Program PWSCF v.5.4.0 starts on 12Feb2017 at 4: 1:54 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: ./RbGeIO6.save/ file I.rel-pbe-n-rrkjus_psl.1.0.0.UPF: wavefunction(s) 5S renormalized file Rb.rel-pbe-spn-rrkjus_psl.1.0.0.UPF: wavefunction(s) 4S renormalized Subspace diagonalization in iterative solution of the eigenvalue problem: one sub-group per 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 2568 1132 175 Max 57 33 10 2572 1142 180 Sum 2017 1159 337 92481 40919 6365 bravais-lattice index = 14 lattice parameter (alat) = 9.4902 a.u. unit-cell volume = 939.7858 (a.u.)^3 number of atoms/cell = 9 number of atomic types = 4 number of electrons = 56.00 number of Kohn-Sham states= 68 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)= 9.490204 celldm(2)= 1.000000 celldm(3)= 1.269614 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 1.269614 ) 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 0.787641 ) PseudoPot. # 1 for Ge read from file: /users/gautes/Pseudo/Ge.rel-pbe-n-rrkjus_psl.1.0.0.UPF MD5 check sum: 069ab8842bb693aa9ce6e533f48e0b78 Pseudo is Ultrasoft + core correction, Zval = 4.0 Generated using "atomic" code by A. Dal Corso v.5.0.2 svn rev. 9656 Using radial grid of 1207 points, 6 beta functions with: l(1) = 0 l(2) = 0 l(3) = 1 l(4) = 1 l(5) = 1 l(6) = 1 Q(r) pseudized with 0 coefficients PseudoPot. # 2 for O read from file: /users/gautes/Pseudo/O.rel-pbe-n-rrkjus_psl.1.0.0.UPF MD5 check sum: e551570ea340e0688630c94d366e26e3 Pseudo is Ultrasoft + core correction, Zval = 6.0 Generated using "atomic" code by A. Dal Corso v.5.0.2 svn rev. 9656 Using radial grid of 1095 points, 6 beta functions with: l(1) = 0 l(2) = 0 l(3) = 1 l(4) = 1 l(5) = 1 l(6) = 1 Q(r) pseudized with 0 coefficients PseudoPot. # 3 for I read from file: /users/gautes/Pseudo/I.rel-pbe-n-rrkjus_psl.1.0.0.UPF MD5 check sum: 7c65668ffc3f6431347fa26e98076fd5 Pseudo is Ultrasoft + core correction, Zval = 7.0 Generated using "atomic" code by A. Dal Corso v.5.0.2 svn rev. 9656 Using radial grid of 1247 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 Rb read from file: /users/gautes/Pseudo/Rb.rel-pbe-spn-rrkjus_psl.1.0.0.UPF MD5 check sum: 948b8f0a9070089a35782939cf30e963 Pseudo is Ultrasoft + core correction, Zval = 9.0 Generated using "atomic" code by A. Dal Corso v.5.0.2 svn rev. 9656 Using radial grid of 1219 points, 10 beta functions with: l(1) = 0 l(2) = 0 l(3) = 1 l(4) = 1 l(5) = 1 l(6) = 1 l(7) = 2 l(8) = 2 l(9) = 2 l(10) = 2 Q(r) pseudized with 0 coefficients atomic species valence mass pseudopotential Ge 4.00 72.64000 Ge( 1.00) O 6.00 15.99940 O( 1.00) I 7.00 126.90450 I( 1.00) Rb 9.00 85.46780 Rb( 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 [0,1,0] 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 [1,-1,0] cryst. s( 5) = ( 0 -1 0 ) ( -1 0 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 [2,1,0] cryst. s( 6) = ( 1 1 0 ) ( 0 -1 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 -6 -5 180 deg rotation - cart. axis [0,1,0] 3C2' 5 6 -2 180 deg rotation - cryst. axis [1,-1,0] Cartesian axes number of k points= 284 Fermi-Dirac smearing, width (Ry)= 0.0010 cart. coord. in units 2pi/alat k( 1) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0035211 k( 2) = ( 0.0135135 0.0078020 -0.0000000), wk = 0.0035211 k( 3) = ( 0.0270270 0.0156041 -0.0000000), wk = 0.0035211 k( 4) = ( 0.0405405 0.0234061 -0.0000000), wk = 0.0035211 k( 5) = ( 0.0540540 0.0312081 -0.0000000), wk = 0.0035211 k( 6) = ( 0.0675676 0.0390102 -0.0000000), wk = 0.0035211 k( 7) = ( 0.0810811 0.0468122 -0.0000000), wk = 0.0035211 k( 8) = ( 0.0945946 0.0546142 -0.0000000), wk = 0.0035211 k( 9) = ( 0.1081081 0.0624162 -0.0000000), wk = 0.0035211 k( 10) = ( 0.1216216 0.0702183 -0.0000000), wk = 0.0035211 k( 11) = ( 0.1351351 0.0780203 -0.0000000), wk = 0.0035211 k( 12) = ( 0.1486486 0.0858223 -0.0000000), wk = 0.0035211 k( 13) = ( 0.1621622 0.0936244 -0.0000000), wk = 0.0035211 k( 14) = ( 0.1756757 0.1014264 -0.0000000), wk = 0.0035211 k( 15) = ( 0.1891892 0.1092284 -0.0000000), wk = 0.0035211 k( 16) = ( 0.2027027 0.1170305 -0.0000000), wk = 0.0035211 k( 17) = ( 0.2162162 0.1248325 -0.0000000), wk = 0.0035211 k( 18) = ( 0.2297297 0.1326345 -0.0000000), wk = 0.0035211 k( 19) = ( 0.2432432 0.1404366 -0.0000000), wk = 0.0035211 k( 20) = ( 0.2567568 0.1482386 -0.0000000), wk = 0.0035211 k( 21) = ( 0.2702703 0.1560406 -0.0000000), wk = 0.0035211 k( 22) = ( 0.2837838 0.1638426 -0.0000000), wk = 0.0035211 k( 23) = ( 0.2972973 0.1716447 -0.0000000), wk = 0.0035211 k( 24) = ( 0.3108108 0.1794467 -0.0000000), wk = 0.0035211 k( 25) = ( 0.3243243 0.1872487 -0.0000000), wk = 0.0035211 k( 26) = ( 0.3378378 0.1950508 -0.0000000), wk = 0.0035211 k( 27) = ( 0.3513514 0.2028528 -0.0000000), wk = 0.0035211 k( 28) = ( 0.3648649 0.2106548 -0.0000000), wk = 0.0035211 k( 29) = ( 0.3783784 0.2184569 -0.0000000), wk = 0.0035211 k( 30) = ( 0.3918919 0.2262589 -0.0000000), wk = 0.0035211 k( 31) = ( 0.4054054 0.2340609 -0.0000000), wk = 0.0035211 k( 32) = ( 0.4189189 0.2418630 -0.0000000), wk = 0.0035211 k( 33) = ( 0.4324324 0.2496650 -0.0000000), wk = 0.0035211 k( 34) = ( 0.4459459 0.2574670 -0.0000000), wk = 0.0035211 k( 35) = ( 0.4594595 0.2652690 -0.0000000), wk = 0.0035211 k( 36) = ( 0.4729730 0.2730711 -0.0000000), wk = 0.0035211 k( 37) = ( 0.4864865 0.2808731 -0.0000000), wk = 0.0035211 k( 38) = ( 0.5000000 0.2886751 -0.0000000), wk = 0.0035211 k( 39) = ( 0.5000000 0.2886751 -0.0000000), wk = 0.0035211 k( 40) = ( 0.4920635 0.3024216 -0.0000000), wk = 0.0035211 k( 41) = ( 0.4841270 0.3161680 -0.0000000), wk = 0.0035211 k( 42) = ( 0.4761905 0.3299144 -0.0000000), wk = 0.0035211 k( 43) = ( 0.4682540 0.3436609 -0.0000000), wk = 0.0035211 k( 44) = ( 0.4603175 0.3574073 -0.0000000), wk = 0.0035211 k( 45) = ( 0.4523810 0.3711537 -0.0000000), wk = 0.0035211 k( 46) = ( 0.4444444 0.3849002 -0.0000000), wk = 0.0035211 k( 47) = ( 0.4365079 0.3986466 -0.0000000), wk = 0.0035211 k( 48) = ( 0.4285714 0.4123930 -0.0000000), wk = 0.0035211 k( 49) = ( 0.4206349 0.4261395 -0.0000000), wk = 0.0035211 k( 50) = ( 0.4126984 0.4398859 -0.0000000), wk = 0.0035211 k( 51) = ( 0.4047619 0.4536324 -0.0000000), wk = 0.0035211 k( 52) = ( 0.3968254 0.4673788 -0.0000000), wk = 0.0035211 k( 53) = ( 0.3888889 0.4811252 -0.0000000), wk = 0.0035211 k( 54) = ( 0.3809524 0.4948717 -0.0000000), wk = 0.0035211 k( 55) = ( 0.3730159 0.5086181 -0.0000000), wk = 0.0035211 k( 56) = ( 0.3650794 0.5223645 -0.0000000), wk = 0.0035211 k( 57) = ( 0.3571429 0.5361110 -0.0000000), wk = 0.0035211 k( 58) = ( 0.3492063 0.5498574 -0.0000000), wk = 0.0035211 k( 59) = ( 0.3412698 0.5636038 -0.0000000), wk = 0.0035211 k( 60) = ( 0.3333333 0.5773503 -0.0000000), wk = 0.0035211 k( 61) = ( 0.3333333 0.5773503 -0.0000000), wk = 0.0035211 k( 62) = ( 0.3253968 0.5636038 -0.0000000), wk = 0.0035211 k( 63) = ( 0.3174603 0.5498574 -0.0000000), wk = 0.0035211 k( 64) = ( 0.3095238 0.5361110 -0.0000000), wk = 0.0035211 k( 65) = ( 0.3015873 0.5223645 -0.0000000), wk = 0.0035211 k( 66) = ( 0.2936508 0.5086181 -0.0000000), wk = 0.0035211 k( 67) = ( 0.2857143 0.4948717 -0.0000000), wk = 0.0035211 k( 68) = ( 0.2777778 0.4811252 -0.0000000), wk = 0.0035211 k( 69) = ( 0.2698413 0.4673788 -0.0000000), wk = 0.0035211 k( 70) = ( 0.2619048 0.4536324 -0.0000000), wk = 0.0035211 k( 71) = ( 0.2539683 0.4398859 -0.0000000), wk = 0.0035211 k( 72) = ( 0.2460317 0.4261395 -0.0000000), wk = 0.0035211 k( 73) = ( 0.2380952 0.4123931 -0.0000000), wk = 0.0035211 k( 74) = ( 0.2301587 0.3986466 -0.0000000), wk = 0.0035211 k( 75) = ( 0.2222222 0.3849002 -0.0000000), wk = 0.0035211 k( 76) = ( 0.2142857 0.3711537 -0.0000000), wk = 0.0035211 k( 77) = ( 0.2063492 0.3574073 -0.0000000), wk = 0.0035211 k( 78) = ( 0.1984127 0.3436609 -0.0000000), wk = 0.0035211 k( 79) = ( 0.1904762 0.3299144 -0.0000000), wk = 0.0035211 k( 80) = ( 0.1825397 0.3161680 -0.0000000), wk = 0.0035211 k( 81) = ( 0.1746032 0.3024216 -0.0000000), wk = 0.0035211 k( 82) = ( 0.1666667 0.2886751 -0.0000000), wk = 0.0035211 k( 83) = ( 0.1587302 0.2749287 -0.0000000), wk = 0.0035211 k( 84) = ( 0.1507937 0.2611823 -0.0000000), wk = 0.0035211 k( 85) = ( 0.1428571 0.2474358 -0.0000000), wk = 0.0035211 k( 86) = ( 0.1349206 0.2336894 -0.0000000), wk = 0.0035211 k( 87) = ( 0.1269841 0.2199430 -0.0000000), wk = 0.0035211 k( 88) = ( 0.1190476 0.2061965 -0.0000000), wk = 0.0035211 k( 89) = ( 0.1111111 0.1924501 -0.0000000), wk = 0.0035211 k( 90) = ( 0.1031746 0.1787036 -0.0000000), wk = 0.0035211 k( 91) = ( 0.0952381 0.1649572 -0.0000000), wk = 0.0035211 k( 92) = ( 0.0873016 0.1512108 -0.0000000), wk = 0.0035211 k( 93) = ( 0.0793651 0.1374644 -0.0000000), wk = 0.0035211 k( 94) = ( 0.0714286 0.1237179 -0.0000000), wk = 0.0035211 k( 95) = ( 0.0634921 0.1099715 -0.0000000), wk = 0.0035211 k( 96) = ( 0.0555556 0.0962251 -0.0000000), wk = 0.0035211 k( 97) = ( 0.0476191 0.0824786 -0.0000000), wk = 0.0035211 k( 98) = ( 0.0396825 0.0687322 -0.0000000), wk = 0.0035211 k( 99) = ( 0.0317460 0.0549857 -0.0000000), wk = 0.0035211 k( 100) = ( 0.0238095 0.0412393 -0.0000000), wk = 0.0035211 k( 101) = ( 0.0158730 0.0274929 -0.0000000), wk = 0.0035211 k( 102) = ( 0.0079365 0.0137464 -0.0000000), wk = 0.0035211 k( 103) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0035211 k( 104) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0035211 k( 105) = ( 0.0000000 0.0000000 0.0157528), wk = 0.0035211 k( 106) = ( 0.0000000 0.0000000 0.0315056), wk = 0.0035211 k( 107) = ( 0.0000000 0.0000000 0.0472585), wk = 0.0035211 k( 108) = ( 0.0000000 0.0000000 0.0630113), wk = 0.0035211 k( 109) = ( 0.0000000 0.0000000 0.0787641), wk = 0.0035211 k( 110) = ( 0.0000000 0.0000000 0.0945169), wk = 0.0035211 k( 111) = ( 0.0000000 0.0000000 0.1102698), wk = 0.0035211 k( 112) = ( 0.0000000 0.0000000 0.1260226), wk = 0.0035211 k( 113) = ( 0.0000000 0.0000000 0.1417754), wk = 0.0035211 k( 114) = ( 0.0000000 0.0000000 0.1575282), wk = 0.0035211 k( 115) = ( 0.0000000 0.0000000 0.1732811), wk = 0.0035211 k( 116) = ( 0.0000000 0.0000000 0.1890339), wk = 0.0035211 k( 117) = ( 0.0000000 0.0000000 0.2047867), wk = 0.0035211 k( 118) = ( 0.0000000 0.0000000 0.2205395), wk = 0.0035211 k( 119) = ( 0.0000000 0.0000000 0.2362923), wk = 0.0035211 k( 120) = ( 0.0000000 0.0000000 0.2520452), wk = 0.0035211 k( 121) = ( 0.0000000 0.0000000 0.2677980), wk = 0.0035211 k( 122) = ( 0.0000000 0.0000000 0.2835508), wk = 0.0035211 k( 123) = ( 0.0000000 0.0000000 0.2993036), wk = 0.0035211 k( 124) = ( 0.0000000 0.0000000 0.3150565), wk = 0.0035211 k( 125) = ( 0.0000000 0.0000000 0.3308093), wk = 0.0035211 k( 126) = ( 0.0000000 0.0000000 0.3465621), wk = 0.0035211 k( 127) = ( 0.0000000 0.0000000 0.3623149), wk = 0.0035211 k( 128) = ( 0.0000000 0.0000000 0.3780678), wk = 0.0035211 k( 129) = ( 0.0000000 0.0000000 0.3938206), wk = 0.0035211 k( 130) = ( 0.0000000 0.0000000 0.3938206), wk = 0.0035211 k( 131) = ( 0.0135135 0.0078020 0.3938206), wk = 0.0035211 k( 132) = ( 0.0270270 0.0156041 0.3938206), wk = 0.0035211 k( 133) = ( 0.0405405 0.0234061 0.3938206), wk = 0.0035211 k( 134) = ( 0.0540540 0.0312081 0.3938206), wk = 0.0035211 k( 135) = ( 0.0675676 0.0390102 0.3938206), wk = 0.0035211 k( 136) = ( 0.0810811 0.0468122 0.3938206), wk = 0.0035211 k( 137) = ( 0.0945946 0.0546142 0.3938206), wk = 0.0035211 k( 138) = ( 0.1081081 0.0624162 0.3938206), wk = 0.0035211 k( 139) = ( 0.1216216 0.0702183 0.3938206), wk = 0.0035211 k( 140) = ( 0.1351351 0.0780203 0.3938206), wk = 0.0035211 k( 141) = ( 0.1486486 0.0858223 0.3938206), wk = 0.0035211 k( 142) = ( 0.1621622 0.0936244 0.3938206), wk = 0.0035211 k( 143) = ( 0.1756757 0.1014264 0.3938206), wk = 0.0035211 k( 144) = ( 0.1891892 0.1092284 0.3938206), wk = 0.0035211 k( 145) = ( 0.2027027 0.1170305 0.3938206), wk = 0.0035211 k( 146) = ( 0.2162162 0.1248325 0.3938206), wk = 0.0035211 k( 147) = ( 0.2297297 0.1326345 0.3938206), wk = 0.0035211 k( 148) = ( 0.2432432 0.1404366 0.3938206), wk = 0.0035211 k( 149) = ( 0.2567568 0.1482386 0.3938206), wk = 0.0035211 k( 150) = ( 0.2702703 0.1560406 0.3938206), wk = 0.0035211 k( 151) = ( 0.2837838 0.1638426 0.3938206), wk = 0.0035211 k( 152) = ( 0.2972973 0.1716447 0.3938206), wk = 0.0035211 k( 153) = ( 0.3108108 0.1794467 0.3938206), wk = 0.0035211 k( 154) = ( 0.3243243 0.1872487 0.3938206), wk = 0.0035211 k( 155) = ( 0.3378378 0.1950508 0.3938206), wk = 0.0035211 k( 156) = ( 0.3513514 0.2028528 0.3938206), wk = 0.0035211 k( 157) = ( 0.3648649 0.2106548 0.3938206), wk = 0.0035211 k( 158) = ( 0.3783784 0.2184569 0.3938206), wk = 0.0035211 k( 159) = ( 0.3918919 0.2262589 0.3938206), wk = 0.0035211 k( 160) = ( 0.4054054 0.2340609 0.3938206), wk = 0.0035211 k( 161) = ( 0.4189189 0.2418630 0.3938206), wk = 0.0035211 k( 162) = ( 0.4324324 0.2496650 0.3938206), wk = 0.0035211 k( 163) = ( 0.4459459 0.2574670 0.3938206), wk = 0.0035211 k( 164) = ( 0.4594595 0.2652690 0.3938206), wk = 0.0035211 k( 165) = ( 0.4729730 0.2730711 0.3938206), wk = 0.0035211 k( 166) = ( 0.4864865 0.2808731 0.3938206), wk = 0.0035211 k( 167) = ( 0.5000000 0.2886751 0.3938206), wk = 0.0035211 k( 168) = ( 0.5000000 0.2886751 0.3938206), wk = 0.0035211 k( 169) = ( 0.4920635 0.3024216 0.3938206), wk = 0.0035211 k( 170) = ( 0.4841270 0.3161680 0.3938206), wk = 0.0035211 k( 171) = ( 0.4761905 0.3299144 0.3938206), wk = 0.0035211 k( 172) = ( 0.4682540 0.3436609 0.3938206), wk = 0.0035211 k( 173) = ( 0.4603175 0.3574073 0.3938206), wk = 0.0035211 k( 174) = ( 0.4523810 0.3711537 0.3938206), wk = 0.0035211 k( 175) = ( 0.4444444 0.3849002 0.3938206), wk = 0.0035211 k( 176) = ( 0.4365079 0.3986466 0.3938206), wk = 0.0035211 k( 177) = ( 0.4285714 0.4123930 0.3938206), wk = 0.0035211 k( 178) = ( 0.4206349 0.4261395 0.3938206), wk = 0.0035211 k( 179) = ( 0.4126984 0.4398859 0.3938206), wk = 0.0035211 k( 180) = ( 0.4047619 0.4536324 0.3938206), wk = 0.0035211 k( 181) = ( 0.3968254 0.4673788 0.3938206), wk = 0.0035211 k( 182) = ( 0.3888889 0.4811252 0.3938206), wk = 0.0035211 k( 183) = ( 0.3809524 0.4948717 0.3938206), wk = 0.0035211 k( 184) = ( 0.3730159 0.5086181 0.3938206), wk = 0.0035211 k( 185) = ( 0.3650794 0.5223645 0.3938206), wk = 0.0035211 k( 186) = ( 0.3571429 0.5361110 0.3938206), wk = 0.0035211 k( 187) = ( 0.3492063 0.5498574 0.3938206), wk = 0.0035211 k( 188) = ( 0.3412698 0.5636038 0.3938206), wk = 0.0035211 k( 189) = ( 0.3333333 0.5773503 0.3938206), wk = 0.0035211 k( 190) = ( 0.3333333 0.5773503 0.3938206), wk = 0.0035211 k( 191) = ( 0.3253968 0.5636038 0.3938206), wk = 0.0035211 k( 192) = ( 0.3174603 0.5498574 0.3938206), wk = 0.0035211 k( 193) = ( 0.3095238 0.5361110 0.3938206), wk = 0.0035211 k( 194) = ( 0.3015873 0.5223645 0.3938206), wk = 0.0035211 k( 195) = ( 0.2936508 0.5086181 0.3938206), wk = 0.0035211 k( 196) = ( 0.2857143 0.4948717 0.3938206), wk = 0.0035211 k( 197) = ( 0.2777778 0.4811252 0.3938206), wk = 0.0035211 k( 198) = ( 0.2698413 0.4673788 0.3938206), wk = 0.0035211 k( 199) = ( 0.2619048 0.4536324 0.3938206), wk = 0.0035211 k( 200) = ( 0.2539683 0.4398859 0.3938206), wk = 0.0035211 k( 201) = ( 0.2460317 0.4261395 0.3938206), wk = 0.0035211 k( 202) = ( 0.2380952 