9868 -0.3231 -0.3164 -0.0597 -0.0541 0.4124 0.4151 0.7132 0.7306 0.8016 0.8039 1.4061 1.4113 1.6116 1.6166 1.9544 1.9576 2.1118 2.1211 2.3268 2.3346 2.4870 2.4943 3.6606 3.6635 4.1943 4.1997 4.4414 4.4564 4.7176 4.7245 4.7319 4.7334 4.8871 4.8979 5.0595 5.0705 5.2385 5.2388 7.1838 7.3529 7.7028 7.8248 8.0140 8.2735 9.0495 9.0615 10.2379 10.2807 10.6325 10.6774 k = 0.1508 0.2612 0.2960 ( 6836 PWs) bands (ev): -64.4515 -64.4515 -37.3782 -37.3781 -28.8178 -28.8177 -28.8086 -28.8084 -16.9314 -16.9301 -16.6499 -16.6259 -14.9578 -14.9484 -14.8134 -14.7912 -14.7000 -14.6468 -14.5379 -14.4905 -10.1447 -10.1446 -10.0505 -10.0505 -5.9342 -5.9340 -5.8350 -5.8347 -5.7099 -5.7044 -5.1922 -5.1136 -3.7508 -3.7506 -3.7048 -3.7043 -3.6127 -3.6124 -3.3788 -3.3762 -2.9549 -2.9428 -2.7355 -2.7203 -2.3796 -2.2440 -1.7304 -1.7258 -1.0065 -0.9926 -0.3561 -0.3499 -0.0989 -0.0947 0.4592 0.4616 0.7654 0.7795 0.8107 0.8126 1.4423 1.4477 1.6249 1.6308 1.9793 1.9821 2.1233 2.1314 2.3450 2.3542 2.4864 2.4935 3.6562 3.6592 4.2153 4.2202 4.4279 4.4419 4.7148 4.7213 4.7263 4.7277 4.8869 4.8971 5.0592 5.0698 5.2328 5.2329 7.1812 7.3546 7.7109 7.8310 8.0165 8.2801 9.0490 9.0629 10.2332 10.2810 10.6228 10.6683 k = 0.1429 0.2474 0.2960 ( 6824 PWs) bands (ev): -64.4515 -64.4515 -37.3781 -37.3781 -28.8176 -28.8175 -28.8087 -28.8084 -16.9486 -16.9475 -16.6410 -16.6166 -14.9454 -14.9346 -14.8094 -14.7803 -14.7013 -14.6602 -14.5361 -14.4926 -10.1471 -10.1470 -10.0488 -10.0488 -5.9344 -5.9341 -5.8363 -5.8359 -5.7468 -5.7423 -5.1531 -5.0722 -3.7507 -3.7505 -3.7049 -3.7045 -3.6142 -3.6139 -3.3787 -3.3752 -2.9500 -2.9281 -2.7383 -2.7278 -2.4204 -2.2792 -1.7604 -1.7559 -1.0127 -0.9977 -0.3889 -0.3831 -0.1395 -0.1364 0.5038 0.5057 0.8085 0.8086 0.8327 0.8493 1.4755 1.4810 1.6382 1.6447 2.0027 2.0051 2.1361 2.1432 2.3640 2.3745 2.4848 2.4918 3.6506 3.6538 4.2347 4.2392 4.4159 4.4287 4.7109 4.7167 4.7207 4.7222 4.8858 4.8954 5.0588 5.0689 5.2293 5.2294 7.1809 7.3581 7.7186 7.8375 8.0158 8.2836 9.0502 9.0657 10.2278 10.2805 10.6107 10.6564 k = 0.1349 0.2337 0.2960 ( 6828 PWs) bands (ev): -64.4515 -64.4515 -37.3781 -37.3781 -28.8174 -28.8173 -28.8087 -28.8084 -16.9654 -16.9646 -16.6319 -16.6070 -14.9357 -14.9236 -14.8067 -14.7673 -14.6997 -14.6745 -14.5332 -14.4942 -10.1495 -10.1494 -10.0470 -10.0470 -5.9345 -5.9343 -5.8383 -5.8378 -5.7829 -5.7790 -5.1117 -5.0290 -3.7506 -3.7505 -3.7050 -3.7047 -3.6157 -3.6154 -3.3801 -3.3758 -2.9487 -2.9143 -2.7391 -2.7391 -2.4563 -2.3128 -1.7892 -1.7848 -1.0180 -1.0020 -0.4209 -0.4156 -0.1809 -0.1789 0.5462 0.5477 0.8210 0.8222 0.8890 0.9069 1.5055 1.5111 1.6513 1.6584 2.0244 2.0264 2.1504 2.1566 2.3837 2.3951 2.4822 2.4890 3.6438 3.6472 4.2527 4.2568 4.4056 4.4172 4.7057 4.7107 4.7151 4.7169 4.8835 4.8925 5.0582 5.0679 5.2283 5.2285 7.1829 7.3635 7.7257 7.8440 8.0119 8.2838 9.0532 9.0699 10.2220 10.2794 10.5965 10.6421 k = 0.1270 0.2199 0.2960 ( 6814 PWs) bands (ev): -64.4515 -64.4515 -37.3781 -37.3781 -28.8172 -28.8171 -28.8087 -28.8084 -16.9818 -16.9811 -16.6224 -16.5974 -14.9284 -14.9151 -14.8062 -14.7531 -14.6944 -14.6890 -14.5296 -14.4951 -10.1518 -10.1517 -10.0453 -10.0453 -5.9347 -5.9345 -5.8433 -5.8428 -5.8151 -5.8120 -5.0683 -4.9842 -3.7505 -3.7505 -3.7051 -3.7049 -3.6173 -3.6169 -3.3827 -3.3778 -2.9527 -2.9038 -2.7538 -2.7369 -2.4855 -2.3443 -1.8168 -1.8124 -1.0222 -1.0053 -0.4521 -0.4472 -0.2228 -0.2218 0.5869 0.5878 0.8323 0.8328 0.9516 0.9687 1.5322 1.5377 1.6639 1.6713 2.0443 2.0460 2.1666 2.1718 2.4037 2.4158 2.4788 2.4854 3.6357 3.6393 4.2692 4.2730 4.3972 4.4076 4.6993 4.7036 4.7094 4.7114 4.8797 4.8880 5.0574 5.0667 5.2304 5.2306 7.1872 7.3705 7.7324 7.8505 8.0050 8.2809 9.0577 9.0750 10.2162 10.2779 10.5808 10.6260 k = 0.1190 0.2062 0.2960 ( 6830 PWs) bands (ev): -64.4515 -64.4515 -37.3781 -37.3781 -28.8170 -28.8170 -28.8087 -28.8085 -16.9977 -16.9972 -16.6128 -16.5879 -14.9230 -14.9087 -14.8084 -14.7400 -14.7017 -14.6857 -14.5255 -14.4955 -10.1540 -10.1539 -10.0437 -10.0437 -5.9351 -5.9350 -5.8632 -5.8625 -5.8310 -5.8297 -5.0230 -4.9378 -3.7505 -3.7504 -3.7052 -3.7051 -3.6187 -3.6184 -3.3863 -3.3808 -2.9633 -2.9007 -2.7691 -2.7313 -2.5070 -2.3733 -1.8430 -1.8388 -1.0252 -1.0075 -0.4822 -0.4777 -0.2648 -0.2646 0.6258 0.6262 0.8438 0.8438 1.0159 1.0324 1.5557 1.5611 1.6758 1.6833 2.0624 2.0637 2.1845 2.1889 2.4236 2.4364 2.4747 2.4809 3.6262 3.6300 4.2844 4.2879 4.3909 4.4000 4.6917 4.6955 4.7035 4.7055 4.8744 4.8819 5.0565 5.0653 5.2356 5.2357 7.1936 7.3791 7.7384 7.8568 7.9955 8.2749 9.0633 9.0807 10.2106 10.2762 10.5640 10.6086 k = 0.1111 0.1925 0.2960 ( 6838 PWs) bands (ev): -64.4515 -64.4515 -37.3781 -37.3781 -28.8168 -28.8168 -28.8088 -28.8085 -17.0130 -17.0125 -16.6031 -16.5784 -14.9193 -14.9041 -14.8128 -14.7363 -14.7045 -14.6742 -14.5208 -14.4954 -10.1561 -10.1560 -10.0422 -10.0422 -5.9360 -5.9360 -5.8942 -5.8933 -5.8346 -5.8341 -4.9761 -4.8903 -3.7504 -3.7503 -3.7054 -3.7053 -3.6202 -3.6198 -3.3906 -3.3847 -2.9806 -2.9112 -2.7788 -2.7227 -2.5209 -2.3995 -1.8679 -1.8638 -1.0268 -1.0084 -0.5110 -0.5070 -0.3072 -0.3066 0.6631 0.6631 0.8552 0.8556 1.0810 1.0967 1.5764 1.5815 1.6867 1.6940 2.0785 2.0794 2.2041 2.2077 2.4430 2.4566 2.4703 2.4759 3.6154 3.6194 4.2984 4.3018 4.3869 4.3946 4.6830 4.6864 4.6972 4.6990 4.8677 4.8744 5.0554 5.0638 5.2437 5.2438 7.2022 7.3891 7.7438 7.8625 7.9840 8.2662 9.0696 9.0868 10.2059 10.2748 10.5466 10.5903 k = 0.1032 0.1787 0.2960 ( 6838 PWs) bands (ev): -64.4515 -64.4515 -37.3781 -37.3781 -28.8166 -28.8166 -28.8088 -28.8086 -17.0275 -17.0271 -16.5933 -16.5691 -14.9169 -14.9006 -14.8188 -14.7466 -14.6934 -14.6612 -14.5158 -14.4946 -10.1581 -10.1580 -10.0407 -10.0407 -5.9411 -5.9406 -5.9218 -5.9216 -5.8362 -5.8359 -4.9277 -4.8417 -3.7504 -3.7501 -3.7055 -3.7055 -3.6216 -3.6211 -3.3953 -3.3892 -3.0045 -2.9381 -2.7789 -2.7116 -2.5284 -2.4224 -1.8912 -1.8873 -1.0270 -1.0080 -0.5384 -0.5348 -0.3492 -0.3479 0.6985 0.6989 0.8669 0.8675 1.1460 1.1610 1.5946 1.5992 1.6961 1.7032 2.0924 2.0931 2.2250 2.2278 2.4577 2.4695 2.4698 2.4771 3.6035 3.6076 4.3115 4.3146 4.3851 4.3915 4.6734 4.6763 4.6903 4.6920 4.8599 4.8657 5.0542 5.0621 5.2544 5.2544 7.2129 7.4003 7.7485 7.8672 7.9714 8.2550 9.0763 9.0927 10.2022 10.2739 10.5290 10.5715 k = 0.0952 0.1650 0.2960 ( 6846 PWs) bands (ev): -64.4515 -64.4515 -37.3781 -37.3781 -28.8165 -28.8165 -28.8088 -28.8086 -17.0412 -17.0410 -16.5836 -16.5601 -14.9154 -14.8981 -14.8256 -14.7611 -14.6785 -14.6476 -14.5103 -14.4932 -10.1600 -10.1599 -10.0394 -10.0394 -5.9635 -5.9628 -5.9312 -5.9309 -5.8372 -5.8371 -4.8782 -4.7925 -3.7503 -3.7499 -3.7057 -3.7056 -3.6229 -3.6224 -3.4003 -3.3940 -3.0340 -2.9775 -2.7720 -2.6993 -2.5310 -2.4420 -1.9130 -1.9093 -1.0256 -1.0063 -0.5643 -0.5612 -0.3905 -0.3885 0.7323 0.7330 0.8786 0.8793 1.2103 1.2246 1.6106 1.6147 1.7041 1.7107 2.1041 2.1045 2.2467 2.2489 2.4561 2.4639 2.4847 2.4958 3.5905 3.5947 4.3237 4.3267 4.3855 4.3907 4.6628 4.6652 4.6827 4.6842 4.8513 4.8562 5.0529 5.0604 5.2671 5.2672 7.2255 7.4124 7.7524 7.8699 7.9589 8.2418 9.0829 9.0982 10.1999 10.2736 10.5115 10.5524 k = 0.0873 0.1512 0.2960 ( 6842 PWs) bands (ev): -64.4515 -64.4515 -37.3781 -37.3780 -28.8163 -28.8163 -28.8088 -28.8086 -17.0541 -17.0539 -16.5741 -16.5515 -14.9146 -14.8963 -14.8328 -14.7763 -14.6634 -14.6342 -14.5045 -14.4911 -10.1618 -10.1618 -10.0381 -10.0381 -5.9921 -5.9916 -5.9327 -5.9324 -5.8381 -5.8380 -4.8278 -4.7430 -3.7502 -3.7497 -3.7058 -3.7058 -3.6242 -3.6237 -3.4055 -3.3991 -3.0682 -3.0243 -2.7618 -2.6868 -2.5299 -2.4583 -1.9331 -1.9297 -1.0226 -1.0031 -0.5885 -0.5859 -0.4308 -0.4282 0.7644 0.7653 0.8903 0.8910 1.2734 1.2871 1.6247 1.6284 1.7105 1.7166 2.1133 2.1136 2.2689 2.2705 2.4507 2.4577 2.5026 2.5139 3.5768 3.5810 4.3354 4.3383 4.3879 4.3921 4.6512 4.6533 4.6743 4.6756 4.8423 4.8463 5.0516 5.0585 5.2814 5.2815 7.2400 7.4252 7.7555 7.8689 7.9488 8.2268 9.0890 9.1029 10.1994 10.2743 10.4942 10.5333 k = 0.0794 0.1375 0.2960 ( 6852 PWs) bands (ev): -64.4515 -64.4515 -37.3780 -37.3780 -28.8162 -28.8162 -28.8088 -28.8086 -17.0660 -17.0659 -16.5648 -16.5433 -14.9144 -14.8950 -14.8399 -14.7914 -14.6492 -14.6217 -14.4984 -14.4883 -10.1635 -10.1634 -10.0369 -10.0369 -6.0197 -6.0194 -5.9332 -5.9330 -5.8388 -5.8387 -4.7769 -4.6937 -3.7501 -3.7495 -3.7060 -3.7059 -3.6254 -3.6248 -3.4106 -3.4042 -3.1060 -3.0748 -2.7504 -2.6749 -2.5264 -2.4711 -1.9516 -1.9484 -1.0180 -0.9986 -0.6111 -0.6088 -0.4699 -0.4667 0.7945 0.7956 0.9018 0.9025 1.3349 1.3478 1.6372 1.6403 1.7155 1.7210 2.1199 2.1201 2.2909 2.2920 2.4450 2.4516 2.5202 2.5312 3.5626 3.5667 4.3468 4.3495 4.3923 4.3954 4.6389 4.6405 4.6652 4.6663 4.8334 4.8366 5.0502 5.0566 5.2966 5.2968 7.2561 7.4382 7.7579 7.8624 7.9434 8.2104 9.0944 9.1067 10.2008 10.2761 10.4776 10.5144 k = 0.0714 0.1237 0.2960 ( 6846 PWs) bands (ev): -64.4515 -64.4515 -37.3780 -37.3780 -28.8160 -28.8160 -28.8088 -28.8087 -17.0770 -17.0769 -16.5559 -16.5358 -14.9145 -14.8941 -14.8466 -14.8060 -14.6362 -14.6106 -14.4921 -14.4848 -10.1651 -10.1650 -10.0358 -10.0358 -6.0455 -6.0454 -5.9334 -5.9332 -5.8394 -5.8394 -4.7258 -4.6449 -3.7499 -3.7492 -3.7062 -3.7060 -3.6265 -3.6259 -3.4157 -3.4092 -3.1466 -3.1269 -2.7391 -2.6646 -2.5213 -2.4806 -1.9683 -1.9654 -1.0118 -0.9926 -0.6318 -0.6300 -0.5076 -0.5038 0.8224 0.8236 0.9131 0.9136 1.3942 1.4064 1.6483 1.6509 1.7191 1.7240 2.1239 2.1240 2.3122 2.3130 2.4394 2.4456 2.5368 2.5473 3.5483 3.5522 4.3581 4.3606 4.3982 4.4006 4.6257 4.6269 4.6552 4.6561 4.8248 4.8273 5.0487 5.0546 5.3123 5.3125 7.2738 7.4510 7.7594 7.8503 7.9432 8.1930 9.0988 9.1094 10.2043 10.2789 10.4617 10.4958 k = 0.0635 0.1100 0.2960 ( 6846 PWs) bands (ev): -64.4515 -64.4515 -37.3780 -37.3780 -28.8159 -28.8159 -28.8088 -28.8087 -17.0870 -17.0869 -16.5474 -16.5289 -14.9149 -14.8935 -14.8528 -14.8199 -14.6246 -14.6010 -14.4856 -14.4807 -10.1664 -10.1664 -10.0348 -10.0348 -6.0692 -6.0691 -5.9336 -5.9334 -5.8400 -5.8400 -4.6752 -4.5975 -3.7496 -3.7488 -3.7063 -3.7062 -3.6275 -3.6269 -3.4205 -3.4140 -3.1887 -3.1789 -2.7282 -2.6564 -2.5152 -2.4869 -1.9833 -1.9807 -1.0041 -0.9853 -0.6506 -0.6493 -0.5437 -0.5394 0.8479 0.8491 0.9239 0.9243 1.4509 1.4623 1.6581 1.6602 1.7216 1.7258 2.1250 2.1253 2.3323 2.3329 2.4343 2.4400 2.5524 2.5621 3.5341 3.5379 4.3697 4.3718 4.4054 4.4072 4.6119 4.6127 4.6446 4.6452 4.8169 4.8187 5.0473 5.0526 5.3279 5.3281 7.2928 7.4632 7.7600 7.8344 7.9472 8.1750 9.1021 9.1110 10.2098 10.2828 10.4466 10.4776 k = 0.0556 0.0962 0.2960 ( 6850 PWs) bands (ev): -64.4515 -64.4515 -37.3780 -37.3780 -28.8158 -28.8158 -28.8088 -28.8087 -17.0959 -17.0958 -16.5395 -16.5227 -14.9155 -14.8932 -14.8582 -14.8328 -14.6145 -14.5932 -14.4793 -14.4761 -10.1677 -10.1676 -10.0339 -10.0339 -6.0905 -6.0904 -5.9337 -5.9335 -5.8405 -5.8405 -4.6255 -4.5522 -3.7492 -3.7484 -3.7065 -3.7063 -3.6284 -3.6278 -3.4251 -3.4185 -3.2314 -3.2295 -2.7179 -2.6506 -2.5087 -2.4902 -1.9965 -1.9942 -0.9949 -0.9768 -0.6675 -0.6666 -0.5779 -0.5733 0.8704 0.8717 0.9344 0.9346 1.5044 1.5149 1.6667 1.6684 1.7232 1.7268 2.1235 2.1238 2.3509 2.3512 2.4299 2.4349 2.5667 2.5755 3.5206 3.5240 4.3816 4.3834 4.4136 4.4149 4.5974 4.5978 4.6334 4.6339 4.8098 4.8110 5.0460 5.0507 5.3428 5.3430 7.3129 7.4740 7.7598 7.8169 7.9538 8.1566 9.1044 9.1116 10.2173 10.2876 10.4326 10.4597 k = 0.0476 0.0825 0.2960 ( 6842 PWs) bands (ev): -64.4515 -64.4515 -37.3780 -37.3780 -28.8157 -28.8157 -28.8088 -28.8087 -17.1036 -17.1036 -16.5322 -16.5174 -14.9159 -14.8932 -14.8629 -14.8445 -14.6058 -14.5870 -14.4732 -14.4713 -10.1688 -10.1687 -10.0332 -10.0332 -6.1093 -6.1092 -5.9338 -5.9336 -5.8409 -5.8409 -4.5776 -4.5098 -3.7487 -3.7479 -3.7066 -3.7065 -3.6293 -3.6286 -3.4294 -3.4228 -3.2772 -3.2735 -2.7084 -2.6474 -2.5024 -2.4911 -2.0080 -2.0059 -0.9845 -0.9674 -0.6823 -0.6820 -0.6099 -0.6050 0.8899 0.8911 0.9444 0.9445 1.5542 1.5638 1.6743 1.6755 1.7241 1.7270 2.1194 2.1200 2.3674 2.3677 2.4263 2.4306 2.5796 2.5874 3.5080 3.5111 4.3940 4.3954 4.4225 4.4233 4.5825 4.5826 4.6219 4.6222 4.8036 4.8044 5.0448 5.0489 5.3567 5.3568 7.3338 7.4827 7.7589 7.7995 7.9622 8.1381 9.1058 9.1115 10.2266 10.2930 10.4196 10.4424 k = 0.0397 0.0687 0.2960 ( 6846 PWs) bands (ev): -64.4515 -64.4515 -37.3780 -37.3780 -28.8156 -28.8156 -28.8088 -28.8088 -17.1103 -17.1103 -16.5257 -16.5130 -14.9160 -14.8938 -14.8668 -14.8548 -14.5984 -14.5824 -14.4676 -14.4665 -10.1697 -10.1697 -10.0325 -10.0325 -6.1254 -6.1252 -5.9338 -5.9337 -5.8413 -5.8413 -4.5324 -4.4717 -3.7481 -3.7473 -3.7067 -3.7066 -3.6300 -3.6293 -3.4337 -3.4267 -3.3206 -3.3135 -2.6995 -2.6465 -2.4965 -2.4902 -2.0176 -2.0158 -0.9731 -0.9573 -0.6953 -0.6950 -0.6392 -0.6343 0.9059 0.9070 0.9540 0.9540 1.5995 1.6080 1.6808 1.6816 1.7244 1.7266 2.1133 2.1140 2.3815 2.3819 2.4236 2.4271 2.5909 2.5977 3.4966 3.4993 4.4069 4.4080 4.4317 4.4322 4.5670 4.5672 4.6104 4.6106 4.7984 4.7989 5.0437 5.0471 5.3691 5.3692 7.3553 7.4886 7.7572 7.7834 7.9719 8.1196 9.1064 9.1107 10.2375 10.2985 10.4079 10.4256 k = 0.0317 0.0550 0.2960 ( 6842 PWs) bands (ev): -64.4515 -64.4515 -37.3780 -37.3780 -28.8155 -28.8155 -28.8088 -28.8088 -17.1157 -17.1157 -16.5199 -16.5096 -14.9158 -14.8950 -14.8699 -14.8632 -14.5922 -14.5793 -14.4626 -14.4621 -10.1705 -10.1705 -10.0319 -10.0319 -6.1387 -6.1385 -5.9339 -5.9338 -5.8416 -5.8416 -4.4909 -4.4390 -3.7474 -3.7467 -3.7068 -3.7067 -3.6306 -3.6300 -3.4380 -3.4305 -3.3579 -3.3500 -2.6912 -2.6475 -2.4913 -2.4883 -2.0254 -2.0240 -0.9613 -0.9472 -0.7065 -0.7056 -0.6651 -0.6607 0.9185 0.9194 0.9628 0.9628 1.6395 1.6468 1.6862 1.6868 1.7244 1.7259 2.1057 2.1066 2.3929 2.3935 2.4221 2.4246 2.6006 2.6061 3.4869 3.4891 4.4203 4.4210 4.4407 4.4411 4.5514 4.5517 4.5994 4.5995 4.7941 4.7944 5.0428 5.0456 5.3797 5.3798 7.3771 7.4909 7.7550 7.7697 7.9827 8.1016 9.1064 9.1096 10.2496 10.3036 10.3975 10.4098 k = 0.0238 0.0412 0.2960 ( 6858 PWs) bands (ev): -64.4515 -64.4515 -37.3780 -37.3780 -28.8155 -28.8155 -28.8089 -28.8088 -17.1200 -17.1200 -16.5151 -16.5072 -14.9149 -14.8971 -14.8724 -14.8695 -14.5872 -14.5774 -14.4586 -14.4584 -10.1711 -10.1711 -10.0315 -10.0315 -6.1491 -6.1490 -5.9339 -5.9338 -5.8418 -5.8418 -4.4545 -4.4132 -3.7466 -3.7460 -3.7069 -3.7068 -3.6311 -3.6305 -3.4428 -3.4344 -3.3869 -3.3809 -2.6836 -2.6501 -2.4872 -2.4859 -2.0314 -2.0303 -0.9495 -0.9378 -0.7159 -0.7142 -0.6865 -0.6832 0.9278 0.9285 0.9705 0.9705 1.6729 1.6787 1.6909 1.6909 1.7243 1.7251 2.0977 2.0987 2.4012 2.4021 2.4217 2.4231 2.6084 2.6126 3.4791 3.4808 4.4339 4.4343 4.4492 4.4494 4.5359 4.5363 4.5893 4.5894 4.7908 4.7909 5.0422 5.0443 5.3883 5.3883 7.3986 7.4888 7.7525 7.7592 7.9945 8.0840 9.1062 9.1084 10.2625 10.3073 10.3886 10.3956 k = 0.0159 0.0275 0.2960 ( 6850 PWs) bands (ev): -64.4515 -64.4515 -37.3780 -37.3780 -28.8155 -28.8155 -28.8088 -28.8088 -17.1231 -17.1231 -16.5111 -16.5058 -14.9132 -14.9003 -14.8742 -14.8734 -14.5832 -14.5767 -14.4556 -14.4556 -10.1715 -10.1715 -10.0312 -10.0312 -6.1566 -6.1565 -5.9339 -5.9339 -5.8420 -5.8420 -4.4247 -4.3959 -3.7459 -3.7455 -3.7069 -3.7069 -3.6314 -3.6310 -3.4483 -3.4397 -3.4059 -3.4034 -2.6765 -2.6539 -2.4842 -2.4838 -2.0356 -2.0349 -0.9389 -0.9303 -0.7234 -0.7210 -0.7022 -0.7005 0.9341 0.9346 0.9764 0.9764 1.6932 1.6938 1.6984 1.7035 1.7244 1.7245 2.0906 2.0914 2.4063 2.4073 2.4226 2.4231 2.6143 2.6171 3.4735 3.4746 4.4473 4.4474 4.4563 4.4565 4.5212 4.5216 4.5811 4.5811 4.7885 4.7885 5.0418 5.0432 5.3945 5.3946 7.4195 7.4822 7.7500 7.7521 8.0072 8.0670 9.1059 9.1073 10.2756 10.3086 10.3815 10.3842 k = 0.0079 0.0137 0.2960 ( 6836 PWs) bands (ev): -64.4515 -64.4515 -37.3780 -37.3780 -28.8154 -28.8154 -28.8088 -28.8088 -17.1249 -17.1249 -16.5082 -16.5056 -14.9108 -14.9040 -14.8754 -14.8753 -14.5802 -14.5769 -14.4538 -14.4538 -10.1718 -10.1718 -10.0310 -10.0310 -6.1611 -6.1610 -5.9339 -5.9339 -5.8421 -5.8421 -4.4029 -4.3881 -3.7453 -3.7451 -3.7069 -3.7069 -3.6316 -3.6314 -3.4525 -3.4468 -3.4156 -3.4153 -2.6699 -2.6585 -2.4824 -2.4823 -2.0381 -2.0377 -0.9306 -0.9260 -0.7285 -0.7264 -0.7113 -0.7110 0.9378 0.9381 0.9802 0.9802 1.6956 1.6958 1.7136 1.7165 1.7255 1.7257 2.0856 2.0861 2.4088 2.4095 2.4239 2.4240 2.6182 2.6196 3.4701 3.4707 4.4589 4.4589 4.4613 4.4614 4.5087 4.5089 4.5755 4.5755 4.7871 4.7871 5.0417 5.0424 5.3984 5.3984 7.4391 7.4713 7.7481 7.7483 8.0209 8.0508 9.1058 9.1064 10.2881 10.3059 10.3765 10.3769 k = 0.0000 0.0000 0.2960 ( 6840 PWs) bands (ev): -64.4515 -64.4515 -37.3780 -37.3780 -28.8154 -28.8154 -28.8088 -28.8088 -17.1255 -17.1255 -16.5064 -16.5064 -14.9077 -14.9077 -14.8758 -14.8758 -14.5781 -14.5781 -14.4532 -14.4532 -10.1719 -10.1719 -10.0310 -10.0310 -6.1625 -6.1625 -5.9339 -5.9339 -5.8421 -5.8421 -4.3905 -4.3905 -3.7450 -3.7450 -3.7070 -3.7070 -3.6316 -3.6316 -3.4523 -3.4523 -3.4184 -3.4184 -2.6639 -2.6639 -2.4818 -2.4818 -2.0388 -2.0388 -0.9260 -0.9260 -0.7296 -0.7296 -0.7142 -0.7142 0.9391 0.9391 0.9815 0.9815 1.6963 1.6963 1.7184 1.7184 1.7274 1.7274 2.0840 2.0840 2.4097 2.4097 2.4245 2.4245 2.6200 2.6200 3.4692 3.4692 4.4627 4.4627 4.4650 4.4650 4.5029 4.5029 4.5735 4.5735 4.7866 4.7866 5.0419 5.0419 5.3997 5.3997 7.4566 7.4566 7.7472 7.7472 8.0354 8.0354 9.1059 9.1059 10.2988 10.2988 10.3746 10.3746 k = 0.5000 0.2887 0.2960 ( 6828 PWs) bands (ev): -64.4515 -64.4515 -37.3783 -37.3783 -28.8199 -28.8199 -28.8081 -28.8081 -16.8212 -16.8212 -16.6052 -16.6052 -15.2356 -15.2356 -14.8643 -14.8643 -14.6077 -14.6077 -14.4234 -14.4234 -10.1096 -10.1096 -10.0789 -10.0789 -5.9333 -5.9333 -5.8256 -5.8256 -5.7652 -5.7652 -4.8530 -4.8530 -3.7508 -3.7508 -3.7034 -3.7034 -3.5959 -3.5959 -3.5805 -3.5805 -3.3139 -3.3139 -2.5913 -2.5913 -1.7950 -1.7950 -1.1418 -1.1418 -0.9517 -0.9517 -0.3673 -0.3673 0.2226 0.2226 0.3466 0.3466 0.5836 0.5836 0.7385 0.7385 0.8514 0.8514 1.2157 1.2157 1.5830 1.5830 1.9886 1.9886 2.1353 2.1353 2.6460 2.6460 3.7449 3.7449 4.0010 4.0010 4.3576 4.3576 4.7493 4.7493 4.7879 4.7879 5.0089 5.0089 5.0732 5.0732 5.4329 5.4329 7.4541 7.4541 7.5813 7.5813 7.8853 7.8853 9.0464 9.0464 10.3324 10.3324 10.5986 10.5986 k = 0.5000 0.2887 0.2805 ( 6846 PWs) bands (ev): -64.4515 -64.4515 -37.3783 -37.3783 -28.8199 -28.8199 -28.8082 -28.8082 -16.8212 -16.8212 -16.6052 -16.6052 -15.2356 -15.2356 -14.8643 -14.8643 -14.6077 -14.6077 -14.4234 -14.4234 -10.1096 -10.1096 -10.0789 -10.0789 -5.9333 -5.9333 -5.8257 -5.8255 -5.7653 -5.7649 -4.8531 -4.8528 -3.7512 -3.7505 -3.7040 -3.7028 -3.5962 -3.5956 -3.5806 -3.5804 -3.3139 -3.3138 -2.5915 -2.5913 -1.7952 -1.7950 -1.1422 -1.1420 -0.9520 -0.9513 -0.3676 -0.3673 0.2221 0.2239 0.3466 0.3469 0.5812 0.5852 0.7371 0.7413 0.8519 0.8535 1.2157 1.2159 1.5828 1.5829 1.9881 1.9888 2.1326 2.1330 2.6460 2.6461 3.7435 3.7468 4.0015 4.0029 4.3554 4.3570 4.7499 4.7501 4.7876 4.7879 5.0081 5.0091 5.0709 5.0753 5.4320 5.4340 7.4538 7.4549 7.5791 7.5843 7.8835 7.8876 9.0450 9.0474 10.3248 10.3388 10.5914 10.6104 k = 0.5000 0.2887 0.2649 ( 6842 PWs) bands (ev): -64.4515 -64.4515 -37.3783 -37.3783 -28.8199 -28.8199 -28.8082 -28.8082 -16.8212 -16.8212 -16.6052 -16.6052 -15.2356 -15.2356 -14.8643 -14.8643 -14.6077 -14.6077 -14.4234 -14.4234 -10.1096 -10.1096 -10.0789 -10.0789 -5.9334 -5.9333 -5.8260 -5.8256 -5.7653 -5.7646 -4.8533 -4.8527 -3.7515 -3.7503 -3.7047 -3.7023 -3.5966 -3.5953 -3.5806 -3.5803 -3.3139 -3.3137 -2.5917 -2.5913 -1.7953 -1.7949 -1.1432 -1.1427 -0.9522 -0.9509 -0.3683 -0.3677 0.2224 0.2261 0.3468 0.3475 0.5782 0.5861 0.7373 0.7453 0.8550 0.8581 1.2161 1.2166 1.5822 1.5825 1.9874 1.9888 2.1250 2.1257 2.6462 2.6463 3.7427 3.7492 4.0042 4.0071 4.3506 4.3538 4.7517 4.7522 4.7871 4.7876 5.0066 5.0087 5.0685 5.0773 5.4313 5.4351 7.4542 7.4564 7.5776 7.5879 7.8823 7.8904 9.0432 9.0480 10.3165 10.3433 10.5893 10.6260 k = 0.5000 0.2887 0.2493 ( 6852 PWs) bands (ev): -64.4515 -64.4515 -37.3783 -37.3783 -28.8199 -28.8199 -28.8082 -28.8082 -16.8212 -16.8212 -16.6053 -16.6052 -15.2356 -15.2356 -14.8643 -14.8643 -14.6077 -14.6077 -14.4234 -14.4234 -10.1096 -10.1096 -10.0789 -10.0789 -5.9335 -5.9334 -5.8263 -5.8257 -5.7651 -5.7641 -4.8534 -4.8525 -3.7520 -3.7502 -3.7053 -3.7019 -3.5969 -3.5950 -3.5805 -3.5801 -3.3138 -3.3135 -2.5919 -2.5914 -1.7955 -1.7949 -1.1447 -1.1440 -0.9523 -0.9504 -0.3692 -0.3684 0.2235 0.2289 0.3474 0.3484 0.5750 0.5861 0.7389 0.7500 0.8611 0.8654 1.2169 1.2176 1.5814 1.5818 1.9863 1.9885 2.1126 2.1138 2.6464 2.6466 3.7425 3.7521 4.0091 4.0134 4.3435 4.3481 4.7546 4.7553 4.7863 4.7870 5.0045 5.0076 5.0662 5.0791 5.4308 5.4364 7.4549 7.4584 7.5768 7.5921 7.8818 7.8936 9.0410 9.0482 10.3081 10.3455 10.5928 10.6447 k = 0.5000 0.2887 0.2337 ( 6848 PWs) bands (ev): -64.4515 -64.4515 -37.3783 -37.3783 -28.8199 -28.8199 -28.8082 -28.8082 -16.8212 -16.8212 -16.6053 -16.6053 -15.2356 -15.2356 -14.8643 -14.8643 -14.6077 -14.6077 -14.4234 -14.4234 -10.1096 -10.1096 -10.0790 -10.0789 -5.9336 -5.9335 -5.8266 -5.8259 -5.7648 -5.7635 -4.8535 -4.8523 -3.7524 -3.7502 -3.7059 -3.7015 -3.5972 -3.5949 -3.5804 -3.5799 -3.3137 -3.3133 -2.5922 -2.5915 -1.7957 -1.7949 -1.1466 -1.1457 -0.9523 -0.9499 -0.3705 -0.3694 0.2254 0.2323 0.3482 0.3495 0.5717 0.5853 0.7417 0.7548 0.8702 0.8753 1.2181 1.2191 1.5803 1.5808 1.9848 1.9879 2.0956 2.0975 2.6468 2.6471 3.7429 3.7554 4.0159 4.0215 4.3343 4.3404 4.7581 4.7593 4.7852 4.7861 5.0019 5.0058 5.0642 5.0808 5.4305 5.4376 7.4560 7.4609 7.5769 7.5969 7.8819 7.8972 9.0386 9.0479 10.3002 10.3455 10.6019 10.6660 k = 0.5000 0.2887 0.2181 ( 6840 PWs) bands (ev): -64.4515 -64.4515 -37.3783 -37.3783 -28.8199 -28.8199 -28.8082 -28.8082 -16.8212 -16.8212 -16.6053 -16.6053 -15.2356 -15.2356 -14.8643 -14.8643 -14.6077 -14.6077 -14.4234 -14.4234 -10.1096 -10.1095 -10.0790 -10.0789 -5.9338 -5.9337 -5.8270 -5.8262 -5.7644 -5.7629 -4.8536 -4.8522 -3.7529 -3.7502 -3.7065 -3.7013 -3.5975 -3.5947 -3.5803 -3.5796 -3.3135 -3.3131 -2.5926 -2.5917 -1.7959 -1.7950 -1.1490 -1.1479 -0.9523 -0.9493 -0.3719 -0.3706 0.2280 0.2362 0.3492 0.3507 0.5684 0.5839 0.7452 0.7594 0.8825 0.8881 1.2198 1.2210 1.5790 1.5796 1.9823 1.9868 2.0744 2.0774 2.6474 2.6477 3.7440 3.7590 4.0243 4.0313 4.3237 4.3312 4.7617 4.7637 4.7837 4.7851 4.9988 5.0035 5.0627 5.0823 5.4304 5.4389 7.4574 7.4638 7.5778 7.6021 7.8827 7.9010 9.0359 9.0471 10.2929 10.3435 10.6163 10.6894 k = 0.5000 0.2887 0.2026 ( 6828 PWs) bands (ev): -64.4515 -64.4515 -37.3783 -37.3783 -28.8199 -28.8199 -28.8081 -28.8081 -16.8212 -16.8212 -16.6053 -16.6053 -15.2356 -15.2356 -14.8643 -14.8643 -14.6077 -14.6077 -14.4233 -14.4233 -10.1096 -10.1095 -10.0790 -10.0789 -5.9340 -5.9338 -5.8275 -5.8265 -5.7639 -5.7622 -4.8537 -4.8521 -3.7534 -3.7504 -3.7071 -3.7011 -3.5977 -3.5947 -3.5801 -3.5793 -3.3133 -3.3128 -2.5930 -2.5920 -1.7961 -1.7951 -1.1516 -1.1504 -0.9521 -0.9489 -0.3736 -0.3721 0.2312 0.2404 0.3504 0.3522 0.5654 0.5820 0.7491 0.7635 0.8980 0.9038 1.2221 1.2236 1.5774 1.5781 1.9782 1.9848 2.0500 2.0548 2.6480 2.6483 3.7458 3.7630 4.0339 4.0423 4.3121 4.3210 4.7647 4.7680 4.7821 4.7843 4.9954 5.0005 5.0617 5.0839 5.4306 5.4401 7.4589 7.4669 7.5796 7.6076 7.8844 7.9052 9.0331 9.0459 10.2866 10.3400 10.6353 10.7145 k = 0.5000 0.2887 0.1870 ( 6834 PWs) bands (ev): -64.4515 -64.4515 -37.3783 -37.3783 -28.8199 -28.8199 -28.8082 -28.8082 -16.8212 -16.8212 -16.6053 -16.6053 -15.2356 -15.2356 -14.8643 -14.8643 -14.6077 -14.6076 -14.4233 -14.4233 -10.1096 -10.1095 -10.0790 -10.0789 -5.9342 -5.9340 -5.8280 -5.8269 -5.7633 -5.7615 -4.8537 -4.8519 -3.7539 -3.7506 -3.7076 -3.7011 -3.5980 -3.5947 -3.5799 -3.5790 -3.3131 -3.3125 -2.5934 -2.5923 -1.7963 -1.7952 -1.1545 -1.1532 -0.9520 -0.9484 -0.3754 -0.3737 0.2348 0.2448 0.3519 0.3537 0.5627 0.5799 0.7531 0.7670 0.9165 0.9221 1.2250 1.2269 1.5756 1.5765 1.9702 1.9799 2.0245 2.0321 2.6486 2.6490 3.7482 3.7672 4.0440 4.0540 4.3001 4.3104 4.7660 4.7710 4.7810 4.7844 4.9915 4.9971 5.0615 5.0855 5.4310 5.4412 7.4604 7.4699 7.5822 7.6132 7.8868 7.9095 9.0301 9.0442 10.2813 10.3356 10.6582 10.7410 k = 0.5000 0.2887 0.1714 ( 6840 PWs) bands (ev): -64.4515 -64.4515 -37.3783 -37.3783 -28.8199 -28.8199 -28.8082 -28.8082 -16.8212 -16.8212 -16.6053 -16.6053 -15.2357 -15.2357 -14.8643 -14.8643 -14.6077 -14.6076 -14.4233 -14.4233 -10.1096 -10.1095 -10.0791 -10.0790 -5.9344 -5.9342 -5.8284 -5.8274 -5.7627 -5.7607 -4.8537 -4.8519 -3.7544 -3.7509 -3.7080 -3.7012 -3.5981 -3.5947 -3.5796 -3.5786 -3.3129 -3.3123 -2.5938 -2.5927 -1.7965 -1.7954 -1.1576 -1.1562 -0.9517 -0.9480 -0.3772 -0.3755 0.2388 0.2493 0.3534 0.3553 0.5604 0.5777 0.7569 0.7700 0.9375 0.9429 1.2289 1.2311 1.5736 1.5747 1.9540 1.9658 2.0049 2.0142 2.6494 2.6497 3.7513 3.7717 4.0543 4.0659 4.2883 4.3000 4.7650 4.7704 4.7825 4.7860 4.9875 4.9932 5.0622 5.0873 5.4317 5.4423 7.4619 7.4728 7.5856 7.6188 7.8899 7.9139 9.0271 9.0421 10.2771 10.3308 10.6843 10.7685 k = 0.5000 0.2887 0.1558 ( 6842 PWs) bands (ev): -64.4515 -64.4515 -37.3783 -37.3783 -28.8199 -28.8199 -28.8082 -28.8082 -16.8212 -16.8212 -16.6053 -16.6053 -15.2357 -15.2357 -14.8643 -14.8643 -14.6077 -14.6076 -14.4233 -14.4233 -10.1096 -10.1095 -10.0791 -10.0790 -5.9346 -5.9344 -5.8289 -5.8279 -5.7620 -5.7600 -4.8537 -4.8518 -3.7548 -3.7512 -3.7083 -3.7014 -3.5982 -3.5948 -3.5794 -3.5783 -3.3126 -3.3120 -2.5942 -2.5931 -1.7967 -1.7955 -1.1607 -1.1593 -0.9515 -0.9478 -0.3791 -0.3773 0.2429 0.2538 0.3550 0.3569 0.5585 0.5755 0.7605 0.7725 0.9606 0.9655 1.2340 1.2365 1.5715 1.5728 1.9272 1.9372 1.9966 2.0038 2.6501 2.6505 3.7550 3.7763 4.0640 4.0773 4.2774 4.2906 4.7619 4.7670 4.7859 4.7886 4.9833 4.9890 5.0637 5.0891 5.4325 5.4432 7.4634 7.4753 7.5897 7.6242 7.8938 7.9183 9.0241 9.0397 10.2740 10.3259 10.7129 10.7967 k = 0.5000 0.2887 0.1402 ( 6838 PWs) bands (ev): -64.4515 -64.4515 -37.3783 -37.3783 -28.8199 -28.8199 -28.8082 -28.8082 -16.8212 -16.8212 -16.6053 -16.6053 -15.2357 -15.2357 -14.8643 -14.8643 -14.6076 -14.6076 -14.4232 -14.4232 -10.1095 -10.1094 -10.0791 -10.0790 -5.9348 -5.9347 -5.8294 -5.8283 -5.7612 -5.7593 -4.8536 -4.8517 -3.7552 -3.7516 -3.7085 -3.7016 -3.5983 -3.5950 -3.5791 -3.5780 -3.3123 -3.3117 -2.5946 -2.5935 -1.7969 -1.7957 -1.1637 -1.1624 -0.9513 -0.9476 -0.3809 -0.3792 0.2472 0.2580 0.3566 0.3584 0.5570 0.5733 0.7637 0.7745 0.9850 0.9894 1.2407 1.2437 1.5693 1.5708 1.8928 1.9010 1.9934 1.9984 2.6509 2.6512 3.7592 3.7809 4.0726 4.0874 4.2681 4.2827 4.7573 4.7621 4.7897 4.7917 4.9791 4.9847 5.0660 5.0910 5.4335 5.4441 7.4648 