0.4123931 0.3938206), wk = 0.0035211 k( 203) = ( 0.2301587 0.3986466 0.3938206), wk = 0.0035211 k( 204) = ( 0.2222222 0.3849002 0.3938206), wk = 0.0035211 k( 205) = ( 0.2142857 0.3711537 0.3938206), wk = 0.0035211 k( 206) = ( 0.2063492 0.3574073 0.3938206), wk = 0.0035211 k( 207) = ( 0.1984127 0.3436609 0.3938206), wk = 0.0035211 k( 208) = ( 0.1904762 0.3299144 0.3938206), wk = 0.0035211 k( 209) = ( 0.1825397 0.3161680 0.3938206), wk = 0.0035211 k( 210) = ( 0.1746032 0.3024216 0.3938206), wk = 0.0035211 k( 211) = ( 0.1666667 0.2886751 0.3938206), wk = 0.0035211 k( 212) = ( 0.1587302 0.2749287 0.3938206), wk = 0.0035211 k( 213) = ( 0.1507937 0.2611823 0.3938206), wk = 0.0035211 k( 214) = ( 0.1428571 0.2474358 0.3938206), wk = 0.0035211 k( 215) = ( 0.1349206 0.2336894 0.3938206), wk = 0.0035211 k( 216) = ( 0.1269841 0.2199430 0.3938206), wk = 0.0035211 k( 217) = ( 0.1190476 0.2061965 0.3938206), wk = 0.0035211 k( 218) = ( 0.1111111 0.1924501 0.3938206), wk = 0.0035211 k( 219) = ( 0.1031746 0.1787036 0.3938206), wk = 0.0035211 k( 220) = ( 0.0952381 0.1649572 0.3938206), wk = 0.0035211 k( 221) = ( 0.0873016 0.1512108 0.3938206), wk = 0.0035211 k( 222) = ( 0.0793651 0.1374644 0.3938206), wk = 0.0035211 k( 223) = ( 0.0714286 0.1237179 0.3938206), wk = 0.0035211 k( 224) = ( 0.0634921 0.1099715 0.3938206), wk = 0.0035211 k( 225) = ( 0.0555556 0.0962251 0.3938206), wk = 0.0035211 k( 226) = ( 0.0476191 0.0824786 0.3938206), wk = 0.0035211 k( 227) = ( 0.0396825 0.0687322 0.3938206), wk = 0.0035211 k( 228) = ( 0.0317460 0.0549857 0.3938206), wk = 0.0035211 k( 229) = ( 0.0238095 0.0412393 0.3938206), wk = 0.0035211 k( 230) = ( 0.0158730 0.0274929 0.3938206), wk = 0.0035211 k( 231) = ( 0.0079365 0.0137464 0.3938206), wk = 0.0035211 k( 232) = ( 0.0000000 0.0000000 0.3938206), wk = 0.0035211 k( 233) = ( 0.5000000 0.2886751 0.3938206), wk = 0.0035211 k( 234) = ( 0.5000000 0.2886751 0.3780678), wk = 0.0035211 k( 235) = ( 0.5000000 0.2886751 0.3623149), wk = 0.0035211 k( 236) = ( 0.5000000 0.2886751 0.3465621), wk = 0.0035211 k( 237) = ( 0.5000000 0.2886751 0.3308093), wk = 0.0035211 k( 238) = ( 0.5000000 0.2886751 0.3150565), wk = 0.0035211 k( 239) = ( 0.5000000 0.2886751 0.2993036), wk = 0.0035211 k( 240) = ( 0.5000000 0.2886751 0.2835508), wk = 0.0035211 k( 241) = ( 0.5000000 0.2886751 0.2677980), wk = 0.0035211 k( 242) = ( 0.5000000 0.2886751 0.2520452), wk = 0.0035211 k( 243) = ( 0.5000000 0.2886751 0.2362923), wk = 0.0035211 k( 244) = ( 0.5000000 0.2886751 0.2205395), wk = 0.0035211 k( 245) = ( 0.5000000 0.2886751 0.2047867), wk = 0.0035211 k( 246) = ( 0.5000000 0.2886751 0.1890339), wk = 0.0035211 k( 247) = ( 0.5000000 0.2886751 0.1732811), wk = 0.0035211 k( 248) = ( 0.5000000 0.2886751 0.1575282), wk = 0.0035211 k( 249) = ( 0.5000000 0.2886751 0.1417754), wk = 0.0035211 k( 250) = ( 0.5000000 0.2886751 0.1260226), wk = 0.0035211 k( 251) = ( 0.5000000 0.2886751 0.1102698), wk = 0.0035211 k( 252) = ( 0.5000000 0.2886751 0.0945169), wk = 0.0035211 k( 253) = ( 0.5000000 0.2886751 0.0787641), wk = 0.0035211 k( 254) = ( 0.5000000 0.2886751 0.0630113), wk = 0.0035211 k( 255) = ( 0.5000000 0.2886751 0.0472585), wk = 0.0035211 k( 256) = ( 0.5000000 0.2886751 0.0315056), wk = 0.0035211 k( 257) = ( 0.5000000 0.2886751 0.0157528), wk = 0.0035211 k( 258) = ( 0.5000000 0.2886751 -0.0000000), wk = 0.0035211 k( 259) = ( 0.3333333 0.5773503 -0.0000000), wk = 0.0035211 k( 260) = ( 0.3333333 0.5773503 0.0157528), wk = 0.0035211 k( 261) = ( 0.3333333 0.5773503 0.0315056), wk = 0.0035211 k( 262) = ( 0.3333333 0.5773503 0.0472585), wk = 0.0035211 k( 263) = ( 0.3333333 0.5773503 0.0630113), wk = 0.0035211 k( 264) = ( 0.3333333 0.5773503 0.0787641), wk = 0.0035211 k( 265) = ( 0.3333333 0.5773503 0.0945169), wk = 0.0035211 k( 266) = ( 0.3333333 0.5773503 0.1102698), wk = 0.0035211 k( 267) = ( 0.3333333 0.5773503 0.1260226), wk = 0.0035211 k( 268) = ( 0.3333333 0.5773503 0.1417754), wk = 0.0035211 k( 269) = ( 0.3333333 0.5773503 0.1575282), wk = 0.0035211 k( 270) = ( 0.3333333 0.5773503 0.1732811), wk = 0.0035211 k( 271) = ( 0.3333333 0.5773503 0.1890339), wk = 0.0035211 k( 272) = ( 0.3333333 0.5773503 0.2047867), wk = 0.0035211 k( 273) = ( 0.3333333 0.5773503 0.2205395), wk = 0.0035211 k( 274) = ( 0.3333333 0.5773503 0.2362923), wk = 0.0035211 k( 275) = ( 0.3333333 0.5773503 0.2520452), wk = 0.0035211 k( 276) = ( 0.3333333 0.5773503 0.2677980), wk = 0.0035211 k( 277) = ( 0.3333333 0.5773503 0.2835508), wk = 0.0035211 k( 278) = ( 0.3333333 0.5773503 0.2993036), wk = 0.0035211 k( 279) = ( 0.3333333 0.5773503 0.3150565), wk = 0.0035211 k( 280) = ( 0.3333333 0.5773503 0.3308093), wk = 0.0035211 k( 281) = ( 0.3333333 0.5773503 0.3465621), wk = 0.0035211 k( 282) = ( 0.3333333 0.5773503 0.3623149), wk = 0.0035211 k( 283) = ( 0.3333333 0.5773503 0.3780678), wk = 0.0035211 k( 284) = ( 0.3333333 0.5773503 0.3938206), wk = 0.0035211 cryst. coord. k( 1) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0035211 k( 2) = ( 0.0135135 -0.0000000 -0.0000000), wk = 0.0035211 k( 3) = ( 0.0270270 0.0000000 0.0000000), wk = 0.0035211 k( 4) = ( 0.0405405 -0.0000000 -0.0000000), wk = 0.0035211 k( 5) = ( 0.0540540 0.0000000 -0.0000000), wk = 0.0035211 k( 6) = ( 0.0675676 0.0000000 0.0000000), wk = 0.0035211 k( 7) = ( 0.0810811 -0.0000000 -0.0000000), wk = 0.0035211 k( 8) = ( 0.0945946 0.0000000 -0.0000000), wk = 0.0035211 k( 9) = ( 0.1081081 0.0000000 -0.0000000), wk = 0.0035211 k( 10) = ( 0.1216216 -0.0000000 -0.0000000), wk = 0.0035211 k( 11) = ( 0.1351351 0.0000000 0.0000000), wk = 0.0035211 k( 12) = ( 0.1486486 -0.0000000 -0.0000000), wk = 0.0035211 k( 13) = ( 0.1621622 -0.0000000 -0.0000000), wk = 0.0035211 k( 14) = ( 0.1756757 0.0000000 -0.0000000), wk = 0.0035211 k( 15) = ( 0.1891892 0.0000000 0.0000000), wk = 0.0035211 k( 16) = ( 0.2027027 0.0000000 -0.0000000), wk = 0.0035211 k( 17) = ( 0.2162162 0.0000000 -0.0000000), wk = 0.0035211 k( 18) = ( 0.2297297 -0.0000000 -0.0000000), wk = 0.0035211 k( 19) = ( 0.2432432 -0.0000000 -0.0000000), wk = 0.0035211 k( 20) = ( 0.2567568 -0.0000000 -0.0000000), wk = 0.0035211 k( 21) = ( 0.2702703 -0.0000000 -0.0000000), wk = 0.0035211 k( 22) = ( 0.2837838 -0.0000000 -0.0000000), wk = 0.0035211 k( 23) = ( 0.2972973 -0.0000000 -0.0000000), wk = 0.0035211 k( 24) = ( 0.3108108 -0.0000000 -0.0000000), wk = 0.0035211 k( 25) = ( 0.3243243 -0.0000000 -0.0000000), wk = 0.0035211 k( 26) = ( 0.3378378 0.0000000 -0.0000000), wk = 0.0035211 k( 27) = ( 0.3513514 0.0000000 -0.0000000), wk = 0.0035211 k( 28) = ( 0.3648649 0.0000000 -0.0000000), wk = 0.0035211 k( 29) = ( 0.3783784 0.0000000 0.0000000), wk = 0.0035211 k( 30) = ( 0.3918919 0.0000000 -0.0000000), wk = 0.0035211 k( 31) = ( 0.4054054 -0.0000000 -0.0000000), wk = 0.0035211 k( 32) = ( 0.4189189 -0.0000000 -0.0000000), wk = 0.0035211 k( 33) = ( 0.4324324 -0.0000000 -0.0000000), wk = 0.0035211 k( 34) = ( 0.4459459 0.0000000 -0.0000000), wk = 0.0035211 k( 35) = ( 0.4594595 -0.0000000 -0.0000000), wk = 0.0035211 k( 36) = ( 0.4729730 0.0000000 -0.0000000), wk = 0.0035211 k( 37) = ( 0.4864865 -0.0000000 -0.0000000), wk = 0.0035211 k( 38) = ( 0.5000000 0.0000000 -0.0000000), wk = 0.0035211 k( 39) = ( 0.5000000 0.0000000 -0.0000000), wk = 0.0035211 k( 40) = ( 0.4920635 0.0158730 -0.0000000), wk = 0.0035211 k( 41) = ( 0.4841270 0.0317460 0.0000000), wk = 0.0035211 k( 42) = ( 0.4761905 0.0476191 0.0000000), wk = 0.0035211 k( 43) = ( 0.4682540 0.0634921 -0.0000000), wk = 0.0035211 k( 44) = ( 0.4603175 0.0793651 -0.0000000), wk = 0.0035211 k( 45) = ( 0.4523810 0.0952381 -0.0000000), wk = 0.0035211 k( 46) = ( 0.4444444 0.1111111 -0.0000000), wk = 0.0035211 k( 47) = ( 0.4365079 0.1269841 -0.0000000), wk = 0.0035211 k( 48) = ( 0.4285714 0.1428571 -0.0000000), wk = 0.0035211 k( 49) = ( 0.4206349 0.1587302 0.0000000), wk = 0.0035211 k( 50) = ( 0.4126984 0.1746032 -0.0000000), wk = 0.0035211 k( 51) = ( 0.4047619 0.1904762 -0.0000000), wk = 0.0035211 k( 52) = ( 0.3968254 0.2063492 -0.0000000), wk = 0.0035211 k( 53) = ( 0.3888889 0.2222222 0.0000000), wk = 0.0035211 k( 54) = ( 0.3809524 0.2380952 -0.0000000), wk = 0.0035211 k( 55) = ( 0.3730159 0.2539682 -0.0000000), wk = 0.0035211 k( 56) = ( 0.3650794 0.2698413 -0.0000000), wk = 0.0035211 k( 57) = ( 0.3571429 0.2857143 -0.0000000), wk = 0.0035211 k( 58) = ( 0.3492063 0.3015873 0.0000000), wk = 0.0035211 k( 59) = ( 0.3412698 0.3174603 -0.0000000), wk = 0.0035211 k( 60) = ( 0.3333333 0.3333333 0.0000000), wk = 0.0035211 k( 61) = ( 0.3333333 0.3333333 0.0000000), wk = 0.0035211 k( 62) = ( 0.3253968 0.3253968 -0.0000000), wk = 0.0035211 k( 63) = ( 0.3174603 0.3174603 0.0000000), wk = 0.0035211 k( 64) = ( 0.3095238 0.3095238 0.0000000), wk = 0.0035211 k( 65) = ( 0.3015873 0.3015873 0.0000000), wk = 0.0035211 k( 66) = ( 0.2936508 0.2936508 -0.0000000), wk = 0.0035211 k( 67) = ( 0.2857143 0.2857143 -0.0000000), wk = 0.0035211 k( 68) = ( 0.2777778 0.2777778 -0.0000000), wk = 0.0035211 k( 69) = ( 0.2698413 0.2698413 -0.0000000), wk = 0.0035211 k( 70) = ( 0.2619048 0.2619048 -0.0000000), wk = 0.0035211 k( 71) = ( 0.2539683 0.2539683 -0.0000000), wk = 0.0035211 k( 72) = ( 0.2460317 0.2460317 -0.0000000), wk = 0.0035211 k( 73) = ( 0.2380952 0.2380952 -0.0000000), wk = 0.0035211 k( 74) = ( 0.2301587 0.2301587 -0.0000000), wk = 0.0035211 k( 75) = ( 0.2222222 0.2222222 0.0000000), wk = 0.0035211 k( 76) = ( 0.2142857 0.2142857 -0.0000000), wk = 0.0035211 k( 77) = ( 0.2063492 0.2063492 -0.0000000), wk = 0.0035211 k( 78) = ( 0.1984127 0.1984127 -0.0000000), wk = 0.0035211 k( 79) = ( 0.1904762 0.1904762 -0.0000000), wk = 0.0035211 k( 80) = ( 0.1825397 0.1825397 -0.0000000), wk = 0.0035211 k( 81) = ( 0.1746032 0.1746032 0.0000000), wk = 0.0035211 k( 82) = ( 0.1666667 0.1666667 -0.0000000), wk = 0.0035211 k( 83) = ( 0.1587302 0.1587302 0.0000000), wk = 0.0035211 k( 84) = ( 0.1507937 0.1507937 0.0000000), wk = 0.0035211 k( 85) = ( 0.1428571 0.1428571 0.0000000), wk = 0.0035211 k( 86) = ( 0.1349206 0.1349206 -0.0000000), wk = 0.0035211 k( 87) = ( 0.1269841 0.1269841 0.0000000), wk = 0.0035211 k( 88) = ( 0.1190476 0.1190476 -0.0000000), wk = 0.0035211 k( 89) = ( 0.1111111 0.1111111 0.0000000), wk = 0.0035211 k( 90) = ( 0.1031746 0.1031746 -0.0000000), wk = 0.0035211 k( 91) = ( 0.0952381 0.0952381 -0.0000000), wk = 0.0035211 k( 92) = ( 0.0873016 0.0873016 -0.0000000), wk = 0.0035211 k( 93) = ( 0.0793651 0.0793651 0.0000000), wk = 0.0035211 k( 94) = ( 0.0714286 0.0714286 0.0000000), wk = 0.0035211 k( 95) = ( 0.0634921 0.0634921 -0.0000000), wk = 0.0035211 k( 96) = ( 0.0555556 0.0555556 -0.0000000), wk = 0.0035211 k( 97) = ( 0.0476191 0.0476191 -0.0000000), wk = 0.0035211 k( 98) = ( 0.0396825 0.0396825 0.0000000), wk = 0.0035211 k( 99) = ( 0.0317460 0.0317460 -0.0000000), wk = 0.0035211 k( 100) = ( 0.0238095 0.0238095 0.0000000), wk = 0.0035211 k( 101) = ( 0.0158730 0.0158730 -0.0000000), wk = 0.0035211 k( 102) = ( 0.0079365 0.0079365 -0.0000000), wk = 0.0035211 k( 103) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0035211 k( 104) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0035211 k( 105) = ( 0.0000000 0.0000000 0.0200000), wk = 0.0035211 k( 106) = ( 0.0000000 0.0000000 0.0400000), wk = 0.0035211 k( 107) = ( 0.0000000 0.0000000 0.0600000), wk = 0.0035211 k( 108) = ( 0.0000000 0.0000000 0.0800000), wk = 0.0035211 k( 109) = ( 0.0000000 0.0000000 0.1000000), wk = 0.0035211 k( 110) = ( 0.0000000 0.0000000 0.1200000), wk = 0.0035211 k( 111) = ( 0.0000000 0.0000000 0.1400000), wk = 0.0035211 k( 112) = ( 0.0000000 0.0000000 0.1600000), wk = 0.0035211 k( 113) = ( 0.0000000 0.0000000 0.1800000), wk = 0.0035211 k( 114) = ( 0.0000000 0.0000000 0.2000000), wk = 0.0035211 k( 115) = ( 0.0000000 0.0000000 0.2200000), wk = 0.0035211 k( 116) = ( 0.0000000 0.0000000 0.2400000), wk = 0.0035211 k( 117) = ( 0.0000000 0.0000000 0.2600000), wk = 0.0035211 k( 118) = ( 0.0000000 0.0000000 0.2800000), wk = 0.0035211 k( 119) = ( 0.0000000 0.0000000 0.3000000), wk = 0.0035211 k( 120) = ( 0.0000000 0.0000000 0.3200000), wk = 0.0035211 k( 121) = ( 0.0000000 0.0000000 0.3400000), wk = 0.0035211 k( 122) = ( 0.0000000 0.0000000 0.3600000), wk = 0.0035211 k( 123) = ( 0.0000000 0.0000000 0.3800000), wk = 0.0035211 k( 124) = ( 0.0000000 0.0000000 0.4000000), wk = 0.0035211 k( 125) = ( 0.0000000 0.0000000 0.4200000), wk = 0.0035211 k( 126) = ( 0.0000000 0.0000000 0.4400000), wk = 0.0035211 k( 127) = ( 0.0000000 0.0000000 0.4600000), wk = 0.0035211 k( 128) = ( 0.0000000 0.0000000 0.4800000), wk = 0.0035211 k( 129) = ( 0.0000000 0.0000000 0.5000000), wk = 0.0035211 k( 130) = ( 0.0000000 0.0000000 0.5000000), wk = 0.0035211 k( 131) = ( 0.0135135 -0.0000000 0.5000000), wk = 0.0035211 k( 132) = ( 0.0270270 0.0000000 0.5000000), wk = 0.0035211 k( 133) = ( 0.0405405 -0.0000000 0.5000000), wk = 0.0035211 k( 134) = ( 0.0540540 0.0000000 0.5000000), wk = 0.0035211 k( 135) = ( 0.0675676 0.0000000 0.5000000), wk = 0.0035211 k( 136) = ( 0.0810811 -0.0000000 0.5000000), wk = 0.0035211 k( 137) = ( 0.0945946 0.0000000 0.5000000), wk = 0.0035211 k( 138) = ( 0.1081081 0.0000000 0.5000000), wk = 0.0035211 k( 139) = ( 0.1216216 -0.0000000 0.5000000), wk = 0.0035211 k( 140) = ( 0.1351351 0.0000000 0.5000000), wk = 0.0035211 k( 141) = ( 0.1486486 -0.0000000 0.5000000), wk = 0.0035211 k( 142) = ( 0.1621622 -0.0000000 0.5000000), wk = 0.0035211 k( 143) = ( 0.1756757 0.0000000 0.5000000), wk = 0.0035211 k( 144) = ( 0.1891892 0.0000000 0.5000000), wk = 0.0035211 k( 145) = ( 0.2027027 0.0000000 0.5000000), wk = 0.0035211 k( 146) = ( 0.2162162 0.0000000 0.5000000), wk = 0.0035211 k( 147) = ( 0.2297297 -0.0000000 0.5000000), wk = 0.0035211 k( 148) = ( 0.2432432 -0.0000000 0.5000000), wk = 0.0035211 k( 149) = ( 0.2567568 -0.0000000 0.5000000), wk = 0.0035211 k( 150) = ( 0.2702703 -0.0000000 0.5000000), wk = 0.0035211 k( 151) = ( 0.2837838 -0.0000000 0.5000000), wk = 0.0035211 k( 152) = ( 0.2972973 -0.0000000 0.5000000), wk = 0.0035211 k( 153) = ( 0.3108108 -0.0000000 0.5000000), wk = 0.0035211 k( 154) = ( 0.3243243 -0.0000000 0.5000000), wk = 0.0035211 k( 155) = ( 0.3378378 0.0000000 0.5000000), wk = 0.0035211 k( 156) = ( 0.3513514 0.0000000 0.5000000), wk = 0.0035211 k( 157) = ( 0.3648649 0.0000000 0.5000000), wk = 0.0035211 k( 158) = ( 0.3783784 0.0000000 0.5000000), wk = 0.0035211 k( 159) = ( 0.3918919 0.0000000 0.5000000), wk = 0.0035211 k( 160) = ( 0.4054054 -0.0000000 0.5000000), wk = 0.0035211 k( 161) = ( 0.4189189 -0.0000000 0.5000000), wk = 0.0035211 k( 162) = ( 0.4324324 -0.0000000 0.5000000), wk = 0.0035211 k( 163) = ( 0.4459459 0.0000000 0.5000000), wk = 0.0035211 k( 164) = ( 0.4594595 -0.0000000 0.5000000), wk = 0.0035211 k( 165) = ( 0.4729730 0.0000000 0.5000000), wk = 0.0035211 k( 166) = ( 0.4864865 -0.0000000 0.5000000), wk = 0.0035211 k( 167) = ( 0.5000000 0.0000000 0.5000000), wk = 0.0035211 k( 168) = ( 0.5000000 0.0000000 0.5000000), wk = 0.0035211 k( 169) = ( 0.4920635 0.0158730 0.5000000), wk = 0.0035211 k( 170) = ( 0.4841270 0.0317460 0.5000000), wk = 0.0035211 k( 171) = ( 0.4761905 0.0476191 0.5000000), wk = 0.0035211 k( 172) = ( 0.4682540 0.0634921 0.5000000), wk = 0.0035211 k( 173) = ( 0.4603175 0.0793651 0.5000000), wk = 0.0035211 k( 174) = ( 0.4523810 0.0952381 0.5000000), wk = 0.0035211 k( 175) = ( 0.4444444 0.1111111 0.5000000), wk = 0.0035211 k( 176) = ( 0.4365079 0.1269841 0.5000000), wk = 0.0035211 k( 177) = ( 0.4285714 0.1428571 0.5000000), wk = 0.0035211 k( 178) = ( 0.4206349 0.1587302 0.5000000), wk = 0.0035211 k( 179) = ( 0.4126984 0.1746032 0.5000000), wk = 0.0035211 k( 180) = ( 0.4047619 0.1904762 0.5000000), wk = 0.0035211 k( 181) = ( 0.3968254 0.2063492 0.5000000), wk = 0.0035211 k( 182) = ( 0.3888889 0.2222222 0.5000000), wk = 0.0035211 k( 183) = ( 0.3809524 0.2380952 0.5000000), wk = 0.0035211 k( 184) = ( 0.3730159 0.2539682 0.5000000), wk = 0.0035211 k( 185) = ( 0.3650794 0.2698413 0.5000000), wk = 0.0035211 k( 186) = ( 0.3571429 0.2857143 0.5000000), wk = 0.0035211 k( 187) = ( 0.3492063 0.3015873 0.5000000), wk = 0.0035211 k( 188) = ( 0.3412698 0.3174603 0.5000000), wk = 0.0035211 k( 189) = ( 0.3333333 0.3333333 0.5000000), wk = 0.0035211 k( 190) = ( 0.3333333 0.3333333 0.5000000), wk = 0.0035211 k( 191) = ( 0.3253968 0.3253968 0.5000000), wk = 0.0035211 k( 192) = ( 0.3174603 0.3174603 0.5000000), wk = 0.0035211 k( 193) = ( 0.3095238 0.3095238 0.5000000), wk = 0.0035211 k( 194) = ( 0.3015873 0.3015873 0.5000000), wk = 0.0035211 k( 195) = ( 0.2936508 0.2936508 0.5000000), wk = 0.0035211 k( 196) = ( 0.2857143 0.2857143 0.5000000), wk = 0.0035211 k( 197) = ( 0.2777778 0.2777778 0.5000000), wk = 0.0035211 k( 198) = ( 0.2698413 0.2698413 0.5000000), wk = 0.0035211 k( 199) = ( 0.2619048 0.2619048 0.5000000), wk = 0.0035211 k( 200) = ( 0.2539683 0.2539683 0.5000000), wk = 0.0035211 k( 201) = ( 0.2460317 0.2460317 0.5000000), wk = 0.0035211 k( 202) = ( 0.2380952 0.2380952 0.5000000), wk = 0.0035211 k( 203) = ( 0.2301587 0.2301587 0.5000000), wk = 0.0035211 k( 204) = ( 0.2222222 0.2222222 0.5000000), wk = 0.0035211 k( 205) = ( 0.2142857 0.2142857 0.5000000), wk = 0.0035211 k( 206) = ( 0.2063492 0.2063492 0.5000000), wk = 0.0035211 k( 207) = ( 0.1984127 0.1984127 0.5000000), wk = 0.0035211 k( 208) = ( 0.1904762 0.1904762 0.5000000), wk = 0.0035211 k( 209) = ( 0.1825397 0.1825397 0.5000000), wk = 0.0035211 k( 210) = ( 0.1746032 0.1746032 0.5000000), wk = 0.0035211 k( 211) = ( 0.1666667 0.1666667 0.5000000), wk = 0.0035211 k( 212) = ( 0.1587302 0.1587302 0.5000000), wk = 0.0035211 k( 213) = ( 0.1507937 0.1507937 0.5000000), wk = 0.0035211 k( 214) = ( 0.1428571 0.1428571 0.5000000), wk = 0.0035211 k( 215) = ( 0.1349206 0.1349206 0.5000000), wk = 0.0035211 k( 216) = ( 0.1269841 0.1269841 0.5000000), wk = 0.0035211 k( 217) = ( 0.1190476 0.1190476 0.5000000), wk = 0.0035211 k( 218) = ( 0.1111111 0.1111111 0.5000000), wk = 0.0035211 k( 219) = ( 0.1031746 0.1031746 0.5000000), wk = 0.0035211 k( 220) = ( 0.0952381 0.0952381 0.5000000), wk = 0.0035211 k( 221) = ( 0.0873016 0.0873016 0.5000000), wk = 0.0035211 k( 222) = ( 0.0793651 0.0793651 0.5000000), wk = 0.0035211 k( 223) = ( 0.0714286 0.0714286 0.5000000), wk = 0.0035211 k( 224) = ( 0.0634921 0.0634921 0.5000000), wk = 0.0035211 k( 225) = ( 0.0555556 0.0555556 0.5000000), wk = 0.0035211 k( 226) = ( 0.0476191 0.0476191 0.5000000), wk = 0.0035211 k( 227) = ( 0.0396825 0.0396825 0.5000000), wk = 0.0035211 k( 228) = ( 0.0317460 0.0317460 0.5000000), wk = 0.0035211 k( 229) = ( 0.0238095 0.0238095 0.5000000), wk = 0.0035211 k( 230) = ( 0.0158730 0.0158730 0.5000000), wk = 0.0035211 k( 231) = ( 0.0079365 0.0079365 0.5000000), wk = 0.0035211 k( 232) = ( 0.0000000 0.0000000 0.5000000), wk = 0.0035211 k( 233) = ( 0.5000000 0.0000000 0.5000000), wk = 0.0035211 k( 234) = ( 0.5000000 0.0000000 0.4800000), wk = 0.0035211 k( 235) = ( 0.5000000 0.0000000 0.4600000), wk = 0.0035211 k( 236) = ( 0.5000000 0.0000000 0.4400000), wk = 0.0035211 k( 237) = ( 0.5000000 0.0000000 0.4200000), wk = 0.0035211 k( 238) = ( 0.5000000 0.0000000 0.4000000), wk = 0.0035211 k( 239) = ( 0.5000000 0.0000000 0.3800000), wk = 0.0035211 k( 240) = ( 0.5000000 0.0000000 0.3600000), wk = 0.0035211 k( 241) = ( 0.5000000 0.0000000 0.3400000), wk = 0.0035211 k( 242) = ( 0.5000000 0.0000000 0.3200000), wk = 0.0035211 k( 243) = ( 0.5000000 0.0000000 0.3000000), wk = 0.0035211 k( 244) = ( 0.5000000 0.0000000 0.2800000), wk = 0.0035211 k( 245) = ( 0.5000000 0.0000000 0.2600000), wk = 0.0035211 k( 246) = ( 0.5000000 0.0000000 0.2400000), wk = 0.0035211 k( 247) = ( 0.5000000 0.0000000 0.2200000), wk = 0.0035211 k( 248) = ( 0.5000000 0.0000000 0.2000000), wk = 0.0035211 k( 249) = ( 0.5000000 0.0000000 0.1800000), wk = 0.0035211 k( 250) = ( 0.5000000 0.0000000 0.1600000), wk = 0.0035211 k( 251) = ( 0.5000000 0.0000000 0.1400000), wk = 0.0035211 k( 252) = ( 0.5000000 0.0000000 0.1200000), wk = 0.0035211 k( 253) = ( 0.5000000 0.0000000 0.1000000), wk = 0.0035211 k( 254) = ( 0.5000000 0.0000000 0.0800000), wk = 0.0035211 k( 255) = ( 0.5000000 0.0000000 0.0600000), wk = 0.0035211 k( 256) = ( 0.5000000 0.0000000 0.0400000), wk = 0.0035211 k( 257) = ( 0.5000000 0.0000000 0.0200000), wk = 0.0035211 k( 258) = ( 0.5000000 0.0000000 -0.0000000), wk = 0.0035211 k( 259) = ( 0.3333333 0.3333333 0.0000000), wk = 0.0035211 k( 260) = ( 0.3333333 0.3333333 0.0200000), wk = 0.0035211 k( 261) = ( 0.3333333 0.3333333 0.0400000), wk = 0.0035211 k( 262) = ( 0.3333333 0.3333333 0.0600000), wk = 0.0035211 k( 263) = ( 0.3333333 0.3333333 0.0800000), wk = 0.0035211 k( 264) = ( 0.3333333 0.3333333 0.1000000), wk = 0.0035211 k( 265) = ( 0.3333333 0.3333333 0.1200000), wk = 0.0035211 k( 266) = ( 0.3333333 0.3333333 0.1400000), wk = 0.0035211 k( 267) = ( 0.3333333 0.3333333 0.1600000), wk = 0.0035211 k( 268) = ( 0.3333333 0.3333333 0.1800000), wk = 0.0035211 k( 269) = ( 0.3333333 0.3333333 0.2000000), wk = 0.0035211 k( 270) = ( 0.3333333 0.3333333 0.2200000), wk = 0.0035211 k( 271) = ( 0.3333333 0.3333333 0.2400000), wk = 0.0035211 k( 272) = ( 0.3333333 0.3333333 0.2600000), wk = 0.0035211 k( 273) = ( 0.3333333 0.3333333 0.2800000), wk = 0.0035211 k( 274) = ( 0.3333333 0.3333333 0.3000000), wk = 0.0035211 k( 275) = ( 0.3333333 0.3333333 0.3200000), wk = 0.0035211 k( 276) = ( 0.3333333 0.3333333 0.3400000), wk = 0.0035211 k( 277) = ( 0.3333333 0.3333333 0.3600000), wk = 0.0035211 k( 278) = ( 0.3333333 0.3333333 0.3800000), wk = 0.0035211 k( 279) = ( 0.3333333 0.3333333 0.4000000), wk = 0.0035211 k( 280) = ( 0.3333333 0.3333333 0.4200000), wk = 0.0035211 k( 281) = ( 0.3333333 0.3333333 0.4400000), wk = 0.0035211 k( 282) = ( 0.3333333 0.3333333 0.4600000), wk = 0.0035211 k( 283) = ( 0.3333333 0.3333333 0.4800000), wk = 0.0035211 k( 284) = ( 0.3333333 0.3333333 0.5000000), wk = 0.0035211 Dense grid: 92481 G-vectors FFT dimensions: ( 60, 60, 72) Smooth grid: 40919 G-vectors FFT dimensions: ( 45, 45, 54) Largest allocated arrays est. size (Mb) dimensions Kohn-Sham Wavefunctions 0.30 Mb ( 288, 68) NL pseudopotentials 0.36 Mb ( 144, 166) Each V/rho on FFT grid 0.11 Mb ( 7200) Each G-vector array 0.02 Mb ( 2572) G-vector shells 0.01 Mb ( 1211) Largest temporary arrays est. size (Mb) dimensions Auxiliary wavefunctions 1.20 Mb ( 288, 272) Each subspace H/S matrix 0.07 Mb ( 68, 68) Each matrix 0.34 Mb ( 166, 2, 68) Check: negative/imaginary core charge= -0.000002 0.000000 The potential is recalculated from file : ./RbGeIO6.save/charge-density.dat Starting wfc are 80 randomized atomic wfcs Band Structure Calculation Davidson diagonalization with overlap Computing kpt #: 1 total cpu time spent up to now is 4.0 secs Computing kpt #: 2 total cpu time spent up to now is 5.1 secs Computing kpt #: 3 total cpu time spent up to now is 6.2 secs Computing kpt #: 4 total cpu time spent up to now is 7.3 secs Computing kpt #: 5 total cpu time spent up to now is 8.4 secs Computing kpt #: 6 total cpu time spent up to now is 9.5 secs Computing kpt #: 7 total cpu time spent up to now is 10.6 secs Computing kpt #: 8 total cpu time spent up to now is 11.7 secs Computing kpt #: 9 total cpu time spent up to now is 12.8 secs Computing kpt #: 10 total cpu time spent up to now is 13.9 secs Computing kpt #: 11 total cpu time spent up to now is 15.1 secs Computing kpt #: 12 total cpu time spent up to now is 16.3 secs Computing kpt #: 13 total cpu time spent up to now is 17.5 secs Computing kpt #: 14 total cpu time spent up to now is 18.8 secs Computing kpt #: 15 total cpu time spent up to now is 20.1 secs Computing kpt #: 16 total cpu time spent up to now is 21.5 secs Computing kpt #: 17 total cpu time spent up to now is 22.8 secs Computing kpt #: 18 total cpu time spent up to now is 24.2 secs Computing kpt #: 19 total cpu time spent up to now is 25.5 secs Computing kpt #: 20 total cpu time spent up to now is 26.7 secs Computing kpt #: 21 total cpu time spent up to now is 28.1 secs Computing kpt #: 22 total cpu time spent up to now is 29.3 secs Computing kpt #: 23 total cpu time spent up to now is 30.4 secs Computing kpt #: 24 total cpu time spent up to now is 31.6 secs Computing kpt #: 25 total cpu time spent up to now is 32.7 secs Computing kpt #: 26 total cpu time spent up to now is 33.8 secs Computing kpt #: 27 total cpu time spent up to now is 34.8 secs Computing kpt #: 28 total cpu time spent up to now is 35.8 secs Computing kpt #: 29 total cpu time spent up to now is 36.9 secs Computing kpt #: 30 total cpu time spent up to now is 38.0 secs Computing kpt #: 31 total cpu time spent up to now is 38.9 secs Computing kpt #: 32 total cpu time spent up to now is 39.9 secs Computing kpt #: 33 total cpu time spent up to now is 40.9 secs Computing kpt #: 34 total cpu time spent up to now is 41.8 secs Computing kpt #: 35 total cpu time spent up to now is 42.8 secs Computing kpt #: 36 total cpu time spent up to now is 43.7 secs Computing kpt #: 37 total cpu time spent up to now is 44.7 secs Computing kpt #: 38 total cpu time spent up to now is 45.5 secs Computing kpt #: 39 total cpu time spent up to now is 46.4 secs Computing kpt #: 40 total cpu time spent up to now is 47.4 secs Computing kpt #: 41 total cpu time spent up to now is 48.3 secs Computing kpt #: 42 total cpu time spent up to now is 49.1 secs Computing kpt #: 43 total cpu time spent up to now is 50.0 secs Computing kpt #: 44 total cpu time spent up to now is 50.9 secs Computing kpt #: 45 total cpu time spent up to now is 51.7 secs Computing kpt #: 46 total cpu time spent up to now is 52.5 secs Computing kpt #: 47 total cpu time spent up to now is 53.3 secs Computing kpt #: 48 total cpu time spent up to now is 54.2 secs Computing kpt #: 49 total cpu time spent up to now is 55.2 secs Computing kpt #: 50 total cpu time spent up to now is 56.2 secs Computing kpt #: 51 total cpu time spent up to now is 57.1 secs Computing kpt #: 52 total cpu time spent up to now is 58.0 secs Computing kpt #: 53 total cpu time spent up to now is 59.0 secs Computing kpt #: 54 total cpu time spent up to now is 60.0 secs Computing kpt #: 55 total cpu time spent up to now is 60.9 secs Computing kpt #: 56 total cpu time spent up to now is 61.9 secs Computing kpt #: 57 total cpu time spent up to now is 62.9 secs Computing kpt #: 58 total cpu time spent up to now is 63.8 secs Computing kpt #: 59 total cpu time spent up to now is 64.9 secs Computing kpt #: 60 total cpu time spent up to now is 66.3 secs Computing kpt #: 61 total cpu time spent up to now is 67.6 secs Computing kpt #: 62 total cpu time spent up to now is 69.0 secs Computing kpt #: 63 total cpu time spent up to now is 70.1 secs Computing kpt #: 64 total cpu time spent up to now is 71.1 secs Computing kpt #: 65 total cpu time spent up to now is 72.1 secs Computing kpt #: 66 total cpu time spent up to now is 73.1 secs Computing kpt #: 67 total cpu time spent up to now is 74.1 secs Computing kpt #: 68 total cpu time spent up to now is 75.0 secs Computing kpt #: 69 total cpu time spent up to now is 76.0 secs Computing kpt #: 70 total cpu time spent up to now is 77.0 secs Computing kpt #: 71 total cpu time spent up to now is 78.1 secs Computing kpt #: 72 total cpu time spent up to now is 79.0 secs Computing kpt #: 73 total cpu time spent up to now is 80.1 secs Computing kpt #: 74 total cpu time spent up to now is 81.2 secs Computing kpt #: 75 total cpu time spent up to now is 82.3 secs Computing kpt #: 76 total cpu time spent up to now is 83.4 secs Computing kpt #: 77 total cpu time spent up to now is 84.5 secs Computing kpt #: 78 total cpu time spent up to now is 85.9 secs Computing kpt #: 79 total cpu time spent up to now is 87.3 secs Computing kpt #: 80 total cpu time spent up to now is 88.7 secs Computing kpt #: 81 total cpu time spent up to now is 90.7 secs Computing kpt #: 82 total cpu time spent up to now is 92.9 secs Computing kpt #: 83 total cpu time spent up to now is 94.4 secs Computing kpt #: 84 total cpu time spent up to now is 96.3 secs Computing kpt #: 85 total cpu time spent up to now is 98.3 secs Computing kpt #: 86 total cpu time spent up to now is 100.1 secs Computing kpt #: 87 total cpu time spent up to now is 101.6 secs Computing kpt #: 88 total cpu time spent up to now is 102.7 secs Computing kpt #: 89 total cpu time spent up to now is 104.0 secs Computing kpt #: 90 total cpu time spent up to now is 105.3 secs Computing kpt #: 91 total cpu time spent up to now is 106.5 secs Computing kpt #: 92 total cpu time spent up to now is 107.6 secs Computing kpt #: 93 total cpu time spent up to now is 108.7 secs Computing kpt #: 94 total cpu time spent up to now is 109.8 secs Computing kpt #: 95 total cpu time spent up to now is 110.9 secs Computing kpt #: 96 total cpu time spent up to now is 112.0 secs Computing kpt #: 97 total cpu time spent up to now is 113.2 secs Computing kpt #: 98 total cpu time spent up to now is 114.3 secs Computing kpt #: 99 total cpu time spent up to now is 115.4 secs Computing kpt #: 100 total cpu time spent up to now is 116.5 secs Computing kpt #: 101 total cpu time spent up to now is 117.6 secs Computing kpt #: 102 total cpu time spent up to now is 118.7 secs Computing kpt #: 103 total cpu time spent up to now is 119.8 secs Computing kpt #: 104 total cpu time spent up to now is 120.9 secs Computing kpt #: 105 total cpu time spent up to now is 121.8 secs Computing kpt #: 106 total cpu time spent up to now is 122.9 secs Computing kpt #: 107 total cpu time spent up to now is 124.0 secs Computing kpt #: 108 total cpu time spent up to now is 125.3 secs Computing kpt #: 109 total cpu time spent up to now is 126.4 secs Computing kpt #: 110 total cpu time spent up to now is 127.5 secs Computing kpt #: 111 total cpu time spent up to now is 128.5 secs Computing kpt #: 112 total cpu time spent up to now is 129.4 secs Computing kpt #: 113 total cpu time spent up to now is 130.5 secs Computing kpt #: 114 total cpu time spent up to now is 131.6 secs Computing kpt #: 115 total cpu time spent up to now is 132.7 secs Computing kpt #: 116 total cpu time spent up to now is 133.8 secs Computing kpt #: 117 total cpu time spent up to now is 134.9 secs Computing kpt #: 118 total cpu time spent up to now is 136.0 secs Computing kpt #: 119 total cpu time spent up to now is 137.1 secs Computing kpt #: 120 total cpu time spent