7.4774 7.5944 7.6292 7.8984 7.9226 9.0212 9.0369 10.2719 10.3211 10.7434 10.8255 k = 0.5000 0.2887 0.1247 ( 6824 PWs) bands (ev): -64.4515 -64.4515 -37.3783 -37.3783 -28.8199 -28.8199 -28.8082 -28.8082 -16.8212 -16.8212 -16.6053 -16.6053 -15.2357 -15.2357 -14.8643 -14.8643 -14.6076 -14.6076 -14.4232 -14.4232 -10.1095 -10.1094 -10.0791 -10.0790 -5.9350 -5.9349 -5.8298 -5.8288 -5.7605 -5.7586 -4.8536 -4.8517 -3.7555 -3.7521 -3.7086 -3.7020 -3.5983 -3.5952 -3.5788 -3.5777 -3.3120 -3.3114 -2.5950 -2.5939 -1.7971 -1.7959 -1.1667 -1.1654 -0.9510 -0.9475 -0.3827 -0.3810 0.2515 0.2619 0.3582 0.3600 0.5559 0.5711 0.7667 0.7762 1.0099 1.0137 1.2496 1.2530 1.5670 1.5686 1.8540 1.8612 1.9917 1.9953 2.6516 2.6520 3.7639 3.7855 4.0794 4.0956 4.2611 4.2768 4.7518 4.7564 4.7932 4.7947 4.9750 4.9803 5.0691 5.0929 5.4346 5.4447 7.4662 7.4790 7.5996 7.6336 7.9034 7.9268 9.0185 9.0339 10.2709 10.3165 10.7752 10.8543 k = 0.5000 0.2887 0.1091 ( 6828 PWs) bands (ev): -64.4515 -64.4515 -37.3783 -37.3783 -28.8199 -28.8199 -28.8082 -28.8082 -16.8212 -16.8212 -16.6053 -16.6053 -15.2357 -15.2357 -14.8643 -14.8643 -14.6076 -14.6076 -14.4232 -14.4232 -10.1095 -10.1094 -10.0791 -10.0791 -5.9352 -5.9351 -5.8302 -5.8293 -5.7598 -5.7580 -4.8535 -4.8517 -3.7558 -3.7526 -3.7087 -3.7024 -3.5983 -3.5954 -3.5785 -3.5774 -3.3117 -3.3112 -2.5954 -2.5943 -1.7973 -1.7962 -1.1695 -1.1683 -0.9508 -0.9474 -0.3843 -0.3827 0.2557 0.2654 0.3598 0.3614 0.5553 0.5691 0.7693 0.7775 1.0343 1.0373 1.2615 1.2654 1.5644 1.5664 1.8126 1.8194 1.9907 1.9933 2.6523 2.6526 3.7689 3.7898 4.0842 4.1011 4.2571 4.2733 4.7457 4.7502 4.7963 4.7975 4.9710 4.9759 5.0726 5.0947 5.4358 5.4452 7.4675 7.4801 7.6051 7.6372 7.9088 7.9306 9.0161 9.0307 10.2708 10.3121 10.8074 10.8830 k = 0.5000 0.2887 0.0935 ( 6828 PWs) bands (ev): -64.4515 -64.4515 -37.3783 -37.3783 -28.8199 -28.8199 -28.8082 -28.8082 -16.8212 -16.8212 -16.6053 -16.6053 -15.2358 -15.2357 -14.8643 -14.8643 -14.6076 -14.6076 -14.4232 -14.4232 -10.1095 -10.1094 -10.0792 -10.0791 -5.9354 -5.9353 -5.8305 -5.8297 -5.7591 -5.7575 -4.8534 -4.8518 -3.7560 -3.7531 -3.7086 -3.7029 -3.5982 -3.5956 -3.5783 -3.5772 -3.3114 -3.3109 -2.5957 -2.5947 -1.7974 -1.7964 -1.1720 -1.1709 -0.9505 -0.9475 -0.3858 -0.3843 0.2596 0.2684 0.3612 0.3626 0.5549 0.5672 0.7716 0.7786 1.0568 1.0591 1.2772 1.2816 1.5615 1.5639 1.7697 1.7763 1.9899 1.9918 2.6529 2.6532 3.7742 3.7937 4.0869 4.1037 4.2561 4.2719 4.7394 4.7437 4.7991 4.7999 4.9674 4.9718 5.0764 5.0962 5.4371 5.4455 7.4689 7.4807 7.6107 7.6400 7.9143 7.9341 9.0140 9.0275 10.2716 10.3080 10.8394 10.9113 k = 0.5000 0.2887 0.0779 ( 6820 PWs) bands (ev): -64.4515 -64.4515 -37.3783 -37.3783 -28.8199 -28.8199 -28.8081 -28.8081 -16.8212 -16.8212 -16.6053 -16.6053 -15.2358 -15.2358 -14.8643 -14.8643 -14.6076 -14.6076 -14.4231 -14.4231 -10.1095 -10.1094 -10.0792 -10.0791 -5.9356 -5.9355 -5.8308 -5.8301 -5.7584 -5.7571 -4.8532 -4.8518 -3.7562 -3.7536 -3.7084 -3.7035 -3.5981 -3.5959 -3.5780 -3.5770 -3.3112 -3.3107 -2.5959 -2.5951 -1.7975 -1.7966 -1.1742 -1.1733 -0.9502 -0.9476 -0.3871 -0.3858 0.2632 0.2709 0.3625 0.3637 0.5549 0.5655 0.7736 0.7794 1.0764 1.0780 1.2975 1.3023 1.5581 1.5609 1.7264 1.7331 1.9893 1.9908 2.6535 2.6538 3.7795 3.7971 4.0879 4.1036 4.2579 4.2724 4.7333 4.7374 4.8014 4.8021 4.9642 4.9680 5.0804 5.0975 5.4383 5.4457 7.4703 7.4809 7.6163 7.6419 7.9198 7.9369 9.0124 9.0243 10.2730 10.3042 10.8701 10.9394 k = 0.5000 0.2887 0.0623 ( 6812 PWs) bands (ev): -64.4515 -64.4515 -37.3783 -37.3783 -28.8198 -28.8198 -28.8081 -28.8081 -16.8212 -16.8212 -16.6053 -16.6053 -15.2358 -15.2358 -14.8643 -14.8643 -14.6076 -14.6076 -14.4231 -14.4231 -10.1094 -10.1094 -10.0792 -10.0791 -5.9357 -5.9357 -5.8310 -5.8304 -5.7579 -5.7567 -4.8531 -4.8519 -3.7563 -3.7541 -3.7082 -3.7040 -3.5980 -3.5961 -3.5777 -3.5769 -3.3110 -3.3106 -2.5962 -2.5954 -1.7975 -1.7968 -1.1760 -1.1753 -0.9500 -0.9478 -0.3881 -0.3870 0.2665 0.2729 0.3637 0.3646 0.5552 0.5638 0.7754 0.7800 1.0923 1.0933 1.3226 1.3276 1.5533 1.5566 1.6842 1.6911 1.9889 1.9899 2.6540 2.6542 3.7847 3.7997 4.0878 4.1014 4.2615 4.2740 4.7278 4.7314 4.8033 4.8038 4.9615 4.9646 5.0843 5.0984 5.4396 5.4457 7.4716 7.4806 7.6216 7.6430 7.9250 7.9392 9.0112 9.0212 10.2750 10.3005 10.8985 10.9701 k = 0.5000 0.2887 0.0467 ( 6814 PWs) bands (ev): -64.4515 -64.4515 -37.3783 -37.3783 -28.8199 -28.8198 -28.8081 -28.8081 -16.8212 -16.8212 -16.6053 -16.6053 -15.2358 -15.2358 -14.8643 -14.8643 -14.6076 -14.6076 -14.4231 -14.4231 -10.1094 -10.1094 -10.0792 -10.0792 -5.9359 -5.9358 -5.8312 -5.8307 -5.7574 -5.7565 -4.8529 -4.8520 -3.7563 -3.7546 -3.7078 -3.7046 -3.5978 -3.5964 -3.5775 -3.5768 -3.3108 -3.3105 -2.5963 -2.5957 -1.7975 -1.7970 -1.1775 -1.1769 -0.9497 -0.9480 -0.3889 -0.3881 0.2693 0.2742 0.3646 0.3654 0.5557 0.5623 0.7768 0.7803 1.1042 1.1047 1.3523 1.3573 1.5455 1.5492 1.6458 1.6526 1.9886 1.9893 2.6544 2.6546 3.7895 3.8014 4.0874 4.0982 4.2660 4.2758 4.7232 4.7262 4.8048 4.8052 4.9594 4.9618 5.0879 5.0987 5.4408 5.4455 7.4730 7.4801 7.6266 7.6431 7.9297 7.9406 9.0106 9.0184 10.2774 10.2968 10.9235 10.9945 k = 0.5000 0.2887 0.0312 ( 6800 PWs) bands (ev): -64.4515 -64.4515 -37.3783 -37.3783 -28.8198 -28.8198 -28.8081 -28.8081 -16.8212 -16.8212 -16.6053 -16.6053 -15.2358 -15.2358 -14.8643 -14.8643 -14.6076 -14.6076 -14.4231 -14.4231 -10.1094 -10.1094 -10.0792 -10.0792 -5.9359 -5.9359 -5.8313 -5.8310 -5.7570 -5.7564 -4.8528 -4.8521 -3.7562 -3.7550 -3.7074 -3.7052 -3.5976 -3.5967 -3.5772 -3.5768 -3.3106 -3.3104 -2.5964 -2.5960 -1.7975 -1.7971 -1.1786 -1.1782 -0.9494 -0.9483 -0.3894 -0.3889 0.2716 0.2749 0.3653 0.3658 0.5564 0.5609 0.7780 0.7803 1.1122 1.1126 1.3853 1.3899 1.5314 1.5348 1.6165 1.6221 1.9884 1.9889 2.6547 2.6548 3.7938 3.8021 4.0871 4.0947 4.2705 4.2772 4.7198 4.7219 4.8059 4.8061 4.9579 4.9596 5.0912 5.0985 5.4419 5.4451 7.4744 7.4793 7.6310 7.6423 7.9338 7.9411 9.0105 9.0159 10.2802 10.2933 10.9448 10.9943 k = 0.5000 0.2887 0.0156 ( 6816 PWs) bands (ev): -64.4515 -64.4515 -37.3783 -37.3783 -28.8199 -28.8199 -28.8081 -28.8081 -16.8212 -16.8212 -16.6053 -16.6053 -15.2358 -15.2358 -14.8643 -14.8643 -14.6076 -14.6076 -14.4231 -14.4231 -10.1094 -10.1094 -10.0792 -10.0792 -5.9360 -5.9360 -5.8313 -5.8312 -5.7567 -5.7564 -4.8526 -4.8523 -3.7560 -3.7554 -3.7069 -3.7058 -3.5974 -3.5969 -3.5771 -3.5769 -3.3105 -3.3104 -2.5964 -2.5962 -1.7975 -1.7973 -1.1791 -1.1790 -0.9491 -0.9485 -0.3897 -0.3894 0.2733 0.2750 0.3658 0.3661 0.5573 0.5596 0.7790 0.7801 1.1169 1.1170 1.4188 1.4224 1.5089 1.5114 1.6012 1.6041 1.9883 1.9885 2.6549 