up to now is 138.2 secs Computing kpt #: 121 total cpu time spent up to now is 139.3 secs Computing kpt #: 122 total cpu time spent up to now is 140.4 secs Computing kpt #: 123 total cpu time spent up to now is 141.5 secs Computing kpt #: 124 total cpu time spent up to now is 142.6 secs Computing kpt #: 125 total cpu time spent up to now is 143.7 secs Computing kpt #: 126 total cpu time spent up to now is 144.7 secs Computing kpt #: 127 total cpu time spent up to now is 145.8 secs Computing kpt #: 128 total cpu time spent up to now is 146.9 secs Computing kpt #: 129 total cpu time spent up to now is 147.9 secs Computing kpt #: 130 total cpu time spent up to now is 149.0 secs Computing kpt #: 131 total cpu time spent up to now is 150.1 secs Computing kpt #: 132 total cpu time spent up to now is 151.2 secs Computing kpt #: 133 total cpu time spent up to now is 152.3 secs Computing kpt #: 134 total cpu time spent up to now is 153.3 secs Computing kpt #: 135 total cpu time spent up to now is 154.4 secs Computing kpt #: 136 total cpu time spent up to now is 155.5 secs Computing kpt #: 137 total cpu time spent up to now is 156.5 secs Computing kpt #: 138 total cpu time spent up to now is 157.6 secs Computing kpt #: 139 total cpu time spent up to now is 158.6 secs Computing kpt #: 140 total cpu time spent up to now is 159.6 secs Computing kpt #: 141 total cpu time spent up to now is 160.7 secs Computing kpt #: 142 total cpu time spent up to now is 161.7 secs Computing kpt #: 143 total cpu time spent up to now is 162.8 secs Computing kpt #: 144 total cpu time spent up to now is 163.9 secs Computing kpt #: 145 total cpu time spent up to now is 165.0 secs Computing kpt #: 146 total cpu time spent up to now is 166.1 secs Computing kpt #: 147 total cpu time spent up to now is 167.2 secs Computing kpt #: 148 total cpu time spent up to now is 168.3 secs Computing kpt #: 149 total cpu time spent up to now is 169.3 secs Computing kpt #: 150 total cpu time spent up to now is 170.4 secs Computing kpt #: 151 total cpu time spent up to now is 171.4 secs Computing kpt #: 152 total cpu time spent up to now is 172.5 secs Computing kpt #: 153 total cpu time spent up to now is 173.6 secs Computing kpt #: 154 total cpu time spent up to now is 174.7 secs Computing kpt #: 155 total cpu time spent up to now is 175.8 secs Computing kpt #: 156 total cpu time spent up to now is 177.0 secs Computing kpt #: 157 total cpu time spent up to now is 178.4 secs Computing kpt #: 158 total cpu time spent up to now is 179.8 secs Computing kpt #: 159 total cpu time spent up to now is 181.0 secs Computing kpt #: 160 total cpu time spent up to now is 182.5 secs Computing kpt #: 161 total cpu time spent up to now is 184.1 secs Computing kpt #: 162 total cpu time spent up to now is 185.8 secs Computing kpt #: 163 total cpu time spent up to now is 187.6 secs Computing kpt #: 164 total cpu time spent up to now is 189.5 secs Computing kpt #: 165 total cpu time spent up to now is 191.5 secs Computing kpt #: 166 total cpu time spent up to now is 193.6 secs Computing kpt #: 167 total cpu time spent up to now is 195.3 secs Computing kpt #: 168 total cpu time spent up to now is 197.0 secs Computing kpt #: 169 total cpu time spent up to now is 198.7 secs Computing kpt #: 170 total cpu time spent up to now is 200.3 secs Computing kpt #: 171 total cpu time spent up to now is 201.9 secs Computing kpt #: 172 total cpu time spent up to now is 203.3 secs Computing kpt #: 173 total cpu time spent up to now is 204.6 secs Computing kpt #: 174 total cpu time spent up to now is 205.9 secs Computing kpt #: 175 total cpu time spent up to now is 207.1 secs Computing kpt #: 176 total cpu time spent up to now is 208.2 secs Computing kpt #: 177 total cpu time spent up to now is 209.3 secs Computing kpt #: 178 total cpu time spent up to now is 210.4 secs Computing kpt #: 179 total cpu time spent up to now is 211.5 secs Computing kpt #: 180 total cpu time spent up to now is 212.6 secs Computing kpt #: 181 total cpu time spent up to now is 213.7 secs Computing kpt #: 182 total cpu time spent up to now is 214.8 secs Computing kpt #: 183 total cpu time spent up to now is 215.9 secs Computing kpt #: 184 total cpu time spent up to now is 217.0 secs Computing kpt #: 185 total cpu time spent up to now is 218.1 secs Computing kpt #: 186 total cpu time spent up to now is 219.2 secs Computing kpt #: 187 total cpu time spent up to now is 220.4 secs Computing kpt #: 188 total cpu time spent up to now is 221.6 secs Computing kpt #: 189 total cpu time spent up to now is 223.0 secs Computing kpt #: 190 total cpu time spent up to now is 224.4 secs Computing kpt #: 191 total cpu time spent up to now is 225.7 secs Computing kpt #: 192 total cpu time spent up to now is 227.0 secs Computing kpt #: 193 total cpu time spent up to now is 228.3 secs Computing kpt #: 194 total cpu time spent up to now is 229.6 secs Computing kpt #: 195 total cpu time spent up to now is 230.7 secs Computing kpt #: 196 total cpu time spent up to now is 231.8 secs Computing kpt #: 197 total cpu time spent up to now is 232.9 secs Computing kpt #: 198 total cpu time spent up to now is 234.0 secs Computing kpt #: 199 total cpu time spent up to now is 235.1 secs Computing kpt #: 200 total cpu time spent up to now is 236.2 secs Computing kpt #: 201 total cpu time spent up to now is 237.3 secs Computing kpt #: 202 total cpu time spent up to now is 238.4 secs Computing kpt #: 203 total cpu time spent up to now is 239.6 secs Computing kpt #: 204 total cpu time spent up to now is 240.6 secs Computing kpt #: 205 total cpu time spent up to now is 241.7 secs Computing kpt #: 206 total cpu time spent up to now is 242.8 secs Computing kpt #: 207 total cpu time spent up to now is 243.8 secs Computing kpt #: 208 total cpu time spent up to now is 244.9 secs Computing kpt #: 209 total cpu time spent up to now is 246.0 secs Computing kpt #: 210 total cpu time spent up to now is 247.5 secs Computing kpt #: 211 total cpu time spent up to now is 248.6 secs Computing kpt #: 212 total cpu time spent up to now is 249.5 secs Computing kpt #: 213 total cpu time spent up to now is 250.6 secs Computing kpt #: 214 total cpu time spent up to now is 251.7 secs Computing kpt #: 215 total cpu time spent up to now is 252.8 secs Computing kpt #: 216 total cpu time spent up to now is 253.9 secs Computing kpt #: 217 total cpu time spent up to now is 254.9 secs Computing kpt #: 218 total cpu time spent up to now is 256.0 secs Computing kpt #: 219 total cpu time spent up to now is 257.1 secs Computing kpt #: 220 total cpu time spent up to now is 258.2 secs Computing kpt #: 221 total cpu time spent up to now is 259.3 secs Computing kpt #: 222 total cpu time spent up to now is 260.3 secs Computing kpt #: 223 total cpu time spent up to now is 261.4 secs Computing kpt #: 224 total cpu time spent up to now is 262.4 secs Computing kpt #: 225 total cpu time spent up to now is 263.5 secs Computing kpt #: 226 total cpu time spent up to now is 264.6 secs Computing kpt #: 227 total cpu time spent up to now is 265.5 secs Computing kpt #: 228 total cpu time spent up to now is 266.5 secs Computing kpt #: 229 total cpu time spent up to now is 267.6 secs Computing kpt #: 230 total cpu time spent up to now is 268.7 secs Computing kpt #: 231 total cpu time spent up to now is 269.6 secs Computing kpt #: 232 total cpu time spent up to now is 270.7 secs Computing kpt #: 233 total cpu time spent up to now is 272.4 secs Computing kpt #: 234 total cpu time spent up to now is 274.4 secs Computing kpt #: 235 total cpu time spent up to now is 276.6 secs Computing kpt #: 236 total cpu time spent up to now is 278.2 secs Computing kpt #: 237 total cpu time spent up to now is 279.5 secs Computing kpt #: 238 total cpu time spent up to now is 280.8 secs Computing kpt #: 239 total cpu time spent up to now is 282.0 secs Computing kpt #: 240 total cpu time spent up to now is 283.4 secs Computing kpt #: 241 total cpu time spent up to now is 284.6 secs Computing kpt #: 242 total cpu time spent up to now is 285.8 secs Computing kpt #: 243 total cpu time spent up to now is 286.9 secs Computing kpt #: 244 total cpu time spent up to now is 288.0 secs Computing kpt #: 245 total cpu time spent up to now is 289.0 secs Computing kpt #: 246 total cpu time spent up to now is 290.1 secs Computing kpt #: 247 total cpu time spent up to now is 291.1 secs Computing kpt #: 248 total cpu time spent up to now is 292.1 secs Computing kpt #: 249 total cpu time spent up to now is 293.1 secs Computing kpt #: 250 total cpu time spent up to now is 294.1 secs Computing kpt #: 251 total cpu time spent up to now is 295.1 secs Computing kpt #: 252 total cpu time spent up to now is 296.1 secs Computing kpt #: 253 total cpu time spent up to now is 297.0 secs Computing kpt #: 254 total cpu time spent up to now is 298.0 secs Computing kpt #: 255 total cpu time spent up to now is 299.0 secs Computing kpt #: 256 total cpu time spent up to now is 299.9 secs Computing kpt #: 257 total cpu time spent up to now is 300.8 secs Computing kpt #: 258 total cpu time spent up to now is 301.8 secs Computing kpt #: 259 total cpu time spent up to now is 303.5 secs Computing kpt #: 260 total cpu time spent up to now is 304.6 secs Computing kpt #: 261 total cpu time spent up to now is 305.8 secs Computing kpt #: 262 total cpu time spent up to now is 306.9 secs Computing kpt #: 263 total cpu time spent up to now is 307.9 secs Computing kpt #: 264 total cpu time spent up to now is 308.7 secs Computing kpt #: 265 total cpu time spent up to now is 309.5 secs Computing kpt #: 266 total cpu time spent up to now is 310.4 secs Computing kpt #: 267 total cpu time spent up to now is 311.2 secs Computing kpt #: 268 total cpu time spent up to now is 312.1 secs Computing kpt #: 269 total cpu time spent up to now is 312.9 secs Computing kpt #: 270 total cpu time spent up to now is 313.7 secs Computing kpt #: 271 total cpu time spent up to now is 314.6 secs Computing kpt #: 272 total cpu time spent up to now is 315.4 secs Computing kpt #: 273 total cpu time spent up to now is 316.4 secs Computing kpt #: 274 total cpu time spent up to now is 317.6 secs Computing kpt #: 275 total cpu time spent up to now is 318.7 secs Computing kpt #: 276 total cpu time spent up to now is 319.9 secs Computing kpt #: 277 total cpu time spent up to now is 321.0 secs Computing kpt #: 278 total cpu time spent up to now is 322.2 secs Computing kpt #: 279 total cpu time spent up to now is 323.6 secs Computing kpt #: 280 total cpu time spent up to now is 324.7 secs Computing kpt #: 281 total cpu time spent up to now is 326.0 secs Computing kpt #: 282 total cpu time spent up to now is 327.2 secs Computing kpt #: 283 total cpu time spent up to now is 328.4 secs Computing kpt #: 284 total cpu time spent up to now is 329.6 secs ethr = 1.79E-08, avg # of iterations = 35.2 total cpu time spent up to now is 329.6 secs End of band structure calculation k = 0.0000 0.0000 0.0000 ( 5133 PWs) bands (ev): -20.0324 -20.0324 -19.2198 -19.2198 -15.4038 -15.4038 -15.2625 -15.2625 -13.8483 -13.8483 -12.8056 -12.8056 -12.7948 -12.7948 -8.6826 -8.6826 -4.7319 -4.7319 -3.9052 -3.9052 -3.8184 -3.8184 -2.8008 -2.8008 -2.3159 -2.3159 -2.1365 -2.1365 -1.5249 -1.5249 -1.1837 -1.1837 -1.1424 -1.1424 1.3730 1.3730 1.5989 1.5989 1.6065 1.6065 2.2043 2.2043 2.3632 2.3632 2.3942 2.3942 3.4810 3.4810 3.4834 3.4834 3.5263 3.5263 3.9462 3.9462 3.9569 3.9569 7.2004 7.2004 10.0168 10.0168 11.0017 11.0017 12.1998 12.1998 12.8681 12.8681 12.8900 12.8900 k = 0.0135 0.0078-0.0000 ( 5145 PWs) bands (ev): -20.0324 -20.0324 -19.2193 -19.2193 -15.4051 -15.4046 -15.2636 -15.2636 -13.8485 -13.8475 -12.8054 -12.8053 -12.7946 -12.7946 -8.6798 -8.6797 -4.7325 -4.7315 -3.9054 -3.9054 -3.8192 -3.8178 -2.8244 -2.7824 -2.3414 -2.2934 -2.1369 -2.1360 -1.5246 -1.5243 -1.1836 -1.1786 -1.1401 -1.1401 1.3742 1.3744 1.5922 1.5923 1.6029 1.6035 2.2107 2.2119 2.3615 2.3619 2.3926 2.3927 3.4741 3.4809 3.4825 3.4828 3.5267 3.5336 3.9460 3.9465 3.9569 3.9569 7.2043 7.2046 10.0180 10.0181 10.9983 11.0059 12.1956 12.1957 12.8682 12.8682 12.8901 12.8902 k = 0.0270 0.0156-0.0000 ( 5147 PWs) bands (ev): -20.0323 -20.0323 -19.2177 -19.2177 -15.4086 -15.4075 -15.2669 -15.2668 -13.8481 -13.8460 -12.8048 -12.8047 -12.7940 -12.7940 -8.6713 -8.6712 -4.7333 -4.7314 -3.9060 -3.9060 -3.8203 -3.8176 -2.8519 -2.7705 -2.3670 -2.2791 -2.1388 -2.1315 -1.5231 -1.5227 -1.1784 -1.1685 -1.1333 -1.1331 1.3781 1.3784 1.5680 1.5682 1.5981 1.5991 2.2295 2.2320 2.3557 2.3570 2.3889 2.3894 3.4638 3.4734 3.4810 3.4812 3.5346 3.5448 3.9458 3.9467 3.9571 3.9572 7.2163 7.2168 10.0217 10.0219 10.9955 11.0108 12.1832 12.1835 12.8675 12.8675 12.8913 12.8915 k = 0.0405 0.0234-0.0000 ( 5156 PWs) bands (ev): -20.0322 -20.0322 -19.2152 -19.2151 -15.4143 -15.4127 -15.2722 -15.2721 -13.8471 -13.8440 -12.8039 -12.8038 -12.7932 -12.7931 -8.6572 -8.6571 -4.7343 -4.7315 -3.9070 -3.9069 -3.8217 -3.8176 -2.8821 -2.7661 -2.3915 -2.2782 -2.1423 -2.1190 -1.5205 -1.5202 -1.1684 -1.1538 -1.1218 -1.1213 1.3845 1.3848 1.5295 1.5300 1.5920 1.5934 2.2569 2.2611 2.3438 2.3469 2.3858 2.3870 3.4524 3.4630 3.4785 3.4786 3.5458 3.5576 3.9455 3.9466 3.9577 3.9582 7.2362 7.2368 10.0279 10.0282 10.9935 11.0165 12.1633 12.1637 12.8640 12.8640 12.8953 12.8955 k = 0.0541 0.0312-0.0000 ( 5152 PWs) bands (ev): -20.0321 -20.0320 -19.2116 -19.2116 -15.4224 -15.4204 -15.2792 -15.2790 -13.8454 -13.8413 -12.8026 -12.8025 -12.7919 -12.7919 -8.6376 -8.6374 -4.7355 -4.7318 -3.9083 -3.9083 -3.8233 -3.8179 -2.9141 -2.7694 -2.4150 -2.2916 -2.1464 -2.0980 -1.5166 -1.5164 -1.1539 -1.1352 -1.1058 -1.1048 1.3931 1.3936 1.4808 1.4819 1.5838 1.5856 2.2862 2.2938 2.3259 2.3320 2.3867 2.3880 3.4408 3.4519 3.4749 3.4750 3.5583 3.5709 3.9446 3.9456 3.9591 3.9601 7.2636 7.2645 10.0365 10.0369 10.9923 11.0228 12.1366 12.1371 12.8562 12.8563 12.9029 12.9031 k = 0.0676 0.0390-0.0000 ( 5148 PWs) bands (ev): -20.0319 -20.0319 -19.2070 -19.2070 -15.4331 -15.4308 -15.2877 -15.2872 -13.8431 -13.8381 -12.8010 -12.8008 -12.7904 -12.7904 -8.6125 -8.6123 -4.7370 -4.7324 -3.9101 -3.9099 -3.8252 -3.8185 -2.9471 -2.7799 -2.4391 -2.3165 -2.1499 -2.0722 -1.5118 -1.5109 -1.1352 -1.1132 -1.0853 -1.0840 1.4033 1.4036 1.4255 1.4271 1.5738 1.5759 2.2940 2.2974 2.3280 2.3286 2.3963 2.3966 3.4297 3.4410 3.4702 3.4703 3.5711 3.5843 3.9430 3.9438 3.9614 3.9631 7.2984 7.2995 10.0475 10.0480 10.9917 11.0297 12.1041 12.1046 12.8438 12.8440 12.9138 12.9139 k = 0.0811 0.0468-0.0000 ( 5140 PWs) bands (ev): -20.0316 -20.0316 -19.2014 -19.2014 -15.4466 -15.4441 -15.2971 -15.2964 -13.8403 -13.8344 -12.7991 -12.7989 -12.7886 -12.7885 -8.5820 -8.5818 -4.7386 -4.7332 -3.9122 -3.9119 -3.8273 -3.8193 -2.9804 -2.7962 -2.4655 -2.3496 -2.1518 -2.0449 -1.5057 -1.5038 -1.1122 -1.0879 -1.0607 -1.0593 1.3633 1.3659 1.4164 1.4166 1.5625 1.5647 2.2685 2.2700 2.3395 2.3449 2.4200 2.4207 3.4193 3.4307 3.4644 3.4644 3.5839 3.5976 3.9406 3.9413 3.9647 3.9671 7.3400 7.3413 10.0608 10.0614 10.9918 11.0373 12.0667 12.0673 12.8268 12.8270 12.9276 12.9277 k = 0.0946 0.0546-0.0000 ( 5132 PWs) bands (ev): -20.0313 -20.0313 -19.1948 -19.1948 -15.4631 -15.4605 -15.3072 -15.3060 -13.8368 -13.8301 -12.7969 -12.7967 -12.7865 -12.7864 -8.5464 -8.5462 -4.7404 -4.7342 -3.9146 -3.9143 -3.8296 -3.8203 -3.0134 -2.8168 -2.4960 -2.3891 -2.1514 -2.0185 -1.4982 -1.4954 -1.0850 -1.0592 -1.0329 -1.0314 1.2992 1.3027 1.4277 1.4280 1.5513 1.5532 2.2348 2.2380 2.3431 2.3503 2.4561 2.4568 3.4096 3.4212 3.4575 3.4575 3.5965 3.6106 3.9375 3.9381 3.9689 3.9718 7.3879 7.3895 10.0762 10.0769 10.9926 11.0454 12.0254 12.0261 12.8050 12.8053 12.9438 12.9441 k = 0.1081 0.0624-0.0000 ( 5132 PWs) bands (ev): -20.0310 -20.0310 -19.1873 -19.1873 -15.4828 -15.4802 -15.3174 -15.3158 -13.8328 -13.8253 -12.7945 -12.7943 -12.7842 -12.7841 -8.5058 -8.5055 -4.7424 -4.7354 -3.9174 -3.9169 -3.8321 -3.8215 -3.0458 -2.8400 -2.5313 -2.4334 -2.1492 -1.9943 -1.4894 -1.4856 -1.0535 -1.0272 -1.0024 -1.0009 1.2328 1.2372 1.4351 1.4366 1.5432 1.5444 2.1980 2.2023 2.3419 2.3501 2.4969 2.4975 3.4010 3.4128 3.4494 3.4494 3.6088 3.6231 3.9338 3.9342 3.9740 3.9774 7.4417 7.4435 10.0938 10.0945 10.9939 11.0539 11.9811 11.9819 12.7785 12.7788 12.9623 12.9630 k = 0.1216 0.0702-0.0000 ( 5128 PWs) bands (ev): -20.0307 -20.0307 -19.1789 -19.1789 -15.5055 -15.5031 -15.3277 -15.3256 -13.8282 -13.8200 -12.7919 -12.7918 -12.7817 -12.7815 -8.4604 -8.4600 -4.7445 -4.7368 -3.9205 -3.9198 -3.8348 -3.8230 -3.0773 -2.8646 -2.5719 -2.4818 -2.1456 -1.9733 -1.4792 -1.4746 -1.0180 -0.9916 -0.9700 -0.9680 1.1652 1.1706 1.4334 1.4366 1.5430 1.5433 2.1592 2.1643 2.3385 2.3474 2.5384 2.5390 3.3936 3.4054 3.4402 3.4402 3.6207 3.6353 3.9294 3.9298 3.9797 3.9837 7.5008 7.5027 10.1133 10.1141 10.9958 11.0629 11.9346 11.9354 12.7473 12.7475 12.9828 12.9840 k = 0.1351 0.0780-0.0000 ( 5124 PWs) bands (ev): -20.0303 -20.0303 -19.1696 -19.1696 -15.5312 -15.5290 -15.3379 -15.3352 -13.8232 -13.8143 -12.7892 -12.7891 -12.7791 -12.7788 -8.4104 -8.4100 -4.7468 -4.7384 -3.9239 -3.9230 -3.8376 -3.8246 -3.1075 -2.8896 -2.6172 -2.5335 -2.1417 -1.9560 -1.4678 -1.4624 -0.9789 -0.9527 -0.9359 -0.9331 1.0971 1.1036 1.4196 1.4244 1.5527 1.5543 2.1192 2.1251 2.3335 2.3432 2.5790 2.5798 3.3874 3.3994 3.4300 3.4300 3.6322 3.6469 3.9244 3.9247 3.9862 3.9906 7.5646 7.5668 10.1346 10.1354 10.9983 11.0722 11.8865 11.8874 12.7116 12.7118 13.0050 13.0070 k = 0.1486 0.0858-0.0000 ( 5130 PWs) bands (ev): -20.0299 -20.0299 -19.1595 -19.1595 -15.5597 -15.5577 -15.3478 -15.3446 -13.8176 -13.8081 -12.7864 -12.7864 -12.7763 -12.7759 -8.3560 -8.3555 -4.7491 -4.7402 -3.9275 -3.9264 -3.8404 -3.8264 -3.1363 -2.9141 -2.6668 -2.5880 -2.1384 -1.9426 -1.4551 -1.4492 -0.9373 -0.9116 -0.8999 -0.8957 1.0292 1.0367 1.3958 1.4016 1.5715 1.5737 2.0790 2.0855 2.3273 2.3378 2.6178 2.6188 3.3824 3.3945 3.4188 3.4188 3.6432 3.6580 3.9187 3.9190 3.9934 3.9980 7.6326 7.6350 10.1575 10.1584 11.0013 11.0818 11.8376 11.8386 12.6717 12.6719 13.0285 13.0317 k = 0.1622 0.0936-0.0000 ( 5122 PWs) bands (ev): -20.0295 -20.0295 -19.1486 -19.1486 -15.5907 -15.5888 -15.3574 -15.3538 -13.8116 -13.8017 -12.7836 -12.7836 -12.7735 -12.7730 -8.2974 -8.2970 -4.7516 -4.7421 -3.9313 -3.9301 -3.8433 -3.8283 -3.1636 -2.9377 -2.7200 -2.6449 -2.1364 -1.9334 -1.4413 -1.4351 -0.8949 -0.8720 -0.8587 -0.8549 0.9621 0.9708 1.3649 1.3713 1.5959 1.5986 2.0393 2.0463 2.3201 2.3312 2.6544 2.6557 3.3788 3.3909 3.4068 3.4070 3.6538 3.6687 3.9124 3.9127 4.0010 4.0060 7.7042 7.7068 10.1819 10.1827 11.0048 11.0916 11.7884 11.7893 12.6280 12.6282 13.0528 13.0577 k = 0.1757 0.1014-0.0000 ( 5126 PWs) bands (ev): -20.0291 -20.0291 -19.1370 -19.1369 -15.6238 -15.6221 -15.3668 -15.3628 -13.8052 -13.7948 -12.7809 -12.7808 -12.7705 -12.7699 -8.2351 -8.2346 -4.7541 -4.7441 -3.9354 -3.9339 -3.8463 -3.8304 -3.1895 -2.9601 -2.7764 -2.7035 -2.1363 -1.9282 -1.4265 -1.4202 -0.8539 -0.8356 -0.8114 -0.8094 0.8964 0.9061 1.3288 1.3355 1.6238 1.6267 2.0010 2.0083 2.3117 2.3235 2.6885 2.6901 3.3762 3.3874 3.3943 3.3954 3.6640 3.6788 3.9055 3.9057 4.0092 4.0144 7.7790 7.7817 10.2075 10.2084 11.0088 11.1017 11.7393 11.7403 12.5809 12.5811 13.0773 13.0846 k = 0.1892 0.1092-0.0000 ( 5120 PWs) bands (ev): -20.0287 -20.0287 -19.1246 -19.1246 -15.6587 -15.6572 -15.3760 -15.3716 -13.7985 -13.7877 -12.7783 -12.7781 -12.7675 -12.7668 -8.1691 -8.1686 -4.7567 -4.7463 -3.9395 -3.9379 -3.8492 -3.8326 -3.2138 -2.9813 -2.8350 -2.7634 -2.1385 -1.9270 -1.4109 -1.4045 -0.8151 -0.8002 -0.7608 -0.7592 0.8327 0.8434 1.2884 1.2953 1.6537 1.6569 1.9649 1.9724 2.3023 2.3148 2.7199 2.7219 3.3729 3.3779 3.3831 3.3904 3.6738 3.6885 3.8979 3.8981 4.0178 4.0231 7.8562 7.8591 10.2342 10.2350 11.0133 11.1119 11.6907 11.6918 12.5308 12.5310 13.1009 13.1119 k = 0.2027 0.1170-0.0000 ( 5118 PWs) bands (ev): -20.0282 -20.0282 -19.1116 -19.1116 -15.6951 -15.6938 -15.3850 -15.3803 -13.7914 -13.7804 -12.7757 -12.7754 -12.7644 -12.7637 -8.0998 -8.0993 -4.7593 -4.7486 -3.9438 -3.9420 -3.8520 -3.8349 -3.2370 -3.0018 -2.8945 -2.8241 -2.1432 -1.9297 -1.3945 -1.3883 -0.7783 -0.7655 -0.7081 -0.7056 0.7714 0.7830 1.2447 1.2516 1.6843 1.6877 1.9319 1.9393 2.2918 2.3049 2.7487 2.7510 3.3628 3.3641 3.3793 3.3902 3.6834 3.6978 3.8896 3.8898 4.0267 4.0321 7.9356 7.9387 10.2617 10.2624 11.0184 11.1223 11.6431 11.6442 12.4783 12.4784 13.1225 13.1388 k = 0.2162 0.1248-0.0000 ( 5114 PWs) bands (ev): -20.0277 -20.0277 -19.0981 -19.0981 -15.7326 -15.7314 -15.3938 -15.3889 -13.7840 -13.7729 -12.7733 -12.7729 -12.7613 -12.7606 -8.0276 -8.0270 -4.7619 -4.7510 -3.9482 -3.9463 -3.8548 -3.8373 -3.2594 -3.0251 -2.9514 -2.8847 -2.1507 -1.9360 -1.3774 -1.3715 -0.7428 -0.7313 -0.6543 -0.6501 0.7133 0.7257 1.1981 1.2050 1.7135 1.7174 1.9038 1.9109 2.2801 2.2939 2.7748 2.7774 3.3486 3.3493 3.3801 3.3915 3.6928 3.7068 3.8806 3.8808 4.0357 4.0413 8.0165 8.0198 10.2898 10.2903 11.0240 11.1327 11.5968 11.5979 12.4237 12.4238 13.1404 13.1643 k = 0.2297 0.1326-0.0000 ( 5114 PWs) bands (ev): -20.0273 -20.0273 -19.0841 -19.0841 -15.7710 -15.7699 -15.4024 -15.3974 -13.7764 -13.7652 -12.7709 -12.7706 -12.7583 -12.7576 -7.9527 -7.9521 -4.7645 -4.7534 -3.9526 -3.9506 -3.8575 -3.8397 -3.2818 -3.0617 -2.9942 -2.9442 -2.1610 -1.9458 -1.3599 -1.3542 -0.7084 -0.6978 -0.6000 -0.5939 0.6590 0.6720 1.1495 1.1562 1.7374 1.7421 1.8845 1.8907 2.2674 2.2817 2.7984 2.8013 3.3334 3.3339 3.3825 3.3937 3.7020 3.7156 3.8709 3.8711 4.0449 4.0506 8.0986 8.1020 10.3182 10.3185 11.0303 11.1433 11.5521 11.5532 12.3676 12.3677 13.1526 13.1871 k = 0.2432 0.1404-0.0000 ( 5110 PWs) bands (ev): -20.0268 -20.0268 -19.0697 -19.0696 -15.8098 -15.8089 -15.4108 -15.4057 -13.7686 -13.7574 -12.7688 -12.7684 -12.7553 -12.7546 -7.8755 -7.8749 -4.7671 -4.7559 -3.9570 -3.9550 -3.8601 -3.8422 -3.3056 -3.1181 -3.0163 -3.0010 -2.1742 -1.9590 -1.3420 -1.3367 -0.6750 -0.6651 -0.5462 -0.5382 0.6093 0.6226 1.0994 1.1059 1.7486 1.7547 1.8807 1.8855 2.2535 2.2683 2.8196 2.8226 3.3177 3.3181 3.3856 3.3964 3.7111 3.7242 3.8606 3.8607 4.0542 4.0598 8.1813 8.1849 10.3466 10.3467 11.0372 11.1539 11.5092 11.5103 12.3105 12.3106 13.1570 13.2055 k = 0.2568 0.1482-0.0000 ( 5110 PWs) bands (ev): -20.0264 -20.0264 -19.0549 -19.0549 -15.8488 -15.8480 -15.4189 -15.4138 -13.7608 -13.7496 -12.7668 -12.7664 -12.7524 -12.7517 -7.7963 -7.7957 -4.7697 -4.7584 -3.9614 -3.9595 -3.8625 -3.8448 -3.3326 -3.1838 -3.0528 -3.0278 -2.1902 -1.9755 -1.3239 -1.3190 -0.6427 -0.6333 -0.4938 -0.4843 0.5649 0.5783 1.0485 1.0547 1.7431 1.7502 1.8963 1.8998 2.2385 2.2538 2.8386 2.8418 3.3016 3.3021 3.3892 3.3995 3.7203 3.7327 3.8497 3.8498 4.0633 4.0689 8.2643 8.2680 10.3746 10.3747 11.0448 11.1647 11.4683 11.4694 12.2528 12.2530 13.1520 13.2176 k = 0.2703 0.1560-0.0000 ( 5116 PWs) bands (ev): -20.0259 -20.0259 -19.0400 -19.0399 -15.8878 -15.8871 -15.4269 -15.4217 -13.7528 -13.7418 -12.7649 -12.7645 -12.7496 -12.7489 -7.7156 -7.7150 -4.7721 -4.7610 -3.9657 -3.9640 -3.8649 -3.8474 -3.3653 -3.2530 -3.0970 -3.0341 -2.2089 -1.9950 -1.3057 -1.3012 -0.6114 -0.6024 -0.4439 -0.4333 0.5269 0.5398 0.9974 1.0033 1.7269 1.7343 1.9249 1.9278 2.2223 2.2381 2.8557 2.8589 3.2854 3.2859 3.3930 3.4026 3.7294 3.7412 3.8381 3.8382 4.0723 4.0778 8.3470 8.3509 10.4020 10.4023 11.0532 11.1755 11.4297 11.4307 12.1952 12.1955 13.1371 13.2215 k = 0.2838 0.1638-0.0000 ( 5114 PWs) bands (ev): -20.0255 -20.0255 -19.0249 -19.0249 -15.9263 -15.9257 -15.4345 -15.4295 -13.7448 -13.7341 -12.7632 -12.7629 -12.7470 -12.7463 -7.6338 -7.6331 -4.7745 -4.7635 -3.9699 -3.9685 -3.8670 -3.8500 -3.4058 -3.3241 -3.1311 -3.0366 -2.2303 -2.0174 -1.2876 -1.2834 -0.5813 -0.5727 -0.3976 -0.3865 0.4962 0.5081 0.9467 0.9523 1.7063 1.7136 1.9598 1.9625 2.2051 2.2212 2.8711 2.8743 3.2691 3.2696 3.3967 3.4056 3.7386 3.7496 3.8261 3.8261 4.0811 4.0865 8.4292 8.4332 10.4284 10.4290 11.0623 11.1863 11.3932 11.3942 12.1382 12.1387 13.1131 13.2156 k = 0.2973 0.1716-0.0000 ( 5116 PWs) bands (ev): -20.0251 -20.0251 -19.0098 -19.0098 -15.9643 -15.9637 -15.4419 -15.4369 -13.7369 -13.7265 -12.7617 -12.7613 -12.7445 -12.7439 -7.5512 -7.5505 -4.7768 -4.7659 -3.9741 -3.9731 -3.8691 -3.8526 -3.4545 -3.3962 -3.1544 -3.0360 -2.2542 -2.0425 -1.2696 -1.2658 -0.5524 -0.5442 -0.3561 -0.3453 0.4738 0.4841 0.8970 0.9022 1.6844 1.6915 1.9976 2.0001 2.1870 2.2033 2.8850 2.8881 3.2528 3.2533 3.4001 3.4082 3.7478 3.7580 3.8136 3.8136 4.0896 4.0949 8.5103 8.5144 10.4538 10.4547 11.0721 11.1971 11.3591 11.3600 12.0826 12.0833 13.0816 13.1993 k = 0.3108 0.1794-0.0000 ( 5116 PWs) bands (ev): -20.0247 -20.0247 -18.9949 -18.9948 -16.0013 -16.0008 -15.4489 -15.4441 -13.7291 -13.7190 -12.7603 -12.7600 -12.7422 -12.7416 -7.4684 -7.4677 -4.7790 -4.7684 -3.9781 -3.9778 -3.8710 -3.8551 -3.5100 -3.4686 -3.1678 -3.0323 -2.2805 -2.0702 -1.2520 -1.2485 -0.5248 -0.5170 -0.3205 -0.3107 0.4605 0.4687 0.8488 0.8536 1.6625 1.6692 2.0366 2.0391 2.1679 2.1844 2.8976 2.9005 3.2366 3.2372 3.4030 3.4103 3.7570 3.7663 3.8007 3.8007 4.0978 4.1029 8.5900 8.5941 10.4778 10.4789 11.0827 11.2078 11.3271 11.3281 12.0291 12.0299 13.0447 13.1734 k = 0.3243 0.1872-0.0000 ( 5112 PWs) bands (ev): -20.0243 -20.0243 -18.9801 -18.9801 -16.0371 -16.0367 -15.4556 -15.4510 -13.7215 -13.7118 -12.7591 -12.7588 -12.7401 -12.7396 -7.3859 -7.3852 -4.7811 -4.7707 -3.9825 -3.9821 -3.8729 -3.8577 -3.5702 -3.5410 -3.1732 -3.0258 -2.3087 -2.1003 -1.2348 -1.2317 -0.4987 -0.4912 -0.2918 -0.2835 0.4569 0.4623 0.8025 0.8069 1.6412 1.6475 2.0760 2.0784 2.1480 2.1646 2.9091 2.9118 3.2206 3.2212 3.4054 3.4118 3.7660 3.7745 3.7876 3.7877 4.1055 4.1104 8.6677 8.6719 10.5003 10.5017 11.0939 11.2181 11.2974 11.2982 11.9784 11.9794 13.0043 13.1396 k = 0.3378 0.1951-0.0000 ( 5106 PWs) bands (ev): -20.0239 -20.0239 -18.9657 -18.9657 -16.0715 -16.0711 -15.4619 -15.4575 -13.7141 -13.7049 -12.7580 -12.7577 -12.7382 -12.7377 -7.3042 -7.3035 -4.7830 -4.7730 -3.9875 -3.9860 -3.8746 -3.8602 -3.6328 -3.6127 -3.1723 -3.0167 -2.3388 -2.1326 -1.2183 -1.2155 -0.4740 -0.4670 -0.2703 -0.2641 0.4627 0.4651 0.7584 0.7625 1.6207 1.6267 2.1151 2.1175 2.1275 2.1442 2.9196 2.9221 3.2049 3.2056 3.4071 3.4127 3.7734 3.7742 3.7759 3.7829 4.1128 4.1175 8.7431 8.7473 10.5212 10.5228 11.1053 11.2268 11.2702 11.2705 11.9313 11.9326 12.9620 13.0999 k = 0.3514 0.2029-0.0000 ( 5110 PWs) bands (ev): -20.0236 -20.0236 -18.9518 -18.9518 -16.1042 -16.1039 -15.4678 -15.4637 -13.7069 -13.6983 -12.7570 -12.7567 -12.7365 -12.7360 -7.2240 -7.2234 -4.7847 -4.7751 -3.9929 -3.9899 -3.8764 -3.8627 -3.6958 -3.6830 -3.1661 -3.0051 -2.3704 -2.1667 -1.2025 -1.2000 -0.4509 -0.4443 -0.2558 -0.2518 0.4763 0.4770 0.7170 0.7207 1.6013 1.6068 2.1066 2.1228 2.1539 2.1559 2.9292 2.9314 3.1897 3.1903 3.4081 3.4129 3.7610 3.7611 3.7838 3.7906 4.1196 4.1240 8.8156 8.8198 10.5404 10.5422 11.1165 11.2261 11.2442 11.2537 11.8886 11.8901 12.9193 13.0562 k = 0.3649 0.2107-0.0000 ( 5112 PWs) bands (ev): -20.0233 -20.0233 -18.9385 -18.9385 -16.1350 -16.1347 -15.4733 -15.4695 -13.7002 -13.6922 -12.7561 -12.7559 -12.7350 -12.7346 -7.1460 -7.1454 -4.7863 -4.7772 -3.9990 -3.9939 -3.8785 -3.8652 -3.7574 -3.7512 -3.1556 -2.9913 -2.4030 -2.2025 -1.1875 -1.1853 -0.4296 -0.4234 -0.2476 -0.2456 0.4948 0.4983 0.6786 0.6819 1.5830 1.5882 2.0855 2.1015 2.1911 2.1930 2.9380 2.9400 3.1749 3.1756 3.4085 3.4125 3.7480 3.7481 3.7921 3.7981 4.1260 4.1300 8.8847 8.8889 10.5581 10.5599 11.1261 11.2056 11.2209 11.2566 11.8511 11.8528 12.8772 13.0104 k = 0.3784 0.2185-0.0000 ( 5116 PWs) bands (ev): -20.0230 -20.0230 -18.9259 -18.9259 -16.1636 -16.1634 -15.4783 -15.4748 -13.6938 -13.6864 -12.7554 -12.7552 -12.7337 -12.7333 -7.0710 -7.0704 -4.7877 -4.7791 -4.0066 -3.9986 -3.8817 -3.8682 -3.8156 -3.8146 -3.1415 -2.9758 -2.4361 -2.2397 -1.1736 -1.1716 -0.4100 -0.4043 -0.2444 -0.2442 0.5188 0.5246 0.6433 0.6463 1.5661 1.5708 2.0645 2.0800 2.2268 2.2287 2.9460 2.9478 3.1607 3.1614 3.4084 3.4117 3.7353 3.7354 3.7999 3.8053 4.1317 4.1355 8.9500 8.9540 10.5743 10.5762 11.1305 11.1791 11.2033 11.2646 11.8193 11.8212 12.8368 12.9639 k = 0.3919 0.2263-0.0000 ( 5108 PWs) bands (ev): -20.0227 -20.0227 -18.9143 -18.9142 -16.1899 -16.1897 -15.4828 -15.4796 -13.6879 -13.6812 -12.7548 -12.7546 -12.7325 -12.7322 -6.9997 -6.9991 -4.7888 -4.7808 -4.0172 -4.0048 -3.8923 -3.8827 -3.8633 -3.8586 -3.1241 -2.9589 -2.4691 -2.2778 -1.1607 -1.1591 -0.3922 -0.3870 -0.2460 -0.2450 0.5465 0.5539 0.6115 0.6142 1.5506 1.5548 2.0439 2.0587 2.2606 2.2623 2.9534 2.9549 3.1473 3.1480 3.4077 3.4104 3.7232 3.7233 3.8073 3.8119 4.1370 4.1404 9.0107 9.0146 10.5895 10.5912 11.1235 11.1511 11.1970 11.2728 11.7936 11.7956 12.7990 12.9180 k = 0.4054 0.2341-0.0000 ( 5104 PWs) bands (ev): -20.0225 -20.0225 -18.9036 -18.9036 -16.2137 -16.2135 -15.4868 -15.4840 -13.6824 -13.6765 -12.7542 -12.7540 -12.7315 -12.7312 -6.9332 -6.9327 -4.7897 -4.7824 -4.0337 -4.0158 -3.9298 -3.9228 -3.8730 -3.8693 -3.1039 -2.9414 -2.5011 -2.3166 -1.1491 -1.1477 -0.3764 -0.3717 -0.2499 -0.2481 0.5752 0.5821 0.5854 0.5862 1.5367 1.5404 2.0242 2.0381 2.2919 2.2934 2.9600 2.9612 3.1348 3.1355 3.4067 3.4089 3.7118 3.7119 3.8140 3.8180 4.1416 4.1447 9.0665 9.0701 10.6037 10.6052 11.1049 11.1223 11.2021 11.2802 11.7737 11.7757 12.7648 12.8736 k = 0.4189 0.2419-0.0000 ( 5106 PWs) bands (ev): -20.0223 -20.0223 -18.8941 -18.8941 -16.2346 -16.2345 -15.4903 -15.4879 -13.6776 -13.6725 -12.7537 -12.7536 -12.7307 -12.7304 -6.8724 -6.8719 -4.7905 -4.7839 -4.0590 -4.0385 -3.9637 -3.9506 -3.8762 -3.8716 -3.0813 -2.9243 -2.5309 -2.3556 -1.1388 -1.1376 -0.3626 -0.3584 -0.2548 -0.2526 0.5583 0.5601 0.6058 0.6143 1.5244 1.5276 2.0059 2.0185 2.3204 2.3218 2.9658 2.9668 3.1233 3.1240 3.4055 3.4072 3.7014 3.7015 3.8200 3.8233 4.1457 4.1484 9.1165 9.1199 10.6172 10.6185 11.0807 11.0931 11.2127 11.2862 11.7593 11.7613 12.7347 12.8318 k = 0.4324 0.2497-0.0000 ( 5104 PWs) bands (ev): -20.0221 -20.0221 -18.8858 -18.8858 -16.2527 -16.2526 -15.4933 -15.4912 -13.6733 -13.6690 -12.7534 -12.7532 -12.7300 -12.7298 -6.8184 -6.8180 -4.7909 -4.7852 -4.0909 -4.0735 -3.9794 -3.9675 -3.8776 -3.8733 -3.0568 -2.9092 -2.5568 -2.3944 -1.1299 -1.1289 -0.3507 -0.3471 -0.2599 -0.2576 0.5374 0.5390 0.6337 0.6419 1.5138 1.5165 1.9893 2.0004 2.3455 2.3467 2.9709 2.9717 3.1131 3.1137 3.4042 3.4054 3.6921 3.6922 3.8253 3.8280 4.1492 4.1515 9.1603 9.1633 10.6300 10.6310 11.0550 11.0644 11.2253 11.2907 11.7496 11.7515 12.7096 12.7934 k = 0.4459 0.2575-0.0000 ( 5116 PWs) bands (ev): -20.0219 -20.0219 -18.8789 -18.8789 -16.2677 -16.2676 -15.4957 -15.4940 -13.6697 -13.6662 -12.7531 -12.7530 -12.7295 -12.7293 -6.7723 -6.7720 -4.7911 -4.7864 -4.1234 -4.1103 -3.9861 -3.9773 -3.8784 -3.8748 -3.0308 -2.8982 -2.5767 -2.4325 -1.1225 -1.1217 -0.3410 -0.3379 -0.2647 -0.2626 0.5203 0.5215 0.6588 0.6662 1.5051 1.5073 1.9751 1.9844 2.3669 2.3679 2.9751 2.9757 3.1043 3.1048 3.4029 3.4038 3.6842 3.6843 3.8297 3.8318 4.1521 4.1539 9.1972 9.1997 10.6421 10.6428 11.0300 11.0373 11.2383 11.2931 11.7437 11.7453 12.6900 12.7590 k = 0.4595 0.2653-0.0000 ( 5122 PWs) bands (ev): -20.0218 -20.0218 -18.8734 -18.8734 -16.2795 -16.2794 -15.4975 -15.4962 -13.6668 -13.6641 -12.7528 -12.7528 -12.7291 -12.7289 -6.7351 -6.7348 -4.7911 -4.7875 -4.1516 -4.1424 -3.9893 -3.9832 -3.8788 -3.8760 -3.0039 -2.8936 -2.5880 -2.4690 -1.1167 -1.1161 -0.3333 -0.3309 -0.2686 -0.2670 0.5070 0.5079 0.6800 0.6860 1.4983 1.4999 1.9636 1.9709 2.3842 2.3849 2.9785 2.9789 3.0972 3.0976 3.4017 3.4024 3.6779 3.6780 3.8332 3.8348 4.1544 4.1558 9.2266 9.2286 10.6530 10.6535 11.0078 11.0132 11.2509 11.2935 11.7405 11.7418 12.6764 12.7294 k = 0.4730 0.2731-0.0000 ( 5132 PWs) bands (ev): -20.0217 -20.0217 -18.8694 -18.8694 -16.2880 -16.2879 -15.4987 -15.4979 -13.6645 -13.6627 -12.7527 -12.7526 -12.7288 -12.7287 -6.7078 -6.7076 -4.7909 -4.7884 -4.1729 -4.1670 -3.9908 -3.9870 -3.8789 -3.8770 -2.9770 -2.8971 -2.5888 -2.5033 -1.1125 -1.1121 -0.3276 -0.3260 -0.2715 -0.2704 0.4975 0.4981 0.6962 0.7004 1.4934 1.4945 1.9555 1.9605 2.3968 2.3974 2.9809 2.9812 3.0920 3.0923 3.4009 3.4013 3.6733 3.6733 3.8358 3.8368 4.1561 4.1571 9.2482 9.2495 10.6620 10.6622 10.9901 10.9938 11.2624 11.2916 11.7390 11.7399 12.6691 12.7050 k = 0.4865 0.2809-0.0000 ( 5136 PWs) bands (ev): -20.0217 -20.0217 -18.8670 -18.8670 -16.2931 -16.2931 -15.4994 -15.4990 -13.6630 -13.6621 -12.7526 -12.7525 -12.7286 -12.7286 -6.6910 -6.6909 -4.7905 -4.7892 -4.1857 -4.1828 -3.9913 -3.9894 -3.8787 -3.8778 -2.9511 -2.9091 -2.5791 -2.5342 -1.1099 -1.1097 -0.3241 -0.3232 -0.2732 -0.2727 0.4919 0.4922 0.7067 0.7089 1.4906 1.4912 1.9510 1.9535 2.4046 2.4049 2.9824 2.9825 3.0888 3.0890 3.4004 3.4006 3.6704 3.6705 3.8375 3.8380 4.1573 4.1577 9.2614 9.2620 10.6680 10.6681 10.9790 10.9809 11.2726 11.2874 11.7386 11.7390 12.6684 12.6865 k = 0.5000 0.2887-0.0000 ( 5132 PWs) bands (ev): -20.0217 -20.0217 -18.8662 -18.8662 -16.2948 -16.2948 -15.4995 -15.4995 -13.6621 -13.6621 -12.7525 -12.7525 -12.7285 -12.7285 -6.6853 -6.6853 -4.7900 -4.7900 -4.1891 -4.1891 -3.9908 -3.9908 -3.8784 -3.8784 -2.9278 -2.9278 -2.5601 -2.5601 -1.1089 -1.1089 -0.3226 -0.3226 -0.2736 -0.2736 0.4901 0.4901 0.7110 0.7110 1.4898 1.4898 1.9503 1.9503 2.4073 2.4073 2.9830 2.9830 3.0878 3.0878 3.4002 3.4002 3.6695 3.6695 3.8382 3.8382 4.1578 4.1578 9.2660 9.2660 10.6701 10.6701 10.9757 10.9757 11.2810 11.2810 11.7386 11.7386 12.6742 12.6742 k = 0.5000 0.2887-0.0000 ( 5132 PWs) bands (ev): -20.0217 -20.0217 -18.8662 -18.8662 -16.2948 -16.2948 -15.4995 -15.4995 -13.6621 -13.6621 -12.7525 -12.7525 -12.7285 -12.7285 -6.6853 -6.6853 -4.7900 -4.7900 -4.1891 -4.1891 -3.9908 -3.9908 -3.8784 -3.8784 -2.9278 -2.9278 -2.5601 -2.5601 -1.1089 -1.1089 -0.3226 -0.3226 -0.2736 -0.2736 0.4901 0.4901 0.7110 0.7110 1.4898 1.4898 1.9503 1.9503 2.4073 2.4073 2.9830 2.9830 3.0878 3.0878 3.4002 3.4002 3.6695 3.6695 3.8382 3.8382 4.1578 4.1578 9.2660 9.2660 10.6701 10.6701 10.9757 10.9757 11.2810 11.2810 11.7386 11.7386 12.6742 12.6742 k = 0.4921 0.3024-0.0000 ( 5136 PWs) bands (ev): -20.0217 -20.0217 -18.8661 -18.8658 -16.2987 -16.2913 -15.5048 -15.4955 -13.6624 -13.6618 -12.7583 -12.7563 -12.7238 -12.7229 -6.6843 -6.6831 -4.7903 -4.7897 -4.2011 -4.1845 -3.9934 -3.9877 -3.8787 -3.8780 -2.9381 -2.9135 -2.5626 -2.5535 -1.1126 -1.1087 -0.3276 -0.3223 -0.2719 -0.2697 0.4885 0.4895 0.7063 0.7068 1.4928 1.4941 1.9515 1.9519 2.4067 2.4073 2.9826 2.9831 3.0878 3.0890 3.3983 3.3989 3.6705 3.6712 3.8387 3.8390 4.1572 4.1574 9.2662 9.2673 10.6700 10.6718 10.9737 10.9777 11.2707 11.2865 11.7324 11.7455 12.6707 12.6787 k = 0.4841 0.3162-0.0000 ( 5128 PWs) bands (ev): -20.0217 -20.0217 -18.8654 -18.8649 -16.3028 -16.2882 -15.5114 -15.4928 -13.6625 -13.6613 -12.7679 -12.7651 -12.7134 -12.7124 -6.6800 -6.6776 -4.7907 -4.7895 -4.2201 -4.1874 -3.9955 -3.9845 -3.8789 -3.8776 -2.9441 -2.8958 -2.5609 -2.5428 -1.1198 -1.1119 -0.3356 -0.3264 -0.2648 -0.2618 0.4846 0.4866 0.6933 0.6941 1.5028 1.5053 1.9553 1.9562 2.4056 2.4068 2.9820 2.9830 3.0890 3.0914 3.3932 3.3944 3.6741 3.6754 3.8405 3.8411 4.1555 4.1558 9.2678 9.2699 10.6713 10.6749 10.9717 10.9799 11.2561 11.2869 11.7271 11.7526 12.6680 12.6839 k = 0.4762 0.3299-0.0000 ( 5120 PWs) bands (ev): -20.0216 -20.0216 -18.8642 -18.8635 -16.3074 -16.2854 -15.5192 -15.4915 -13.6624 -13.6607 -12.7782 -12.7747 -12.7014 -12.7006 -6.6724 -6.6689 -4.7911 -4.7893 -4.2456 -4.1973 -3.9969 -3.9816 -3.8790 -3.8773 -2.9456 -2.8756 -2.5551 -2.5279 -1.1303 -1.1186 -0.3447 -0.3329 -0.2544 -0.2516 0.4783 0.4813 0.6730 0.6739 1.5189 1.5224 1.9618 1.9631 2.4040 2.4057 2.9812 2.9826 3.0913 3.0948 3.3853 3.3870 3.6800 3.6818 3.8436 3.8444 4.1527 4.1533 9.2708 9.2739 10.6741 10.6792 10.9696 10.9821 11.2377 11.2824 11.7229 11.7592 12.6660 12.6897 k = 0.4683 0.3437-0.0000 ( 5126 PWs) bands (ev): -20.0216 -20.0216 -18.8626 -18.8616 -16.3122 -16.2831 -15.5281 -15.4914 -13.6622 -13.6599 -12.7883 -12.7843 -12.6890 -12.6881 -6.6617 -6.6570 -4.7916 -4.7892 -4.2767 -4.2137 -3.9977 -3.9791 -3.8790 -3.8770 -2.9427 -2.8536 -2.5451 -2.5089 -1.1443 -1.1289 -0.3544 -0.3404 -0.2420 -0.2398 0.4697 0.4735 0.6470 0.6480 1.5399 1.5441 1.9708 1.9725 2.4020 2.4042 2.9801 2.9820 3.0945 3.0991 3.3754 3.3774 3.6876 3.6897 3.8479 3.8490 4.1489 4.1497 9.2751 9.2792 10.6781 10.6843 10.9675 10.9848 11.2164 11.2737 11.7199 11.7650 12.6648 12.6961 k = 0.4603 0.3574-0.0000 ( 5122 PWs) bands (ev): -20.0216 -20.0216 -18.8604 -18.8593 -16.3174 -16.2811 -15.5380 -15.4924 -13.6618 -13.6591 -12.7980 -12.7934 -12.6764 -12.6753 -6.6478 -6.6421 -4.7923 -4.7891 -4.3125 -4.2361 -3.9981 -3.9771 -3.8790 -3.8768 -2.9358 -2.8306 -2.5310 -2.4858 -1.1617 -1.1429 -0.3641 -0.3484 -0.2286 -0.2266 0.4585 0.4629 0.6168 0.6182 1.5646 1.5692 1.9821 1.9843 2.3997 2.4023 2.9789 2.9811 3.0984 3.1040 3.3639 3.3660 3.6966 3.6988 3.8532 3.8547 4.1441 4.1451 9.2809 9.2859 10.6831 10.6898 10.9654 10.9882 11.1929 11.2614 11.7178 11.7698 12.6641 12.7027 k = 0.4524 0.3712-0.0000 ( 5122 PWs) bands (ev): -20.0215 -20.0215 -18.8579 -18.8565 -16.3228 -16.2796 -15.5487 -15.4945 -13.6612 -13.6581 -12.8071 -12.8020 -12.6638 -12.6625 -6.6308 -6.6243 -4.7930 -4.7891 -4.3522 -4.2638 -3.9983 -3.9756 -3.8790 -3.8768 -2.9254 -2.8075 -2.5128 -2.4588 -1.1825 -1.1605 -0.3737 -0.3565 -0.2145 -0.2120 0.4443 0.4492 0.5844 0.5866 1.5916 1.5963 1.9957 1.9982 2.3971 2.4001 2.9774 2.9799 3.1028 3.1092 3.3514 3.3536 3.7062 3.7085 3.8596 3.8615 4.1385 4.1396 9.2881 9.2939 10.6888 10.6951 10.9632 10.9927 11.1679 11.2468 11.7167 11.7732 12.6638 12.7093 k = 0.4444 0.3849-0.0000 ( 5122 PWs) bands (ev): -20.0215 -20.0214 -18.8550 -18.8534 -16.3286 -16.2786 -15.5600 -15.4974 -13.6606 -13.6571 -12.8156 -12.8101 -12.6514 -12.6498 -6.6109 -6.6036 -4.7939 -4.7891 -4.3950 -4.2960 -3.9982 -3.9745 -3.8791 -3.8768 -2.9120 -2.7847 -2.4910 -2.4281 -1.2066 -1.1819 -0.3831 -0.3645 -0.1996 -0.1962 0.4269 0.4318 0.5517 0.5551 1.6198 1.6245 2.0113 2.0142 2.3944 2.3977 2.9757 2.9785 3.1073 3.1145 3.3385 3.3407 3.7164 3.7185 3.8669 3.8691 4.1320 4.1332 9.2965 9.3031 10.6947 10.6998 10.9606 10.9985 11.1420 11.2309 11.7162 11.7753 12.6639 12.7158 k = 0.4365 0.3986-0.0000 ( 5126 PWs) bands (ev): -20.0214 -20.0214 -18.8517 -18.8499 -16.3345 -16.2780 -15.5718 -15.5012 -13.6597 -13.6559 -12.8235 -12.8176 -12.6393 -12.6373 -6.5882 -6.5803 -4.7950 -4.7893 -4.4401 -4.3320 -3.9981 -3.9738 -3.8792 -3.8769 -2.8963 -2.7625 -2.4657 -2.3939 -1.2341 -1.2071 -0.3923 -0.3724 -0.1839 -0.1795 0.4057 0.4102 0.5207 0.5253 1.6484 1.6529 2.0287 2.0318 2.3916 2.3951 2.9737 2.9767 3.1118 3.1196 3.3256 3.3277 3.7266 3.7286 3.8748 3.8774 4.1247 4.1262 9.3063 9.3135 10.7006 10.7035 10.9573 11.0060 11.1158 11.2149 11.7165 11.7763 12.6644 12.7220 k = 0.4286 0.4124-0.0000 ( 5118 PWs) bands (ev): -20.0213 -20.0213 -18.8481 -18.8461 -16.3407 -16.2779 -15.5837 -15.5055 -13.6588 -13.6547 -12.8308 -12.8244 -12.6276 -12.6253 -6.5629 -6.5545 -4.7964 -4.7894 -4.4867 -4.3709 -3.9980 -3.9733 -3.8794 -3.8771 -2.8786 -2.7411 -2.4375 -2.3569 -1.2646 -1.2359 -0.4011 -0.3801 -0.1673 -0.1618 0.3807 0.3842 0.4925 0.4983 1.6766 1.6807 2.0475 2.0510 2.3887 2.3924 2.9714 2.9747 3.1160 3.1242 3.3130 3.3151 3.7367 3.7385 3.8831 3.8862 4.1169 4.1185 9.3172 9.3249 10.7050 10.7069 10.9527 11.0151 11.0901 11.2001 11.7178 11.7765 12.6654 12.7280 k = 0.4206 0.4261-0.0000 ( 5122 PWs) bands (ev): -20.0213 -20.0212 -18.8444 -18.8422 -16.3471 -16.2783 -15.5956 -15.5102 -13.6577 -13.6535 -12.8374 -12.8307 -12.6164 -12.6139 -6.5353 -6.5266 -4.7983 -4.7897 -4.5341 -4.4120 -3.9979 -3.9729 -3.8798 -3.8774 -2.8595 -2.7206 -2.4069 -2.3175 -1.2979 -1.2684 -0.4096 -0.3874 -0.1497 -0.1432 0.3524 0.3549 0.4675 0.4742 1.7039 1.7076 2.0677 2.0714 2.3858 2.3895 2.9689 2.9725 3.1195 3.1280 3.3011 3.3033 3.7465 3.7482 3.8918 3.8952 4.1087 4.1104 9.3292 9.3373 10.7059 10.7119 10.9463 11.0241 11.0665 11.1872 11.7201 11.7763 12.6671 12.7338 k = 0.4127 0.4399-0.0000 ( 5126 PWs) bands (ev): -20.0212 -20.0212 -18.8405 -18.8381 -16.3535 -16.2791 -15.6072 -15.5151 -13.6565 -13.6522 -12.8434 -12.8364 -12.6058 -12.6031 -6.5057 -6.4968 -4.8009 -4.7900 -4.5812 -4.4546 -3.9978 -3.9727 -3.8802 -3.8777 -2.8393 -2.7011 -2.3746 -2.2763 -1.3338 -1.3042 -0.4175 -0.3945 -0.1314 -0.1238 0.3218 0.3240 0.4451 0.4526 1.7299 1.7330 2.0888 2.0927 2.3827 2.3864 2.9660 2.9699 3.1223 3.1309 3.2901 3.2925 3.7559 3.7575 3.9004 3.9041 4.1001 4.1020 9.3420 9.3504 10.7053 10.7165 10.9376 11.0231 11.0549 11.1771 11.7240 11.7762 12.6697 12.7398 k = 0.4048 0.4536-0.0000 ( 5108 PWs) bands (ev): -20.0211 -20.0211 -18.8365 -18.8339 -16.3599 -16.2805 -15.6183 -15.5201 -13.6553 -13.6509 -12.8488 -12.8415 -12.5960 -12.5931 -6.4746 -6.4656 -4.8048 -4.7904 -4.6270 -4.4978 -3.9977 -3.9726 -3.8806 -3.8781 -2.8185 -2.6824 -2.3413 -2.2339 -1.3716 -1.3430 -0.4250 -0.4011 -0.1121 -0.1036 0.2900 0.2930 0.4246 0.4326 1.7541 1.7567 2.1107 2.1147 2.3793 2.3831 2.9630 2.9673 3.1243 3.1328 3.2801 3.2832 3.7648 3.7665 3.9087 3.9127 4.0915 4.0935 9.3556 9.3642 10.7039 10.7208 10.9264 11.0038 11.0631 11.1700 11.7296 11.7767 12.6736 12.7462 k = 0.3968 0.4674-0.0000 ( 5104 PWs) bands (ev): -20.0210 -20.0210 -18.8326 -18.8298 -16.3663 -16.2822 -15.6288 -15.5251 -13.6540 -13.6496 -12.8535 -12.8460 -12.5870 -12.5840 -6.4426 -6.4335 -4.8110 -4.7909 -4.6697 -4.5407 -3.9977 -3.9725 -3.8812 -3.8786 -2.7973 -2.6648 -2.3076 -2.1910 -1.4108 -1.3843 -0.4319 -0.4072 -0.0921 -0.0827 0.2587 0.2628 0.4053 0.4136 1.7764 1.7784 2.1329 2.1371 2.3755 2.3792 2.9599 2.9645 3.1254 3.1336 3.2713 3.2752 3.7731 3.7749 3.9166 3.9207 4.0831 4.0851 9.3696 9.3782 10.7021 10.7250 10.9127 10.9799 11.0762 11.1655 11.7372 11.7785 12.6794 12.7536 k = 0.3889 0.4811-0.0000 ( 5096 PWs) bands (ev): -20.0210 -20.0210 -18.8287 -18.8258 -16.3725 -16.2843 -15.6384 -15.5298 -13.6527 -13.6484 -12.8577 -12.8499 -12.5789 -12.5758 -6.4103 -6.4010 -4.8214 -4.7915 -4.7067 -4.5825 -3.9977 -3.9725 -3.8817 -3.8791 -2.7759 -2.6484 -2.2745 -2.1482 -1.4509 -1.4272 -0.4381 -0.4127 -0.0713 -0.0610 0.2287 0.2340 0.3870 0.3954 1.7966 1.7980 2.1552 2.1595 2.3710 2.3747 2.9567 2.9616 3.1257 3.1334 3.2637 3.2686 3.7808 3.7828 3.9238 3.9279 4.0751 4.0772 9.3838 9.3922 10.7007 10.7293 10.8970 10.9555 11.0895 11.1633 11.7468 11.7822 12.6875 12.7627 k = 0.3810 0.4949-0.0000 ( 5094 PWs) bands (ev): -20.0209 -20.0209 -18.8251 -18.8220 -16.3784 -16.2866 -15.6469 -15.5341 -13.6514 -13.6472 -12.8612 -12.8533 -12.5718 -12.5686 -6.3787 -6.3689 -4.8385 -4.7922 -4.7345 -4.6222 -3.9977 -3.9726 -3.8822 -3.8797 -2.7549 -2.6335 -2.2428 -2.1062 -1.4912 -1.4701 -0.4437 -0.4176 -0.0499 -0.0388 0.2008 0.2069 0.3695 0.3777 1.8144 1.8155 2.1773 2.1817 2.3657 2.3694 2.9537 2.9590 3.1253 3.1324 3.2573 3.2632 3.7878 3.7900 3.9300 3.9340 4.0677 4.0698 9.3977 9.4059 10.7003 10.7343 10.8797 10.9312 11.1012 11.1628 11.7579 11.7881 12.6984 12.7741 k = 0.3730 0.5086-0.0000 ( 5094 PWs) bands (ev): -20.0209 -20.0208 -18.8217 -18.8186 -16.3839 -16.2890 -15.6543 -15.5380 -13.6502 -13.6461 -12.8642 -12.8561 -12.5657 -12.5625 -6.3486 -6.3382 -4.8624 -4.7932 -4.7521 -4.6588 -3.9977 -3.9726 -3.8827 -3.8802 -2.7344 -2.6204 -2.2135 -2.0661 -1.5317 -1.5106 -0.4484 -0.4219 -0.0283 -0.0163 0.1754 0.1819 0.3529 0.3608 1.8299 1.8307 2.1988 2.2032 2.3592 2.3630 2.9510 2.9565 3.1245 3.1309 3.2520 3.2589 3.7939 3.7964 3.9352 3.9389 4.0614 4.0634 9.4109 9.4188 10.7014 10.7403 10.8615 10.9074 11.1103 11.1636 11.7697 11.7965 12.7126 12.7885 k = 0.3651 0.5224-0.0000 ( 5088 PWs) bands (ev): -20.0208 -20.0208 -18.8188 -18.8155 -16.3887 -16.2915 -15.6603 -15.5413 -13.6491 -13.6452 -12.8666 -12.8584 -12.5607 -12.5574 -6.3212 -6.3098 -4.8895 -4.7944 -4.7620 -4.6909 -3.9978 -3.9727 -3.8832 -3.8808 -2.7151 -2.6096 -2.1877 -2.0290 -1.5719 -1.5459 -0.4524 -0.4254 -0.0066 0.0063 0.1526 0.1591 0.3374 0.3448 1.8428 1.8436 2.2193 2.2237 2.3516 2.3556 2.9487 2.9545 3.1235 3.1290 3.2476 3.2555 3.7992 3.8019 3.9393 3.9425 4.0562 4.0581 9.4229 9.4306 10.7045 10.7477 10.8429 10.8841 11.1163 11.1652 11.7814 11.8071 12.7304 12.8067 k = 0.3571 0.5361-0.0000 ( 5082 PWs) bands (ev): -20.0208 -20.0207 -18.8163 -18.8130 -16.3928 -16.2937 -15.6651 -15.5439 -13.6481 -13.6444 -12.8685 -12.8602 -12.5568 -12.5535 -6.2978 -6.2852 -4.9150 -4.7960 -4.7676 -4.7172 -3.9979 -3.9728 -3.8835 -3.8812 -2.6975 -2.6015 -2.1666 -1.9966 -1.6095 -1.5744 -0.4555 -0.4281 0.0142 0.0283 0.1329 0.1388 0.3236 0.3302 1.8532 1.8540 2.2383 2.2427 2.3429 2.3473 2.9470 2.9530 3.1224 3.1271 3.2442 3.2529 3.8034 3.8062 3.9423 3.9449 4.0524 4.0541 9.4333 9.4406 10.7098 10.7570 10.8247 10.8616 11.1196 11.1670 11.7921 11.8186 12.7514 12.8292 k = 0.3492 0.5499-0.0000 ( 5082 PWs) bands (ev): -20.0207 -20.0207 -18.8144 -18.8110 -16.3959 -16.2956 -15.6685 -15.5458 -13.6474 -13.6438 -12.8698 -12.8614 -12.5540 -12.5507 -6.2795 -6.2658 -4.9357 -4.7981 -4.7707 -4.7366 -3.9979 -3.9729 -3.8838 -3.8816 -2.6828 -2.5962 -2.1510 -1.9712 -1.6407 -1.5951 -0.4577 -0.4301 0.0329 0.0489 0.1168 0.1210 0.3123 0.3177 1.8609 1.8618 2.2547 2.2592 2.3336 2.3386 2.9459 2.9520 3.1216 3.1254 3.2418 3.2510 3.8064 3.8094 3.9442 3.9461 4.0498 4.0514 9.4414 9.4484 10.7170 10.7683 10.8081 10.8400 11.1208 11.1686 11.8013 11.8290 12.7739 12.8559 k = 0.3413 0.5636-0.0000 ( 5082 PWs) bands (ev): -20.0207 -20.0207 -18.8133 -18.8098 -16.3979 -16.2969 -15.6705 -15.5470 -13.6469 -13.6434 -12.8705 -12.8621 -12.5524 -12.5490 -6.2677 -6.2532 -4.9493 -4.8001 -4.7723 -4.7482 -3.9980 -3.9730 -3.8840 -3.8819 -2.6724 -2.5936 -2.1417 -1.9554 -1.6612 -1.6075 -0.4590 -0.4312 0.0466 0.0662 0.1046 0.1079 0.3046 0.3087 1.8659 1.8665 2.2669 2.2715 2.3253 2.3313 2.9453 2.9515 3.1210 3.1241 3.2402 