2.6549 3.7974 3.8016 4.0876 4.0915 4.2742 4.2776 4.7179 4.7190 4.8066 4.8067 4.9572 4.9581 5.0939 5.0976 5.4429 5.4445 7.4757 7.4782 7.6349 7.6406 7.9370 7.9407 9.0111 9.0138 10.2833 10.2899 10.9619 10.9859 k = 0.5000 0.2887-0.0000 ( 6816 PWs) bands (ev): -64.4515 -64.4515 -37.3783 -37.3783 -28.8199 -28.8199 -28.8081 -28.8081 -16.8212 -16.8212 -16.6053 -16.6053 -15.2358 -15.2358 -14.8643 -14.8643 -14.6076 -14.6076 -14.4231 -14.4231 -10.1094 -10.1094 -10.0792 -10.0792 -5.9360 -5.9360 -5.8313 -5.8313 -5.7565 -5.7565 -4.8524 -4.8524 -3.7557 -3.7557 -3.7064 -3.7064 -3.5972 -3.5972 -3.5769 -3.5769 -3.3104 -3.3104 -2.5963 -2.5963 -1.7974 -1.7974 -1.1793 -1.1793 -0.9488 -0.9488 -0.3897 -0.3897 0.2744 0.2744 0.3661 0.3661 0.5584 0.5584 0.7797 0.7797 1.1185 1.1185 1.4400 1.4400 1.4933 1.4933 1.5978 1.5978 1.9884 1.9884 2.6549 2.6549 3.8000 3.8000 4.0891 4.0891 4.2766 4.2766 4.7177 4.7177 4.8068 4.8068 4.9573 4.9573 5.0961 5.0961 5.4438 5.4438 7.4770 7.4770 7.6381 7.6381 7.9394 7.9394 9.0122 9.0122 10.2865 10.2865 10.9750 10.9755 k = 0.3333 0.5774-0.0000 ( 6798 PWs) bands (ev): -64.4515 -64.4515 -37.3783 -37.3783 -28.8201 -28.8201 -28.8083 -28.8083 -16.7256 -16.7256 -16.6719 -16.6704 -15.2925 -15.2925 -14.7821 -14.7821 -14.6869 -14.6838 -14.4153 -14.4153 -10.0932 -10.0932 -10.0932 -10.0932 -5.9335 -5.9335 -5.8254 -5.8244 -5.4219 -5.4219 -5.3381 -5.3099 -3.7544 -3.7544 -3.7004 -3.6987 -3.5923 -3.5923 -3.5772 -3.5772 -2.8679 -2.8679 -2.8055 -2.7511 -1.6784 -1.6784 -0.9933 -0.9933 -0.9513 -0.9450 -0.8467 -0.8467 0.0962 0.0962 0.1142 0.1272 0.9013 0.9013 1.2151 1.2151 1.2557 1.2574 1.2651 1.2651 1.4341 1.4341 1.5936 1.5936 2.1434 2.1434 2.1772 2.1964 3.6823 3.6823 3.7106 3.7262 4.6685 4.6685 4.8378 4.8416 4.8517 4.8517 5.0201 5.0330 5.0330 5.0602 5.2304 5.2304 7.5490 7.5747 7.5969 7.5969 7.9291 7.9291 9.1818 9.1818 10.1961 10.1961 10.2473 10.2542 k = 0.3333 0.5774 0.0156 ( 6795 PWs) bands (ev): -64.4515 -64.4515 -37.3783 -37.3783 -28.8201 -28.8201 -28.8083 -28.8083 -16.7256 -16.7256 -16.6719 -16.6704 -15.2925 -15.2925 -14.7821 -14.7821 -14.6869 -14.6838 -14.4153 -14.4153 -10.0932 -10.0932 -10.0932 -10.0932 -5.9336 -5.9334 -5.8254 -5.8244 -5.4219 -5.4219 -5.3381 -5.3099 -3.7544 -3.7543 -3.7004 -3.6987 -3.5923 -3.5923 -3.5772 -3.5772 -2.8681 -2.8677 -2.8055 -2.7511 -1.6784 -1.6783 -0.9938 -0.9927 -0.9513 -0.9449 -0.8463 -0.8463 0.0956 0.0964 0.1140 0.1270 0.9001 0.9007 1.2149 1.2151 1.2557 1.2574 1.2647 1.2649 1.4188 1.4214 1.6084 1.6102 2.1424 2.1445 2.1772 2.1965 3.6799 3.6852 3.7099 3.7274 4.6679 4.6679 4.8371 4.8416 4.8505 4.8520 5.0181 5.0256 5.0406 5.0624 5.2305 5.2306 7.5484 7.5754 7.5954 7.5980 7.9259 7.9320 9.1798 9.1839 10.1910 10.2008 10.2413 10.2625 k = 0.3333 0.5774 0.0312 ( 6789 PWs) bands (ev): -64.4515 -64.4515 -37.3783 -37.3783 -28.8201 -28.8201 -28.8083 -28.8083 -16.7256 -16.7256 -16.6719 -16.6704 -15.2925 -15.2925 -14.7821 -14.7821 -14.6869 -14.6838 -14.4153 -14.4153 -10.0933 -10.0932 -10.0932 -10.0932 -5.9336 -5.9333 -5.8254 -5.8244 -5.4220 -5.4218 -5.3381 -5.3099 -3.7544 -3.7542 -3.7005 -3.6987 -3.5924 -3.5923 -3.5773 -3.5773 -2.8682 -2.8674 -2.8054 -2.7511 -1.6784 -1.6783 -0.9941 -0.9919 -0.9513 -0.9445 -0.8451 -0.8450 0.0948 0.0963 0.1135 0.1266 0.8971 0.8983 1.2145 1.2151 1.2557 1.2575 1.2634 1.2638 1.3866 1.3905 1.6446 1.6471 2.1416 2.1456 2.1772 2.1968 3.6779 3.6884 3.7083 3.7304 4.6660 4.6662 4.8353 4.8411 4.8487 4.8515 5.0133 5.0189 5.0482 5.0677 5.2307 5.2308 7.5468 7.5773 7.5936 7.5986 7.9225 7.9345 9.1780 9.1860 10.1856 10.2052 10.2350 10.2754 k = 0.3333 0.5774 0.0467 ( 6792 PWs) bands (ev): -64.4515 -64.4515 -37.3783 -37.3783 -28.8201 -28.8201 -28.8083 -28.8083 -16.7256 -16.7256 -16.6719 -16.6704 -15.2925 -15.2925 -14.7821 -14.7821 -14.6869 -14.6838 -14.4153 -14.4153 -10.0933 -10.0933 -10.0932 -10.0932 -5.9337 -5.9333 -5.8254 -5.8244 -5.4220 -5.4218 -5.3381 -5.3098 -3.7544 -3.7540 -3.7006 -3.6988 -3.5924 -3.5923 -3.5773 -3.5773 -2.8684 -2.8672 -2.8054 -2.7510 -1.6784 -1.6782 -0.9943 -0.9910 -0.9512 -0.9439 -0.8431 -0.8431 0.0936 0.0959 0.1127 0.1258 0.8922 0.8940 1.2138 1.2148 1.2558 1.2576 1.2606 1.2615 1.3503 1.3550 1.6899 1.6924 2.1410 2.1469 2.1772 2.1973 3.6764 3.6919 3.7065 3.7343 4.6631 4.6634 4.8327 4.8398 4.8463 4.8499 5.0076 5.0130 5.0555 5.0744 5.2311 5.2313 7.5448 7.5799 7.5914 7.5988 7.9189 7.9365 9.1765 9.1881 10.1802 10.2092 10.2309 10.2903 k = 0.3333 0.5774 0.0623 ( 6798 PWs) bands (ev): -64.4515 -64.4515 -37.3783 -37.3783 -28.8201 -28.8201 -28.8083 -28.8083 -16.7256 -16.7256 -16.6719 -16.6704 -15.2925 -15.2925 -14.7821 -14.7821 -14.6869 -14.6838 -14.4153 -14.4153 -10.0933 -10.0933 -10.0932 -10.0932 -5.9337 -5.9332 -5.8254 -5.8243 -5.4220 -5.4218 -5.3382 -5.3098 -3.7543 -3.7538 -3.7007 -3.6988 -3.5924 -3.5923 -3.5774 -3.5774 -2.8685 -2.8670 -2.8053 -2.7509 -1.6784 -1.6781 -0.9942 -0.9901 -0.9510 -0.9432 -0.8404 -0.8404 0.0922 0.0951 0.1116 0.1249 0.8852 0.8875 1.2124 1.2140 1.2542 1.2559 1.2563 1.2578 1.3176 1.3221 1.7386 1.7410 2.1406 2.1481 2.1773 2.1980 3.6755 3.6955 3.7051 3.7387 4.6591 4.6594 4.8297 4.8374 4.8435 4.8473 5.0023 5.0083 5.0623 5.0813 5.2316 5.2319 7.5426 7.5828 7.5891 7.5985 7.9152 7.9380 9.1752 9.1901 10.1747 10.2129 10.2293 10.3068 k = 0.3333 0.5774 0.0779 ( 6804 PWs) bands (ev): -64.4515 -64.4515 -37.3783 -37.3783 -28.8201 -28.8201 -28.8083 -28.8083 -16.7256 -16.7256 -16.6719 -16.6704 -15.2925 -15.2925 -14.7821 -14.7821 -14.6869 -14.6838 -14.4153 -14.4153 -10.0933 -10.0933 -10.0932 -10.0931 -5.9337 -5.9331 -5.8253 -5.8243 -5.4220 -5.4217 -5.3382 -5.3097 -3.7541 -3.7535 -3.7009 -3.6989 -3.5924 -3.5923 -3.5775 -3.5775 -2.8685 -2.8668 -2.8052 -2.7508 -1.6783 -1.6780 -0.9940 -0.9891 -0.9508 -0.9423 -0.8370 -0.8370 0.0905 0.0940 0.1103 0.1236 0.8760 0.8788 1.2090 1.2117 1.2407 1.2456 1.2560 1.2580 1.2952 1.2985 1.7884 1.7907 2.1403 2.1494 2.1774 2.1987 3.6752 3.6993 3.7042 3.7433 4.6541 4.6545 4.8262 4.8340 4.8404 4.8436 4.9980 5.0049 5.0684 5.0876 5.2322 5.2326 7.5406 7.5856 7.5865 7.5977 7.9116 7.9390 9.1741 9.1919 10.1695 10.2163 10.2301 10.3246 k = 0.3333 0.5774 0.0935 ( 6804 PWs) bands (ev): -64.4515 -64.4515 -37.3783 -37.3783 -28.8201 -28.8201 -28.8083 -28.8083 -16.7256 -16.7256 -16.6719 -16.6704 -15.2925 -15.2925 -14.7821 -14.7821 -14.6869 -14.6838 -14.4154 -14.4153 -10.0933 -10.0933 -10.0932 -10.0931 -5.9337 -5.9330 -5.8253 -5.8243 -5.4220 -5.4217 -5.3383 -5.3096 -3.7539 -3.7533 -3.7011 -3.6990 -3.5924 -3.5924 -3.5776 -3.5776 -2.8686 -2.8666 -2.8051 -2.7506 -1.6783 -1.6779 -0.9937 -0.9880 -0.9504 -0.9413 -0.8330 -0.8330 0.0887 0.0927 0.1088 0.1222 0.8643 0.8675 1.1997 1.2020 1.2257 1.2320 1.2561 1.2582 1.2848 1.2867 1.8381 1.8402 2.1403 2.1506 2.1777 2.1995 3.6754 3.7030 3.7039 3.7479 4.6483 4.6487 4.8223 4.8297 4.8369 4.8389 4.9951 5.0028 5.0736 5.0932 5.2330 5.2334 7.5391 7.5839 7.5882 7.5964 7.9081 7.9394 9.1734 9.1934 10.1647 10.2194 10.2333 10.3432 k = 0.3333 0.5774 0.1091 ( 6816 PWs) bands (ev): -64.4515 -64.4515 -37.3783 -37.3783 -28.8201 -28.8201 -28.8084 -28.8084 -16.7256 -16.7256 -16.6719 -16.6704 -15.2925 -15.2925 -14.7821 -14.7821 -14.6869 -14.6838 -14.4154 -14.4154 -10.0933 -10.0933 -10.0932 -10.0931 -5.9337 -5.9329 -5.8253 -5.8243 -5.4220 -5.4216 -5.3384 -5.3094 -3.7537 -3.7530 -3.7013 -3.6992 -3.5924 -3.5924 -3.5778 -3.5778 -2.8686 -2.8664 -2.8050 -2.7505 -1.6782 -1.6777 -0.9931 -0.9869 -0.9499 -0.9403 -0.8285 -0.8285 0.0867 0.0911 0.1071 0.1205 0.8501 0.8536 1.1805 1.1812 1.2206 1.2247 1.2562 1.2584 1.2804 1.2816 1.8869 1.8888 2.1405 2.1518 2.1780 2.2003 3.6762 3.7043 3.7066 3.7522 4.6417 4.6422 4.8179 4.8247 4.8333 4.8336 4.9937 5.0022 5.0779 5.0977 5.2338 5.2342 7.5380 7.5813 7.5905 7.5947 7.9049 7.9391 9.1729 9.1945 10.1606 10.2221 10.2390 10.3623 k = 0.3333 0.5774 0.1247 ( 6822 PWs) bands (ev): -64.4515 -64.4515 -37.3783 -37.3783 -28.8201 -28.8201 -28.8084 -28.8084 -16.7256 -16.7256 -16.6719 -16.6704 -15.2924 -15.2924 -14.7821 -14.7821 -14.6869 -14.6838 -14.4154 -14.4154 -10.0934 -10.0934 -10.0932 -10.0932 -5.9337 -5.9329 -5.8252 -5.8242 -5.4220 -5.4216 -5.3384 -5.3093 -3.7535 -3.7527 -3.7015 -3.6993 -3.5924 -3.5924 -3.5779 -3.5779 -2.8685 -2.8662 -2.8048 -2.7503 -1.6781 -1.6776 -0.9925 -0.9859 -0.9492 -0.9393 -0.8235 -0.8235 0.0847 0.0894 0.1052 0.1188 0.8336 0.8372 1.1572 1.1596 1.2191 1.2219 1.2564 1.2586 1.2783 1.2792 1.9342 1.9359 2.1410 2.1528 2.1784 2.2011 3.6775 3.7054 3.7100 3.7561 4.6345 4.6350 4.8130 4.8195 4.8277 4.8295 4.9938 5.0028 5.0811 5.1010 5.2347 5.2352 7.5375 7.5787 7.5922 7.5927 7.9019 7.9384 9.1727 9.1953 10.1574 10.2245 10.2469 10.3812 k = 0.3333 0.5774 0.1402 ( 6810 PWs) bands (ev): -64.4515 -64.4515 -37.3783 -37.3783 -28.8201 -28.8201 -28.8084 -28.8083 -16.7256 -16.7256 -16.6719 -16.6704 -15.2924 -15.2924 -14.7821 -14.7821 -14.6869 -14.6838 -14.4154 -14.4154 -10.0934 -10.0934 -10.0932 -10.0932 -5.9337 -5.9328 -5.8252 -5.8242 -5.4220 -5.4216 -5.3385 -5.3092 -3.7532 -3.7524 -3.7016 -3.6995 -3.5925 -3.5924 -3.5781 -3.5781 -2.8684 -2.8661 -2.8047 -2.7501 -1.6780 -1.6775 -0.9917 -0.9849 -0.9485 -0.9383 -0.8183 -0.8183 0.0826 0.0875 0.1034 0.1169 0.8151 0.8187 1.1365 1.1396 1.2186 1.2206 1.2566 1.2588 1.2771 1.2779 1.9794 1.9809 2.1416 2.1539 2.1790 2.2019 3.6794 3.7071 3.7130 3.7596 4.6269 4.6275 4.8074 4.8146 4.8217 4.8255 4.9953 5.0045 5.0832 5.1030 5.2356 5.2361 7.5377 7.5763 7.5904 7.5935 7.8995 7.9370 9.1727 9.1957 10.1552 10.2265 10.2571 10.3994 k = 0.3333 0.5774 0.1558 ( 6828 PWs) bands (ev): -64.4515 -64.4515 -37.3783 -37.3783 -28.8201 -28.8201 -28.8084 -28.8084 -16.7256 -16.7256 -16.6719 -16.6704 -15.2924 -15.2924 -14.7821 -14.7821 -14.6869 -14.6838 -14.4155 -14.4155 -10.0934 -10.0934 -10.0932 -10.0932 -5.9337 -5.9328 -5.8251 -5.8242 -5.4219 -5.4215 -5.3386 -5.3090 -3.7529 -3.7521 -3.7018 -3.6997 -3.5925 -3.5924 -3.5782 -3.5782 -2.8683 -2.8659 -2.8045 -2.7500 -1.6779 -1.6774 -0.9908 -0.9840 -0.9477 -0.9373 -0.8129 -0.8129 0.0806 0.0855 0.1015 0.1150 0.7952 0.7987 1.1192 1.1224 1.2183 1.2199 1.2568 1.2590 1.2764 1.2771 2.0219 2.0232 2.1426 2.1548 2.1796 2.2026 3.6817 3.7096 3.7156 3.7623 4.6192 4.6197 4.8016 4.8099 4.8158 4.8215 4.9979 5.0072 5.0842 5.1038 5.2365 5.2371 7.5385 7.5739 7.5878 7.5941 7.8974 7.9352 9.1729 9.1956 10.1542 10.2279 10.2693 10.4162 k = 0.3333 0.5774 0.1714 ( 6810 PWs) bands (ev): -64.4515 -64.4515 -37.3783 -37.3783 -28.8201 -28.8201 -28.8083 -28.8083 -16.7256 -16.7256 -16.6719 -16.6704 -15.2924 -15.2924 -14.7821 -14.7821 -14.6869 -14.6838 -14.4155 -14.4155 -10.0934 -10.0934 -10.0932 -10.0932 -5.9336 -5.9328 -5.8251 -5.8242 -5.4219 -5.4215 -5.3387 -5.3089 -3.7526 -3.7518 -3.7019 -3.7000 -3.5925 -3.5924 -3.5784 -3.5784 -2.8682 -2.8659 -2.8044 -2.7498 -1.6777 -1.6773 -0.9898 -0.9831 -0.9469 -0.9364 -0.8075 -0.8075 0.0787 0.0834 0.0996 0.1132 0.7748 0.7779 1.1052 1.1084 1.2182 1.2195 1.2571 1.2592 1.2760 1.2767 2.0612 2.0624 2.1438 2.1557 2.1804 2.2032 3.6845 3.7126 3.7177 3.7644 4.6114 4.6119 4.7958 4.8055 4.8103 4.8175 5.0016 5.0108 5.0842 5.1034 5.2375 5.2380 7.5400 7.5719 7.5851 7.5942 7.8960 7.9329 9.1734 9.1951 10.1545 10.2286 10.2834 10.4309 k = 0.3333 0.5774 0.1870 ( 6810 PWs) bands (ev): -64.4515 -64.4515 -37.3783 -37.3783 -28.8201 -28.8201 -28.8083 -28.8083 -16.7256 -16.7256 -16.6719 -16.6704 -15.2923 -15.2923 -14.7821 -14.7821 -14.6869 -14.6838 -14.4155 -14.4155 -10.0934 -10.0934 -10.0932 -10.0932 -5.9335 -5.9327 -5.8250 -5.8242 -5.4219 -5.4215 -5.3387 -5.3088 -3.7523 -3.7515 -3.7021 -3.7002 -3.5925 -3.5924 -3.5785 -3.5785 -2.8680 -2.8658 -2.8042 -2.7496 -1.6776 -1.6772 -0.9887 -0.9824 -0.9460 -0.9356 -0.8023 -0.8022 0.0769 0.0814 0.0979 0.1113 0.7545 0.7574 1.0942 1.0970 1.2181 1.2192 1.2573 1.2594 1.2757 1.2763 2.0966 2.0977 2.1458 2.1569 2.1811 2.2037 3.6876 3.7161 3.7193 3.7656 4.6038 4.6044 4.7906 4.8013 4.8053 4.8136 5.0061 5.0150 5.0831 5.1019 5.2383 5.2388 7.5420 7.5700 7.5822 7.5937 7.8952 7.9301 9.1740 9.1943 10.1562 10.2284 10.2990 10.4429 k = 0.3333 0.5774 0.2026 ( 6810 PWs) bands (ev): -64.4515 -64.4515 -37.3783 -37.3783 -28.8201 -28.8201 -28.8083 -28.8083 -16.7256 -16.7256 -16.6719 -16.6704 -15.2923 -15.2923 -14.7821 -14.7821 -14.6869 -14.6838 -14.4156 -14.4156 -10.0934 -10.0934 -10.0932 -10.0932 -5.9335 -5.9327 -5.8249 -5.8242 -5.4218 -5.4215 -5.3388 -5.3087 -3.7520 -3.7513 -3.7021 -3.7004 -3.5925 -3.5924 -3.5787 -3.5787 -2.8678 -2.8658 -2.8041 -2.7495 -1.6775 -1.6771 -0.9876 -0.9819 -0.9451 -0.9350 -0.7973 -0.7973 0.0753 0.0795 0.0962 0.1096 0.7354 0.7378 1.0855 1.0880 1.2181 1.2190 1.2576 1.2595 1.2756 1.2761 2.1258 2.1276 2.1501 2.1593 2.1819 2.2040 3.6910 3.7201 3.7201 3.7661 4.5967 4.5972 4.7860 4.7972 4.8010 4.8097 5.0112 5.0199 5.0811 5.0993 5.2392 5.2396 7.5444 7.5685 7.5794 7.5927 7.8949 7.9270 9.1749 9.1932 10.1592 10.2272 10.3160 10.4516 k = 0.3333 0.5774 0.2181 ( 6840 PWs) bands (ev): -64.4515 -64.4515 -37.3783 -37.3783 -28.8202 -28.8202 -28.8084 -28.8084 -16.7256 -16.7256 -16.6719 -16.6704 -15.2923 -15.2923 -14.7822 -14.7821 -14.6869 -14.6838 -14.4156 -14.4156 -10.0934 -10.0934 -10.0932 -10.0932 -5.9334 -5.9327 -5.8249 -5.8242 -5.4218 -5.4215 -5.3388 -5.3086 -3.7517 -3.7511 -3.7022 -3.7007 -3.5925 -3.5924 -3.5788 -3.5788 -2.8676 -2.8659 -2.8039 -2.7494 -1.6774 -1.6770 -0.9866 -0.9815 -0.9443 -0.9344 -0.7928 -0.7927 0.0739 0.0776 0.0948 0.1081 0.7179 0.7200 1.0789 1.0811 1.2181 1.2188 1.2578 1.2596 1.2755 1.2759 2.1405 2.1461 2.1647 2.1687 2.1827 2.2043 3.6946 3.7203 3.7244 3.7657 4.5903 4.5907 4.7822 4.7934 4.7975 4.8061 5.0167 5.0251 5.0782 5.0960 5.2399 5.2403 7.5472 7.5672 7.5767 7.5911 7.8953 7.9236 9.1759 9.1918 10.1635 10.2248 10.3340 10.4565 k = 0.3333 0.5774 0.2337 ( 6825 PWs) bands (ev): -64.4515 -64.4515 -37.3783 -37.3783 -28.8202 -28.8201 -28.8084 -28.8084 -16.7256 -16.7256 -16.6719 -16.6704 -15.2923 -15.2923 -14.7822 -14.7821 -14.6869 -14.6838 -14.4156 -14.4156 -10.0934 -10.0934 -10.0933 -10.0932 -5.9333 -5.9328 -5.8248 -5.8242 -5.4217 -5.4215 -5.3389 -5.3085 -3.7515 -3.7510 -3.7022 -3.7009 -3.5925 -3.5925 -3.5789 -3.5789 -2.8674 -2.8659 -2.8038 -2.7493 -1.6773 -1.6770 -0.9855 -0.9813 -0.9435 -0.9340 -0.7888 -0.7888 0.0729 0.0760 0.0935 0.1067 0.7029 0.7046 1.0740 1.0757 1.2181 1.2187 1.2580 1.2596 1.2754 1.2758 2.1444 2.1509 2.1834 2.1855 2.1871 2.2045 3.6983 3.7199 3.7289 3.7645 4.5847 4.5850 4.7794 4.7899 4.7949 4.8026 5.0223 5.0307 5.0745 5.0920 5.2405 5.2408 7.5503 7.5664 7.5742 7.5891 7.8964 7.9200 9.1770 9.1902 10.1689 10.2212 10.3525 10.4573 k = 0.3333 0.5774 0.2493 ( 6828 PWs) bands (ev): -64.4515 -64.4515 -37.3783 -37.3783 -28.8202 -28.8202 -28.8084 -28.8084 -16.7256 -16.7256 -16.6719 -16.6704 -15.2923 -15.2923 -14.7822 -14.7821 -14.6869 -14.6838 -14.4156 -14.4156 -10.0934 -10.0933 -10.0933 -10.0933 -5.9332 -5.9328 -5.8248 -5.8242 -5.4217 -5.4215 -5.3389 -5.3084 -3.7513 -3.7509 -3.7022 -3.7012 -3.5925 -3.5925 -3.5790 -3.5790 -2.8672 -2.8660 -2.8037 -2.7492 -1.6772 -1.6769 -0.9845 -0.9813 -0.9429 -0.9337 -0.7856 -0.7856 0.0721 0.0745 0.0926 0.1057 0.6908 0.6920 1.0705 1.0718 1.2182 1.2186 1.2582 1.2597 1.2754 1.2757 2.1464 2.1518 2.1840 2.2034 2.2043 2.2046 3.7020 3.7188 3.7334 3.7627 4.5801 4.5804 4.7774 4.7868 4.7932 4.7996 5.0278 5.0365 5.0701 5.0878 5.2410 5.2413 7.5533 7.5659 7.5719 7.5870 7.8980 7.9164 9.1783 9.1884 10.1752 10.2165 10.3711 10.4542 k = 0.3333 0.5774 0.2649 ( 6825 PWs) bands (ev): -64.4515 -64.4515 -37.3783 -37.3783 -28.8201 -28.8201 -28.8084 -28.8084 -16.7256 -16.7256 -16.6719 -16.6704 -15.2922 -15.2922 -14.7822 -14.7821 -14.6869 -14.6838 -14.4156 -14.4156 -10.0934 -10.0933 -10.0933 -10.0933 -5.9331 -5.9329 -5.8247 -5.8242 -5.4217 -5.4215 -5.3390 -5.3083 -3.7511 -3.7508 -3.7021 -3.7013 -3.5925 -3.5925 -3.5790 -3.5790 -2.8669 -2.8662 -2.8036 -2.7491 -1.6771 -1.6769 -0.9836 -0.9814 -0.9424 -0.9334 -0.7832 -0.7832 0.0717 0.0733 0.0918 0.1048 0.6819 0.6827 1.0682 1.0690 1.2182 1.2185 1.2583 1.2597 1.2754 1.2756 2.1480 2.1517 2.1845 2.2047 2.2166 2.2172 3.7056 3.7171 3.7375 3.7604 4.5768 4.5770 4.7763 4.7843 4.7924 4.7969 5.0327 5.0424 5.0652 5.0839 5.2414 5.2416 7.5561 7.5659 7.5700 7.5850 7.9002 7.9127 9.1798 9.1866 10.1822 10.2107 10.3893 10.4473 k = 0.3333 0.5774 0.2805 ( 6825 PWs) bands (ev): -64.4515 -64.4515 -37.3783 -37.3783 -28.8201 -28.8201 -28.8084 -28.8084 -16.7256 -16.7256 -16.6719 -16.6704 -15.2922 -15.2922 -14.7822 -14.7821 -14.6869 -14.6838 -14.4156 -14.4156 -10.0934 -10.0933 -10.0933 -10.0933 -5.9331 -5.9329 -5.8247 -5.8242 -5.4216 -5.4215 -5.3390 -5.3083 -3.7510 -3.7508 -3.7021 -3.7015 -3.5925 -3.5925 -3.5791 -3.5791 -2.8667 -2.8663 -2.8036 -2.7491 -1.6770 -1.6769 -0.9829 -0.9817 -0.9421 -0.9333 -0.7817 -0.7817 0.0716 0.0724 0.0914 0.1044 0.6765 0.6769 1.0669 1.0674 1.2183 1.2184 1.2584 1.2597 1.2754 1.2755 2.1492 2.1511 2.1848 2.2047 2.2247 2.2250 3.7090 3.7148 3.7408 3.7583 4.5747 4.5748 4.7758 4.7826 4.7924 4.7948 5.0361 5.0484 5.0599 5.0809 5.2417 5.2418 7.5581 7.5663 7.5683 7.5834 7.9028 7.9092 9.1814 9.1848 10.1895 10.2041 10.4061 10.4372 k = 0.3333 0.5774 0.2960 ( 6828 PWs) bands (ev): -64.4515 -64.4515 -37.3783 -37.3783 -28.8201 -28.8201 -28.8084 -28.8084 -16.7256 -16.7256 -16.6719 -16.6704 -15.2922 -15.2922 -14.7822 -14.7822 -14.6869 -14.6838 -14.4156 -14.4156 -10.0933 -10.0933 -10.0933 -10.0933 -5.9330 -5.9330 -5.8247 -5.8242 -5.4216 -5.4216 -5.3390 -5.3083 -3.7509 -3.7509 -3.7020 -3.7016 -3.5925 -3.5925 -3.5791 -3.5791 -2.8665 -2.8665 -2.8036 -2.7491 -1.6770 -1.6770 -0.9822 -0.9822 -0.9420 -0.9333 -0.7812 -0.7812 0.0719 0.0719 0.0912 0.1042 0.6749 0.6749 1.0667 1.0667 1.2183 1.2183 1.2584 1.2597 1.2755 1.2755 2.1503 2.1503 2.1849 2.2048 2.2276 2.2276 3.7121 3.7121 3.7422 3.7574 4.5741 4.5741 4.7757 4.7820 4.7932 4.7932 5.0375 5.0543 5.0543 5.0798 5.2418 5.2418 7.5588 7.5671 7.5671 7.5828 7.9059 7.9059 9.1831 9.1831 10.1970 10.1970 10.4174 10.4281 Writing output data file TaTlxPO4x2.save init_run : 1.64s CPU 0.98s WALL ( 1 calls) electrons : 1024.23s CPU 883.35s WALL ( 1 calls) Called by init_run: wfcinit : 0.01s CPU 0.01s WALL ( 1 calls) potinit : 0.15s CPU 0.10s WALL ( 1 calls) Called by electrons: c_bands : 1024.22s CPU 883.33s WALL ( 1 calls) v_of_rho : 0.01s CPU 0.01s WALL ( 1 calls) v_h : 0.00s CPU 0.00s WALL ( 1 calls) v_xc : 0.01s CPU 0.01s WALL ( 1 calls) newd : 0.44s CPU 0.26s WALL ( 1 calls) Called by c_bands: init_us_2 : 0.54s CPU 0.63s WALL ( 266 calls) cegterg : 949.18s CPU 840.05s WALL ( 1128 calls) Called by sum_band: Called by *egterg: h_psi : 465.74s CPU 335.36s WALL ( 21721 calls) s_psi : 40.57s CPU 35.60s WALL ( 21721 calls) g_psi : 1.14s CPU 1.01s WALL ( 20327 calls) cdiaghg : 383.80s CPU 383.99s WALL ( 20593 calls) cegterg:over : 41.88s CPU 41.31s WALL ( 20327 calls) cegterg:upda : 41.61s CPU 42.28s WALL ( 20327 calls) cegterg:last : 15.97s CPU 16.00s WALL ( 1926 calls) cdiaghg:chol : 22.16s CPU 22.45s WALL ( 20593 calls) cdiaghg:inve : 16.54s CPU 16.88s WALL ( 20593 calls) cdiaghg:para : 28.37s CPU 29.01s WALL ( 41186 calls) Called by h_psi: h_psi:vloc : 382.84s CPU 261.91s WALL ( 21721 calls) h_psi:vnl : 81.56s CPU 72.12s WALL ( 21721 calls) add_vuspsi : 42.17s CPU 36.81s WALL ( 21721 calls) General routines calbec : 39.25s CPU 35.23s WALL ( 21721 calls) fft : 0.03s CPU 0.02s WALL ( 19 calls) ffts : 0.02s CPU 0.01s WALL ( 4 calls) fftw : 359.64s CPU 240.72s WALL ( 2151200 calls) interpolate : 0.03s CPU 0.02s WALL ( 4 calls) davcio : 0.52s CPU 2.22s WALL ( 532 calls) Parallel routines fft_scatter : 111.67s CPU 97.87s WALL ( 2151223 calls) PWSCF : 17m38.93s CPU 15m31.35s WALL This run was terminated on: 4:57:28 12Feb2017 =------------------------------------------------------------------------------= JOB DONE. =------------------------------------------------------------------------------=