3.2498 3.8082 3.8113 3.9452 3.9466 4.0484 4.0499 9.4467 9.4535 10.7245 10.7813 10.7954 10.8199 11.1209 11.1694 11.8079 11.8364 12.7936 12.8842 k = 0.3333 0.5774-0.0000 ( 5082 PWs) bands (ev): -20.0207 -20.0207 -18.8128 -18.8094 -16.3986 -16.2974 -15.6712 -15.5474 -13.6468 -13.6432 -12.8708 -12.8624 -12.5518 -12.5485 -6.2636 -6.2487 -4.9541 -4.8010 -4.7728 -4.7520 -3.9980 -3.9730 -3.8840 -3.8820 -2.6684 -2.5930 -2.1387 -1.9504 -1.6681 -1.6115 -0.4595 -0.4316 0.0515 0.0744 0.0981 0.1040 0.3018 0.3051 1.8676 1.8682 2.2717 2.2763 2.3217 2.3282 2.9451 2.9514 3.1208 3.1235 3.2397 3.2494 3.8088 3.8119 3.9455 3.9467 4.0480 4.0495 9.4486 9.4553 10.7282 10.7890 10.7930 10.8067 11.1208 11.1696 11.8105 11.8391 12.8021 12.8999 k = 0.3333 0.5774-0.0000 ( 5082 PWs) bands (ev): -20.0207 -20.0207 -18.8128 -18.8094 -16.3986 -16.2974 -15.6712 -15.5474 -13.6468 -13.6432 -12.8708 -12.8624 -12.5518 -12.5485 -6.2636 -6.2487 -4.9541 -4.8010 -4.7728 -4.7520 -3.9980 -3.9730 -3.8840 -3.8820 -2.6684 -2.5930 -2.1387 -1.9504 -1.6681 -1.6115 -0.4595 -0.4316 0.0515 0.0744 0.0981 0.1040 0.3018 0.3051 1.8676 1.8682 2.2717 2.2763 2.3217 2.3282 2.9451 2.9514 3.1208 3.1235 3.2397 3.2494 3.8088 3.8119 3.9455 3.9467 4.0480 4.0495 9.4486 9.4553 10.7282 10.7890 10.7930 10.8067 11.1208 11.1696 11.8105 11.8391 12.8021 12.8999 k = 0.3254 0.5636-0.0000 ( 5084 PWs) bands (ev): -20.0207 -20.0207 -18.8133 -18.8098 -16.3979 -16.2968 -15.6705 -15.5470 -13.6469 -13.6434 -12.8705 -12.8621 -12.5524 -12.5490 -6.2680 -6.2534 -4.9491 -4.8001 -4.7723 -4.7480 -3.9980 -3.9730 -3.8840 -3.8819 -2.6729 -2.5934 -2.1414 -1.9540 -1.6620 -1.6079 -0.4590 -0.4313 0.0479 0.0682 0.1024 0.1056 0.3050 0.3094 1.8656 1.8665 2.2673 2.2721 2.3249 2.3310 2.9452 2.9515 3.1211 3.1242 3.2403 3.2498 3.8082 3.8113 3.9453 3.9467 4.0483 4.0498 9.4465 9.4534 10.7241 10.7788 10.7988 10.8194 11.1211 11.1696 11.8072 11.8363 12.7936 12.8855 k = 0.3175 0.5499-0.0000 ( 5088 PWs) bands (ev): -20.0207 -20.0207 -18.8147 -18.8112 -16.3954 -16.2950 -15.6686 -15.5458 -13.6475 -13.6438 -12.8698 -12.8614 -12.5540 -12.5506 -6.2815 -6.2680 -4.9343 -4.7979 -4.7704 -4.7351 -3.9979 -3.9728 -3.8838 -3.8816 -2.6866 -2.5954 -2.1486 -1.9614 -1.6465 -1.5978 -0.4578 -0.4302 0.0403 0.0578 0.1054 0.1080 0.3155 0.3225 1.8595 1.8611 2.2571 2.2627 2.3313 2.3368 2.9452 2.9514 3.1221 3.1261 3.2419 3.2512 3.8066 3.8096 3.9448 3.9465 4.0492 4.0507 9.4401 9.4471 10.7148 10.7631 10.8168 10.8391 11.1226 11.1700 11.7964 11.8279 12.7740 12.8631 k = 0.3095 0.5361-0.0000 ( 5084 PWs) bands (ev): -20.0208 -20.0207 -18.8170 -18.8137 -16.3912 -16.2918 -15.6655 -15.5439 -13.6485 -13.6446 -12.8686 -12.8603 -12.5565 -12.5532 -6.3044 -6.2924 -4.9105 -4.7956 -4.7664 -4.7120 -3.9977 -3.9725 -3.8835 -3.8809 -2.7084 -2.6003 -2.1583 -1.9679 -1.6255 -1.5830 -0.4557 -0.4284 0.0311 0.0470 0.1030 0.1091 0.3341 0.3436 1.8488 1.8514 2.2450 2.2518 2.3374 2.3423 2.9449 2.9509 3.1243 3.1294 3.2446 3.2534 3.8041 3.8070 3.9443 3.9461 4.0505 4.0519 9.4289 9.4363 10.7040 10.7487 10.8407 10.8608 11.1256 11.1718 11.7770 11.8144 12.7531 12.8477 k = 0.3016 0.5224-0.0000 ( 5088 PWs) bands (ev): -20.0208 -20.0208 -18.8204 -18.8171 -16.3851 -16.2869 -15.6613 -15.5411 -13.6500 -13.6458 -12.8670 -12.8587 -12.5601 -12.5567 -6.3365 -6.3262 -4.8806 -4.7937 -4.7581 -4.6789 -3.9974 -3.9720 -3.8830 -3.8801 -2.7366 -2.6101 -2.1682 -1.9713 -1.6019 -1.5649 -0.4530 -0.4262 0.0207 0.0364 0.0978 0.1076 0.3597 0.3712 1.8334 1.8370 2.2335 2.2415 2.3415 2.3461 2.9441 2.9497 3.1280 3.1342 3.2483 3.2566 3.8010 3.8037 3.9437 3.9456 4.0520 4.0534 9.4126 9.4205 10.6937 10.7359 10.8675 10.8842 11.1303 11.1763 11.7494 11.7962 12.7367 12.8417 k = 0.2937 0.5086-0.0000 ( 5090 PWs) bands (ev): -20.0209 -20.0209 -18.8249 -18.8217 -16.3769 -16.2802 -15.6561 -15.5377 -13.6519 -13.6474 -12.8649 -12.8567 -12.5645 -12.5612 -6.3773 -6.3685 -4.8503 -4.7921 -4.7408 -4.6364 -3.9970 -3.9712 -3.8824 -3.8789 -2.7697 -2.6255 -2.1762 -1.9708 -1.5777 -1.5449 -0.4498 -0.4234 0.0088 0.0254 0.0916 0.1051 0.3910 0.4042 1.8131 1.8178 2.2236 2.2329 2.3430 2.3472 2.9426 2.9477 3.1335 3.1405 3.2529 3.2606 3.7973 3.7998 3.9430 3.9448 4.0535 4.0550 9.3911 9.3995 10.6845 10.7249 10.8942 10.9099 11.1366 11.1851 11.7152 11.7737 12.7277 12.8453 k = 0.2857 0.4949-0.0000 ( 5090 PWs) bands (ev): -20.0210 -20.0210 -18.8305 -18.8274 -16.3666 -16.2716 -15.6499 -15.5336 -13.6544 -13.6494 -12.8624 -12.8544 -12.5697 -12.5664 -6.4261 -6.4184 -4.8273 -4.7907 -4.7077 -4.5858 -3.9964 -3.9701 -3.8816 -3.8775 -2.8059 -2.6469 -2.1809 -1.9668 -1.5540 -1.5240 -0.4461 -0.4204 -0.0046 0.0134 0.0863 0.1027 0.4269 0.4414 1.7882 1.7939 2.2160 2.2265 2.3414 2.3452 2.9404 2.9448 3.1407 3.1485 3.2583 3.2655 3.7933 3.7956 3.9421 3.9437 4.0550 4.0566 9.3644 9.3732 10.6765 10.7155 10.9180 10.9385 11.1447 11.1989 11.6769 11.7479 12.7268 12.8575 k = 0.2778 0.4811-0.0000 ( 5094 PWs) bands (ev): -20.0211 -20.0211 -18.8372 -18.8343 -16.3540 -16.2609 -15.6428 -15.5288 -13.6573 -13.6518 -12.8596 -12.8516 -12.5757 -12.5724 -6.4822 -6.4747 -4.8141 -4.7894 -4.6577 -4.5282 -3.9956 -3.9684 -3.8806 -3.8757 -2.8441 -2.6733 -2.1819 -1.9600 -1.5313 -1.5030 -0.4423 -0.4174 -0.0195 -0.0002 0.0829 0.1012 0.4666 0.4820 1.7590 1.7657 2.2111 2.2226 2.3365 2.3399 2.9376 2.9413 3.1497 3.1579 3.2643 3.2710 3.7890 3.7912 3.9409 3.9423 4.0563 4.0583 9.3323 9.3416 10.6697 10.7074 10.9390 10.9678 11.1552 11.2177 11.6372 11.7206 12.7341 12.8776 k = 0.2698 0.4674-0.0000 ( 5082 PWs) bands (ev): -20.0213 -20.0213 -18.8449 -18.8422 -16.3391 -16.2481 -15.6349 -15.5234 -13.6607 -13.6548 -12.8564 -12.8486 -12.5823 -12.5791 -6.5446 -6.5367 -4.8069 -4.7881 -4.5957 -4.4649 -3.9946 -3.9662 -3.8794 -3.8736 -2.8831 -2.7035 -2.1794 -1.9512 -1.5103 -1.4826 -0.4386 -0.4145 -0.0355 -0.0154 0.0819 0.1012 0.5094 0.5257 1.7265 1.7339 2.2087 2.2210 2.3281 2.3311 2.9344 2.9373 3.1603 3.1687 3.2706 3.2770 3.7846 3.7866 3.9393 3.9407 4.0574 4.0599 9.2951 9.3048 10.6637 10.7002 10.9583 10.9953 11.1692 11.2393 11.5994 11.6939 12.7489 12.9046 k = 0.2619 0.4536-0.0000 ( 5092 PWs) bands (ev): -20.0215 -20.0214 -18.8538 -18.8512 -16.3219 -16.2330 -15.6263 -15.5174 -13.6646 -13.6582 -12.8530 -12.8453 -12.5896 -12.5864 -6.6122 -6.6037 -4.8026 -4.7867 -4.5258 -4.3973 -3.9934 -3.9630 -3.8779 -3.8711 -2.9219 -2.7361 -2.1742 -1.9410 -1.4912 -1.4631 -0.4354 -0.4123 -0.0523 -0.0318 0.0832 0.1027 0.5551 0.5720 1.6915 1.6994 2.2086 2.2216 2.3163 2.3189 2.9310 2.9330 3.1721 3.1806 3.2772 3.2833 3.7801 3.7818 3.9374 3.9389 4.0582 4.0612 9.2528 9.2628 10.6581 10.6934 10.9769 11.0194 11.1866 11.2599 11.5680 11.6704 12.7705 12.9376 k = 0.2540 0.4399-0.0000 ( 5088 PWs) bands (ev): -20.0217 -20.0216 -18.8637 -18.8613 -16.3025 -16.2158 -15.6171 -15.5109 -13.6690 -13.6620 -12.8493 -12.8417 -12.5974 -12.5943 -6.6843 -6.6750 -4.7996 -4.7854 -4.4506 -4.3268 -3.9919 -3.9584 -3.8763 -3.8679 -2.9597 -2.7698 -2.1670 -1.9301 -1.4742 -1.4450 -0.4332 -0.4111 -0.0697 -0.0490 0.0867 0.1057 0.6033 0.6207 1.6550 1.6632 2.2104 2.2239 2.3013 2.3034 2.9276 2.9286 3.1850 3.1933 3.2838 3.2898 3.7753 3.7770 3.9351 3.9369 4.0588 4.0623 9.2057 9.2159 10.6523 10.6861 10.9953 11.0402 11.2058 11.2739 11.5494 11.6530 12.7983 12.9760 k = 0.2460 0.4261-0.0000 ( 5084 PWs) bands (ev): -20.0219 -20.0219 -18.8745 -18.8723 -16.2807 -16.1963 -15.6073 -15.5040 -13.6739 -13.6664 -12.8454 -12.8379 -12.6056 -12.6026 -6.7599 -6.7501 -4.7972 -4.7839 -4.3719 -4.2552 -3.9901 -3.9518 -3.8744 -3.8638 -2.9959 -2.8035 -2.1586 -1.9189 -1.4593 -1.4285 -0.4325 -0.4116 -0.0874 -0.0669 0.0925 0.1106 0.6539 0.6717 1.6180 1.6264 2.2137 2.2275 2.2833 2.2848 2.9243 2.9243 3.1986 3.2067 3.2903 3.2964 3.7704 3.7720 3.9327 3.9349 4.0590 4.0631 9.1541 9.1644 10.6457 10.6777 11.0144 11.0588 11.2239 11.2754 11.5495 11.6451 12.8313 13.0191 k = 0.2381 0.4124-0.0000 ( 5088 PWs) bands (ev): -20.0221 -20.0221 -18.8863 -18.8843 -16.2567 -16.1746 -15.5970 -15.4966 -13.6793 -13.6712 -12.8413 -12.8340 -12.6142 -12.6113 -6.8386 -6.8283 -4.7951 -4.7824 -4.2909 -4.1854 -3.9879 -3.9417 -3.8722 -3.8580 -3.0298 -2.8363 -2.1495 -1.9076 -1.4466 -1.4137 -0.4339 -0.4142 -0.1055 -0.0852 0.1006 0.1176 0.7066 0.7246 1.5815 1.5901 2.2172 2.2307 2.2637 2.2642 2.9202 2.9211 3.2127 3.2205 3.2967 3.3030 3.7652 3.7669 3.9301 3.9328 4.0589 4.0635 9.0982 9.1084 10.6377 10.6675 11.0344 11.0767 11.2367 11.2641 11.5696 11.6492 12.8691 13.0663 k = 0.2302 0.3986-0.0000 ( 5086 PWs) bands (ev): -20.0224 -20.0224 -18.8989 -18.8971 -16.2305 -16.1508 -15.5862 -15.4889 -13.6851 -13.6765 -12.8372 -12.8299 -12.6231 -12.6203 -6.9197 -6.9092 -4.7932 -4.7808 -4.2090 -4.1216 -3.9851 -3.9262 -3.8697 -3.8484 -3.0611 -2.8674 -2.1403 -1.8967 -1.4360 -1.4007 -0.4381 -0.4195 -0.1242 -0.1042 0.1115 0.1272 0.7613 0.7794 1.5465 1.5551 2.2165 2.2252 2.2459 2.2512 2.9162 2.9180 3.2271 3.2345 3.3027 3.3093 3.7596 3.7616 3.9276 3.9307 4.0583 4.0635 9.0383 9.0483 10.6277 10.6549 11.0556 11.0954 11.2357 11.2515 11.6052 11.6669 12.9108 13.1172 k = 0.2222 0.3849-0.0000 ( 5086 PWs) bands (ev): -20.0227 -20.0227 -18.9123 -18.9106 -16.2023 -16.1249 -15.5751 -15.4808 -13.6912 -13.6822 -12.8329 -12.8258 -12.6322 -12.6296 -7.0027 -6.9922 -4.7913 -4.7791 -4.1286 -4.0700 -3.9811 -3.9046 -3.8665 -3.8296 -3.0894 -2.8965 -2.1312 -1.8864 -1.4276 -1.3897 -0.4454 -0.4280 -0.1441 -0.1244 0.1256 0.1400 0.8177 0.8359 1.5139 1.5226 2.1996 2.2028 2.2423 2.2536 2.9123 2.9150 3.2415 3.2486 3.3083 3.3153 3.7538 3.7562 3.9252 3.9287 4.0573 4.0630 8.9747 8.9845 10.6154 10.6394 11.0774 11.1158 11.2155 11.2492 11.6510 11.6973 12.9559 13.1711 k = 0.2143 0.3712-0.0000 ( 5094 PWs) bands (ev): -20.0230 -20.0230 -18.9263 -18.9248 -16.1720 -16.0971 -15.5637 -15.4725 -13.6978 -13.6883 -12.8287 -12.8217 -12.6415 -12.6390 -7.0872 -7.0770 -4.7893 -4.7772 -4.0568 -4.0321 -3.9735 -3.8832 -3.8611 -3.7917 -3.1142 -2.9229 -2.1226 -1.8769 -1.4211 -1.3806 -0.4561 -0.4399 -0.1658 -0.1464 0.1435 0.1568 0.8757 0.8938 1.4845 1.4933 2.1720 2.1740 2.2478 2.2607 2.9084 2.9118 3.2557 3.2624 3.3134 3.3209 3.7476 3.7505 3.9230 3.9269 4.0559 4.0620 8.9077 8.9171 10.6003 10.6209 11.0976 11.1385 11.1956 11.2454 11.7032 11.7383 13.0038 13.2276 k = 0.2063 0.3574-0.0000 ( 5112 PWs) bands (ev): -20.0233 -20.0233 -18.9408 -18.9395 -16.1400 -16.0674 -15.5520 -15.4640 -13.7047 -13.6948 -12.8245 -12.8176 -12.6509 -12.6486 -7.1728 -7.1629 -4.7873 -4.7752 -4.0198 -3.9984 -3.9492 -3.8702 -3.8450 -3.7327 -3.1352 -2.9465 -2.1147 -1.8682 -1.4166 -1.3735 -0.4703 -0.4552 -0.1903 -0.1711 0.1657 0.1783 0.9349 0.9528 1.4590 1.4679 2.1407 2.1425 2.2557 2.2690 2.9042 2.9082 3.2697 3.2761 3.3180 3.3261 3.7412 3.7447 3.9211 3.9253 4.0540 4.0605 8.8375 8.8465 10.5823 10.5995 11.1100 11.1637 11.1862 11.2402 11.7596 11.7873 13.0540 13.2860 k = 0.1984 0.3437-0.0000 ( 5116 PWs) bands (ev): -20.0237 -20.0237 -18.9558 -18.9547 -16.1063 -16.0361 -15.5400 -15.4553 -13.7119 -13.7016 -12.8204 -12.8136 -12.6603 -12.6582 -7.2592 -7.2496 -4.7852 -4.7731 -4.0045 -3.9852 -3.9133 -3.8646 -3.8032 -3.6610 -3.1522 -2.9669 -2.1077 -1.8606 -1.4139 -1.3682 -0.4880 -0.4736 -0.2181 -0.1993 0.1928 0.2048 0.9950 1.0126 1.4380 1.4470 2.1073 2.1091 2.2644 2.2779 2.8995 2.9041 3.2833 3.2893 3.3220 3.3308 3.7345 3.7388 3.9194 3.9239 4.0516 4.0584 8.7645 8.7730 10.5614 10.5754 11.1074 11.1878 11.1962 11.2381 11.8190 11.8418 13.1058 13.3456 k = 0.1905 0.3299-0.0000 ( 5120 PWs) bands (ev): -20.0241 -20.0241 -18.9712 -18.9702 -16.0711 -16.0033 -15.5279 -15.4465 -13.7194 -13.7087 -12.8164 -12.8097 -12.6697 -12.6679 -7.3458 -7.3368 -4.7830 -4.7710 -3.9946 -3.9793 -3.8938 -3.8610 -3.7374 -3.5834 -3.1646 -2.9840 -2.1017 -1.8542 -1.4127 -1.3647 -0.5087 -0.4950 -0.2499 -0.2315 0.2248 0.2366 1.0555 1.0727 1.4221 1.4313 2.0726 2.0745 2.2736 2.2871 2.8940 2.8991 3.2964 3.3022 3.3255 3.3351 3.7276 3.7328 3.9181 3.9228 4.0488 4.0559 8.6890 8.6971 10.5379 10.5490 11.0957 11.1960 11.2262 11.2485 11.8805 11.9003 13.1586 13.4048 k = 0.1825 0.3162-0.0000 ( 5120 PWs) bands (ev): -20.0245 -20.0245 -18.9868 -18.9859 -16.0345 -15.9692 -15.5157 -15.4376 -13.7270 -13.7161 -12.8126 -12.8060 -12.6790 -12.6774 -7.4324 -7.4240 -4.7808 -4.7687 -3.9871 -3.9749 -3.8840 -3.8578 -3.6624 -3.5032 -3.1720 -2.9978 -2.0967 -1.8490 -1.4131 -1.3629 -0.5322 -0.5189 -0.2858 -0.2681 0.2620 0.2736 1.1157 1.1323 1.4119 1.4212 2.0371 2.0391 2.2829 2.2964 2.8874 2.8929 3.3089 3.3146 3.3284 3.3390 3.7208 3.7269 3.9172 3.9219 4.0455 4.0529 8.6114 8.6189 10.5121 10.5206 11.0823 11.1932 11.2612 11.2745 11.9435 11.9612 13.2114 13.4592 k = 0.1746 0.3024-0.0000 ( 5117 PWs) bands (ev): -20.0249 -20.0249 -19.0025 -19.0017 -15.9968 -15.9340 -15.5034 -15.4286 -13.7349 -13.7236 -12.8091 -12.8025 -12.6883 -12.6868 -7.5186 -7.5109 -4.7784 -4.7663 -3.9807 -3.9708 -3.8778 -3.8549 -3.5865 -3.4224 -3.1734 -3.0080 -2.0929 -1.8451 -1.4149 -1.3628 -0.5582 -0.5450 -0.3258 -0.3092 0.3041 0.3156 1.1746 1.1904 1.4081 1.4175 2.0013 2.0035 2.2922 2.3056 2.8793 2.8851 3.3206 3.3265 3.3310 3.3427 3.7140 3.7211 3.9165 3.9212 4.0418 4.0494 8.5319 8.5389 10.4844 10.4909 11.0698 11.1861 11.2994 11.3086 12.0075 12.0237 13.2625 13.4904 k = 0.1667 0.2887-0.0000 ( 5121 PWs) bands (ev): -20.0253 -20.0253 -19.0183 -19.0176 -15.9582 -15.8979 -15.4910 -15.4196 -13.7428 -13.7314 -12.8058 -12.7993 -12.6974 -12.6960 -7.6040 -7.5970 -4.7759 -4.7639 -3.9750 -3.9668 -3.8732 -3.8520 -3.5132 -3.3424 -3.1673 -3.0146 -2.0903 -1.8426 -1.4179 -1.3641 -0.5862 -0.5729 -0.3696 -0.3543 0.3510 0.3623 1.2303 1.2447 1.4120 1.4212 1.9659 1.9684 2.3014 2.3147 2.8695 2.8754 3.3307 3.3337 3.3379 3.3465 3.7073 3.7155 3.9161 3.9207 4.0378 4.0455 8.4508 8.4574 10.4553 10.4601 11.0588 11.1776 11.3400 11.3468 12.0721 12.0870 13.3085 13.4701 k = 0.1587 0.2749-0.0000 ( 5113 PWs) bands (ev): -20.0258 -20.0258 -19.0340 -19.0334 -15.9188 -15.8612 -15.4785 -15.4107 -13.7508 -13.7392 -12.8029 -12.7963 -12.7063 -12.7049 -7.6884 -7.6821 -4.7734 -4.7614 -3.9697 -3.9627 -3.8693 -3.8491 -3.4458 -3.2649 -3.1510 -3.0175 -2.0889 -1.8415 -1.4220 -1.3668 -0.6161 -0.6025 -0.4168 -0.4032 0.4023 0.4134 1.2797 1.2919 1.4262 1.4345 1.9318 1.9345 2.3103 2.3234 2.8576 2.8636 3.3345 3.3405 3.3487 3.3518 3.7008 3.7100 3.9160 3.9205 4.0334 4.0412 8.3687 8.3747 10.4252 10.4287 11.0493 11.1688 11.3828 11.3881 12.1367 12.1506 13.3398 13.4253 k = 0.1508 0.2612-0.0000 ( 5111 PWs) bands (ev): -20.0262 -20.0262 -19.0495 -19.0490 -15.8790 -15.8240 -15.4661 -15.4018 -13.7588 -13.7472 -12.8003 -12.7937 -12.7151 -12.7135 -7.7714 -7.7658 -4.7708 -4.7589 -3.9646 -3.9587 -3.8659 -3.8463 -3.3872 -3.1929 -3.1197 -3.0165 -2.0889 -1.8419 -1.4270 -1.3708 -0.6475 -0.6335 -0.4668 -0.4551 0.4576 0.4684 1.3192 1.3283 1.4526 1.4598 1.9000 1.9031 2.3188 2.3318 2.8433 2.8491 3.3366 3.3459 3.3585 3.3602 3.6945 3.7047 3.9162 3.9205 4.0287 4.0366 8.2857 8.2912 10.3945 10.3970 11.0411 11.1597 11.4275 11.4316 12.2010 12.2140 13.3398 13.3762 k = 0.1429 0.2474-0.0000 ( 5115 PWs) bands (ev): -20.0267 -20.0267 -19.0647 -19.0643 -15.8390 -15.7867 -15.4537 -15.3930 -13.7668 -13.7551 -12.7981 -12.7914 -12.7237 -12.7217 -7.8527 -7.8477 -4.7682 -4.7564 -3.9597 -3.9546 -3.8626 -3.8435 -3.3395 -3.1302 -3.0692 -3.0107 -2.0901 -1.8439 -1.4328 -1.3760 -0.6803 -0.6655 -0.5190 -0.5093 0.5166 0.5270 1.3477 1.3548 1.4883 1.4952 1.8725 1.8760 2.3269 2.3396 2.8263 2.8318 3.3387 3.3495 3.3679 3.3700 3.6884 3.6996 3.9166 3.9207 4.0238 4.0316 8.2023 8.2074 10.3636 10.3653 11.0339 11.1505 11.4739 11.4771 12.2646 12.2767 13.3116 13.3272 k = 0.1349 0.2337-0.0000 ( 5111 PWs) bands (ev): -20.0271 -20.0271 -19.0796 -19.0793 -15.7990 -15.7495 -15.4413 -15.3843 -13.7746 -13.7630 -12.7963 -12.7896 -12.7320 -12.7296 -7.9318 -7.9275 -4.7655 -4.7540 -3.9549 -3.9505 -3.8595 -3.8409 -3.3023 -3.0746 -3.0124 -2.9909 -2.0925 -1.8476 -1.4393 -1.3823 -0.7144 -0.6985 -0.5729 -0.5647 0.5789 0.5888 1.3690 1.3758 1.5262 1.5329 1.8523 1.8564 2.3344 2.3469 2.8064 2.8115 3.3411 3.3528 3.3774 3.3797 3.6823 3.6943 3.9173 3.9211 4.0186 4.0263 8.1190 8.1237 10.3327 10.3339 11.0276 11.1412 11.5218 11.5243 12.3270 12.3383 13.2725 13.2798 k = 0.1270 0.2199-0.0000 ( 5111 PWs) bands (ev): -20.0276 -20.0276 -19.0941 -19.0938 -15.7593 -15.7128 -15.4289 -15.3758 -13.7823 -13.7708 -12.7949 -12.7881 -12.7400 -12.7370 -8.0086 -8.0049 -4.7628 -4.7515 -3.9501 -3.9464 -3.8564 -3.8382 -3.2722 -3.0277 -2.9800 -2.9286 -2.0963 -1.8531 -1.4463 -1.3896 -0.7496 -0.7323 -0.6281 -0.6203 0.6440 0.6534 1.3874 1.3945 1.5575 1.5636 1.8442 1.8491 2.3413 2.3536 2.7834 2.7880 3.3441 3.3562 3.3867 3.3892 3.6761 3.6890 3.9183 3.9218 4.0133 4.0209 8.0361 8.0404 10.3022 10.3030 11.0220 11.1317 11.5709 11.5729 12.3879 12.3985 13.2310 13.2346 k = 0.1190 0.2062-0.0000 ( 5105 PWs) bands (ev): -20.0281 -20.0281 -19.1081 -19.1079 -15.7203 -15.6769 -15.4165 -15.3674 -13.7898 -13.7785 -12.7940 -12.7870 -12.7476 -12.7440 -8.0827 -8.0795 -4.7601 -4.7491 -3.9455 -3.9423 -3.8533 -3.8357 -3.2458 -3.0001 -2.9308 -2.8588 -2.1013 -1.8606 -1.4538 -1.3978 -0.7859 -0.7667 -0.6839 -0.6748 0.7116 0.7203 1.4050 1.4125 1.5748 1.5800 1.8531 1.8590 2.3475 2.3595 2.7572 2.7613 3.3477 3.3600 3.3958 3.3984 3.6698 3.6832 3.9196 3.9228 4.0079 4.0152 7.9542 7.9580 10.2722 10.2730 11.0170 11.1221 11.6209 11.6226 12.4469 12.4567 13.1900 13.1919 k = 0.1111 0.1925-0.0000 ( 5113 PWs) bands (ev): -20.0285 -20.0285 -19.1215 -19.1213 -15.6821 -15.6421 -15.4040 -15.3591 -13.7970 -13.7860 -12.7935 -12.7863 -12.7549 -12.7506 -8.1537 -8.1511 -4.7574 -4.7468 -3.9409 -3.9383 -3.8502 -3.8333 -3.2206 -2.9803 -2.8711 -2.7899 -2.1074 -1.8701 -1.4615 -1.4069 -0.8232 -0.8015 -0.7396 -0.7276 0.7811 0.7892 1.4226 1.4303 1.5759 1.5803 1.8800 1.8865 2.3530 2.3647 2.7278 2.7313 3.3521 3.3645 3.4047 3.4073 3.6630 3.6770 3.9212 3.9241 4.0025 4.0095 7.8736 7.8771 10.2430 10.2438 11.0124 11.1124 11.6718 11.6732 12.5036 12.5127 13.1506 13.1520 k = 0.1032 0.1787-0.0000 ( 5119 PWs) bands (ev): -20.0290 -20.0290 -19.1342 -19.1341 -15.6452 -15.6088 -15.3915 -15.3509 -13.8039 -13.7933 -12.7934 -12.7860 -12.7617 -12.7568 -8.2215 -8.2193 -4.7547 -4.7446 -3.9365 -3.9344 -3.8472 -3.8310 -3.1953 -2.9604 -2.8100 -2.7229 -2.1145 -1.8820 -1.4693 -1.4168 -0.8614 -0.8367 -0.7937 -0.7784 0.8522 0.8597 1.4404 1.4481 1.5649 1.5688 1.9201 1.9267 2.3578 2.3692 2.6953 2.6982 3.3573 3.3697 3.4134 3.4159 3.6558 3.6701 3.9231 3.9257 3.9970 4.0037 7.7949 7.7981 10.2149 10.2157 11.0083 11.1026 11.7231 11.7243 12.5575 12.5658 13.1133 13.1149 k = 0.0952 0.1650-0.0000 ( 5119 PWs) bands (ev): -20.0294 -20.0294 -19.1463 -19.1461 -15.6099 -15.5773 -15.3789 -15.3428 -13.8104 -13.8003 -12.7936 -12.7860 -12.7680 -12.7625 -8.2855 -8.2838 -4.7521 -4.7425 -3.9323 -3.9306 -3.8441 -3.8288 -3.1690 -2.9391 -2.7501 -2.6585 -2.1224 -1.8963 -1.4770 -1.4274 -0.9003 -0.8723 -0.8452 -0.8266 0.9244 0.9312 1.4582 1.4657 1.5471 1.5510 1.9675 1.9740 2.3619 2.3729 2.6599 2.6621 3.3634 3.3758 3.4218 3.4243 3.6479 3.6624 3.9253 3.9277 3.9916 3.9979 7.7187 7.7216 10.1880 10.1889 11.0046 11.0928 11.7746 11.7757 12.6082 12.6158 13.0786 13.0803 k = 0.0873 0.1512-0.0000 ( 5111 PWs) bands (ev): -20.0299 -20.0299 -19.1575 -19.1574 -15.5765 -15.5479 -15.3661 -15.3348 -13.8166 -13.8069 -12.7942 -12.7865 -12.7738 -12.7677 -8.3457 -8.3443 -4.7496 -4.7405 -3.9283 -3.9269 -3.8411 -3.8268 -3.1414 -2.9163 -2.6927 -2.5971 -2.1307 -1.9132 -1.4846 -1.4386 -0.9396 -0.9088 -0.8922 -0.8719 0.9973 1.0034 1.4751 1.4821 1.5269 1.5313 2.0180 2.0241 2.3653 2.3759 2.6216 2.6234 3.3704 3.3826 3.4299 3.4324 3.6392 3.6539 3.9277 3.9299 3.9863 3.9921 7.6454 7.6480 10.1626 10.1634 11.0013 11.0831 11.8260 11.8270 12.6552 12.6621 13.0467 13.0485 k = 0.0794 0.1375-0.0000 ( 5123 PWs) bands (ev): -20.0303 -20.0303 -19.1680 -19.1679 -15.5454 -15.5211 -15.3531 -15.3268 -13.8223 -13.8132 -12.7952 -12.7874 -12.7789 -12.7725 -8.4017 -8.4006 -4.7472 -4.7387 -3.9246 -3.9235 -3.8381 -3.8249 -3.1124 -2.8922 -2.6386 -2.5390 -2.1390 -1.9329 -1.4917 -1.4502 -0.9785 -0.9475 -0.9328 -0.9144 1.0702 1.0758 1.4871 1.4914 1.5104 1.5174 2.0690 2.0746 2.3680 2.3782 2.5810 2.5823 3.3782 3.3903 3.4378 3.4401 3.6298 3.6444 3.9303 3.9323 3.9812 3.9865 7.5757 7.5781 10.1387 10.1396 10.9984 11.0735 11.8767 11.8776 12.6982 12.7043 13.0175 13.0194 k = 0.0714 0.1237-0.0000 ( 5127 PWs) bands (ev): -20.0306 -20.0306 -19.1776 -19.1775 -15.5170 -15.4971 -15.3400 -15.3187 -13.8275 -13.8191 -12.7963 -12.7888 -12.7832 -12.7768 -8.4532 -8.4524 -4.7449 -4.7370 -3.9211 -3.9202 -3.8353 -3.8232 -3.0819 -2.8674 -2.5888 -2.4848 -2.1466 -1.9554 -1.4983 -1.4621 -1.0159 -0.9866 -0.9681 -0.9540 1.1428 1.1477 1.4779 1.4784 1.5164 1.5242 2.1186 2.1237 2.3700 2.3799 2.5382 2.5394 3.3868 3.3987 3.4452 3.4475 3.6196 3.6341 3.9331 3.9348 3.9764 3.9810 7.5102 7.5123 10.1166 10.1174 10.9960 11.0641 11.9263 11.9272 12.7367 12.7420 12.9912 12.9930 k = 0.0635 0.1100-0.0000 ( 5135 PWs) bands (ev): -20.0310 -20.0310 -19.1862 -19.1862 -15.4916 -15.4761 -15.3270 -15.3105 -13.8322 -13.8245 -12.7976 -12.7912 -12.7862 -12.7806 -8.5000 -8.4994 -4.7427 -4.7356 -3.9178 -3.9173 -3.8325 -3.8217 -3.0501 -2.8427 -2.5439 -2.4349 -2.1526 -1.9805 -1.5041 -1.4740 -1.0508 -1.0230 -1.0006 -0.9908 1.2142 1.2186 1.4589 1.4598 1.5311 1.5383 2.1655 2.1703 2.3712 2.3810 2.4938 2.4954 3.3961 3.4079 3.4523 3.4544 3.6086 3.6229 3.9358 3.9374 3.9718 3.9759 7.4495 7.4513 10.0964 10.0972 10.9940 11.0550 11.9743 11.9751 12.7705 12.7749 12.9678 12.9695 k = 0.0556 0.0962-0.0000 ( 5127 PWs) bands (ev): -20.0313 -20.0313 -19.1940 -19.1939 -15.4694 -15.4580 -15.3141 -15.3022 -13.8363 -13.8295 -12.7990 -12.7942 -12.7882 -12.7840 -8.5419 -8.5414 -4.7407 -4.7343 -3.9150 -3.9146 -3.8299 -3.8204 -3.0173 -2.8191 -2.5047 -2.3897 -2.1561 -2.0080 -1.5092 -1.4854 -1.0824 -1.0559 -1.0309 -1.0247 1.2837 1.2875 1.4408 1.4420 1.5458 1.5524 2.2086 2.2131 2.3714 2.3817 2.4486 2.4514 3.4062 3.4179 3.4588 3.4607 3.5969 3.6109 3.9385 3.9399 3.9677 3.9711 7.3941 7.3956 10.0783 10.0790 10.9926 11.0463 12.0200 12.0207 12.7992 12.8028 12.9472 12.9487 k = 0.0476 0.0825-0.0000 ( 5123 PWs) bands (ev): -20.0316 -20.0316 -19.2007 -19.2007 -15.4507 -15.4428 -15.3019 -15.2939 -13.8399 -13.8339 -12.8004 -12.7972 -12.7897 -12.7869 -8.5786 -8.5783 -4.7388 -4.7333 -3.9124 -3.9122 -3.8275 -3.8194 -2.9838 -2.7980 -2.4711 -2.3500 -2.1566 -2.0370 -1.5134 -1.4960 -1.1100 -1.0852 -1.0586 -1.0552 1.3496 1.3526 1.4254 1.4270 1.5595 1.5653 2.2462 2.2511 2.3682 2.3818 2.4044 2.4111 3.4169 3.4284 3.4648 3.4665 3.5846 3.5983 3.9410 3.9423 3.9641 3.9668 7.3446 7.3460 10.0623 10.0629 10.9919 11.0381 12.0625 12.0631 12.8228 12.8256 12.9295 12.9309 k = 0.0397 0.0687-0.0000 ( 5135 PWs) bands (ev): -20.0318 -20.0318 -19.2065 -19.2065 -15.4355 -15.4304 -15.2907 -15.2859 -13.8429 -13.8378 -12.8017 -12.7998 -12.7911 -12.7894 -8.6101 -8.6098 -4.7371 -4.7325 -3.9102 -3.9101 -3.8254 -3.8185 -2.9500 -2.7810 -2.4424 -2.3169 -2.1540 -2.0665 -1.5169 -1.5053 -1.1335 -1.1112 -1.0832 -1.0817 1.3973 1.3977 1.4266 1.4303 1.5718 1.5767 2.2748 2.2817 2.3503 2.3637 2.3826 2.3887 3.4281 3.4395 3.4700 3.4715 3.5719 3.5851 3.9431 3.9443 3.9611 3.9631 7.3017 7.3028 10.0485 10.0491 10.9917 11.0304 12.1010 12.1016 12.8412 12.8433 12.9148 12.9160 k = 0.0317 0.0550-0.0000 ( 5139 PWs) bands (ev): -20.0320 -20.0320 -19.2113 -19.2113 -15.4236 -15.4205 -15.2809 -15.2784 -13.8453 -13.8411 -12.8030 -12.8019 -12.7923 -12.7914 -8.6360 -8.6358 -4.7356 -4.7319 -3.9084 -3.9084 -3.8234 -3.8179 -2.9164 -2.7699 -2.4171 -2.2920 -2.1492 -2.0943 -1.5196 -1.5129 -1.1528 -1.1338 -1.1042 -1.1037 1.3934 1.3938 1.4766 1.4797 1.5822 1.5864 2.2811 2.2899 2.3325 2.3425 2.3828 2.3855 3.4398 3.4509 3.4745 3.4757 3.5590 3.5717 3.9446 3.9458 3.9590 3.9602 7.2658 7.2667 10.0372 10.0376 10.9922 11.0233 12.1346 12.1350 12.8547 12.8561 12.9033 12.9042 k = 0.0238 0.0412-0.0000 ( 5155 PWs) bands (ev): -20.0322 -20.0322 -19.2150 -19.2150 -15.4148 -15.4129 -15.2730 -15.2719 -13.8470 -13.8439 -12.8040 -12.8036 -12.7933 -12.7929 -8.6563 -8.6562 -4.7344 -4.7315 -3.9070 -3.9070 -3.8217 -3.8176 -2.8838 -2.7661 -2.3928 -2.2782 -2.1437 -2.1170 -1.5217 -1.5186 -1.1677 -1.1530 -1.1209 -1.1207 1.3848 1.3852 1.5262 1.5287 1.5908 1.5940 2.2577 2.2624 2.3436 2.3480 2.3848 2.3865 3.4517 3.4624 3.4781 3.4790 3.5464 3.5582 3.9455 3.9466 3.9577 3.9583 7.2374 7.2381 10.0283 10.0286 10.9935 11.0168 12.1621 12.1624 12.8633 12.8641 12.8954 12.8960 k = 0.0159 0.0275-0.0000 ( 5153 PWs) bands (ev): -20.0323 -20.0323 -19.2177 -19.2177 -15.4088 -15.4076 -15.2672 -15.2668 -13.8481 -13.8460 -12.8049 -12.8047 -12.7941 -12.7940 -8.6709 -8.6708 -4.7333 -4.7314 -3.9060 -3.9060 -3.8203 -3.8176 -2.8529 -2.7703 -2.3679 -2.2788 -2.1393 -2.1309 -1.5234 -1.5223 -1.1781 -1.1681 -1.1329 -1.1328 1.3783 1.3785 1.5661 1.5678 1.5974 1.5995 2.2303 2.2329 2.3554 2.3570 2.3886 2.3893 3.4634 3.4730 3.4807 3.4814 3.5349 3.5453 3.9458 3.9467 3.9571 3.9573 7.2169 7.2173 10.0219 10.0221 10.9955 11.0110 12.1827 12.1829 12.8673 12.8676 12.8914 12.8916 k = 0.0079 0.0137-0.0000 ( 5137 PWs) bands (ev): -20.0324 -20.0324 -19.2193 -19.2193 -15.4052 -15.4046 -15.2636 -15.2636 -13.8485 -13.8474 -12.8054 -12.8053 -12.7946 -12.7946 -8.6797 -8.6796 -4.7325 -4.7315 -3.9054 -3.9054 -3.8192 -3.8178 -2.8248 -2.7821 -2.3419 -2.2931 -2.1369 -2.1359 -1.5246 -1.5242 -1.1835 -1.1785 -1.1401 -1.1400 1.3743 1.3744 1.5916 1.5923 1.6026 1.6035 2.2109 2.2121 2.3615 2.3619 2.3926 2.3927 3.4740 3.4808 3.4824 3.4828 3.5268 3.5338 3.9460 3.9465 3.9569 3.9569 7.2045 7.2047 10.0181 10.0182 10.9982 11.0060 12.1954 12.1956 12.8682 12.8682 12.8901 12.8903 k = 0.0000 0.0000 0.0000 ( 5133 PWs) bands (ev): -20.0324 -20.0324 -19.2198 -19.2198 -15.4038 -15.4038 -15.2625 -15.2625 -13.8483 -13.8483 -12.8056 -12.8056 -12.7948 -12.7948 -8.6826 -8.6826 -4.7319 -4.7319 -3.9052 -3.9052 -3.8184 -3.8184 -2.8008 -2.8008 -2.3159 -2.3159 -2.1365 -2.1365 -1.5249 -1.5249 -1.1837 -1.1837 -1.1424 -1.1424 1.3730 1.3730 1.5989 1.5989 1.6065 1.6065 2.2043 2.2043 2.3632 2.3632 2.3942 2.3942 3.4810 3.4810 3.4834 3.4834 3.5263 3.5263 3.9462 3.9462 3.9569 3.9569 7.2004 7.2004 10.0168 10.0168 11.0017 11.0017 12.1998 12.1998 12.8681 12.8681 12.8900 12.8900 k = 0.0000 0.0000 0.0000 ( 5133 PWs) bands (ev): -20.0324 -20.0324 -19.2198 -19.2198 -15.4038 -15.4038 -15.2625 -15.2625 -13.8483 -13.8483 -12.8056 -12.8056 -12.7948 -12.7948 -8.6826 -8.6826 -4.7319 -4.7319 -3.9052 -3.9052 -3.8184 -3.8184 -2.8008 -2.8008 -2.3159 -2.3159 -2.1365 -2.1365 -1.5249 -1.5249 -1.1837 -1.1837 -1.1424 -1.1424 1.3730 1.3730 1.5989 1.5989 1.6065 1.6065 2.2043 2.2043 2.3632 2.3632 2.3942 2.3942 3.4810 3.4810 3.4834 3.4834 3.5263 3.5263 3.9462 3.9462 3.9569 3.9569 7.2004 7.2004 10.0168 10.0168 11.0017 11.0017 12.1998 12.1998 12.8681 12.8681 12.8900 12.8900 k = 0.0000 0.0000 0.0158 ( 5145 PWs) bands (ev): -20.0324 -20.0324 -19.2198 -19.2198 -15.4038 -15.4038 -15.2625 -15.2625 -13.8483 -13.8483 -12.8056 -12.8055 -12.7948 -12.7947 -8.6826 -8.6826 -4.7326 -4.7315 -3.9062 -3.9048 -3.8191 -3.8186 -2.8015 -2.8004 -2.3160 -2.3155 -2.1365 -2.1361 -1.5236 -1.5235 -1.1852 -1.1817 -1.1442 -1.1401 1.3732 1.3732 1.5978 1.6000 1.6056 1.6076 2.2040 2.2041 2.3631 2.3633 2.3940 2.3943 3.4808 3.4812 3.4832 3.4836 3.5248 3.5249 3.9447 3.9466 3.9554 3.9573 7.2018 7.2018 10.0156 10.0156 11.0019 11.0021 12.2000 12.2001 12.8650 12.8699 12.8860 12.8922 k = 0.0000 0.0000 0.0315 ( 5145 PWs) bands (ev): -20.0323 -20.0323 -19.2200 -19.2200 -15.4038 -15.4038 -15.2625 -15.2624 -13.8481 -13.8481 -12.8056 -12.8055 -12.7948 -12.7947 -8.6827 -8.6827 -4.7338 -4.7315 -3.9075 -3.9048 -3.8207 -3.8198 -2.8025 -2.8004 -2.3160 -2.3150 -2.1363 -2.1354 -1.5195 -1.5193 -1.1862 -1.1793 -1.1454 -1.1371 1.3738 1.3738 1.5970 1.6013 1.6048 1.6088 2.2032 2.2033 2.3629 2.3634 2.3938 2.3944 3.4805 3.4814 3.4832 3.4840 3.5205 3.5206 3.9423 3.9461 3.9529 3.9567 7.2058 7.2059 10.0119 10.0120 11.0027 11.0030 12.2009 12.2010 12.8607 12.8702 12.8801 12.8924 k = 0.0000 0.0000 0.0473 ( 5151 PWs) bands (ev): -20.0321 -20.0321 -19.2202 -19.2202 -15.4038 -15.4038 -15.2625 -15.2624 -13.8479 -13.8479 -12.8056 -12.8054 -12.7948 -12.7947 -8.6828 -8.6828 -4.7353 -4.7320 -3.9093 -3.9052 -3.8234 -3.8220 -2.8038 -2.8007 -2.3158 -2.3143 -2.1358 -2.1345 -1.5127 -1.5125 -1.1867 -1.1764 -1.1460 -1.1337 1.3748 1.3749 1.5963 1.6027 1.6041 1.6101 2.2019 2.2020 2.3627 2.3634 2.3936 2.3945 3.4802 3.4815 3.4832 3.4845 3.5136 3.5138 3.9390 3.9446 3.9495 3.9551 7.2126 7.2126 10.0059 10.0061 11.0040 11.0044 12.2023 12.2025 12.8551 12.8691 12.8727 12.8906 k = 0.0000 0.0000 0.0630 ( 5145 PWs) bands (ev): -20.0319 -20.0319 -19.2205 -19.2205 -15.4038 -15.4038 -15.2625 -15.2624 -13.8476 -13.8476 -12.8056 -12.8054 -12.7948 -12.7946 -8.6830 -8.6830 -4.7372 -4.7328 -3.9115 -3.9061 -3.8268 -3.8251 -2.8053 -2.8013 -2.3154 -2.3135 -2.1349 -2.1332 -1.5034 -1.5031 -1.1867 -1.1732 -1.1459 -1.1298 1.3763 1.3763 1.5957 1.6036 1.6041 1.6115 2.2002 2.2003 2.3624 2.3633 2.3934 2.3945 3.4793 3.4811 3.4834 3.4850 3.5046 3.5048 3.9348 3.9422 3.9452 3.9525 7.2219 7.2220 9.9977 9.9979 11.0058 11.0064 12.2043 12.2045 12.8485 12.8638 12.8667 12.8868 k = 0.0000 0.0000 0.0788 ( 5127 PWs) bands (ev): -20.0316 -20.0316 -19.2209 -19.2209 -15.4038 -15.4038 -15.2625 -15.2624 -13.8473 -13.8472 -12.8056 -12.8053 -12.7948 -12.7945 -8.6833 -8.6832 -4.7393 -4.7340 -3.9140 -3.9075 -3.8311 -3.8290 -2.8071 -2.8022 -2.3148 -2.3125 -2.1338 -2.1317 -1.4917 -1.4913 -1.1862 -1.1697 -1.1452 -1.1255 1.3781 1.3782 1.5954 1.6034 1.6057 1.6130 2.1979 2.1980 2.3621 2.3633 2.3931 2.3945 3.4768 3.4786 3.4837 3.4857 3.4951 3.4951 3.9298 3.9389 3.9400 3.9490 7.2336 7.2337 9.9874 9.9876 11.0080 11.0087 12.2068 12.2070 12.8409 12.8537 12.8628 12.8811 k = 0.0000 0.0000 0.0945 ( 5121 PWs) bands (ev): -20.0313 -20.0313 -19.2214 -19.2214 -15.4038 -15.4037 -15.2625 -15.2624 -13.8468 -13.8468 -12.8056 -12.8052 -12.7948 -12.7945 -8.6835 -8.6835 -4.7417 -4.7356 -3.9168 -3.9093 -3.8361 -3.8337 -2.8090 -2.8034 -2.3140 -2.3115 -2.1325 -2.1300 -1.4778 -1.4774 -1.1851 -1.1658 -1.1438 -1.1209 1.3802 1.3803 1.5953 1.6033 1.6073 1.6145 2.1952 2.1953 2.3618 2.3631 2.3928 2.3944 3.4687 3.4698 3.4840 3.4865 3.4885 3.4898 3.9241 3.9340 3.9347 3.9445 7.2475 7.2476 9.9751 9.9754 11.0106 11.0114 12.2098 12.2100 12.8325 12.8426 12.8577 12.8737 k = 0.0000 0.0000 0.1103 ( 5115 PWs) bands (ev): -20.0309 -20.0309 -19.2219 -19.2219 -15.4039 -15.4037 -15.2625 -15.2624 -13.8463 -13.8463 -12.8056 -12.8052 -12.7948 -12.7944 -8.6838 -8.6838 -4.7444 -4.7375 -3.9199 -3.9114 -3.8417 -3.8391 -2.8110 -2.8049 -2.3131 -2.3103 -2.1309 -2.1281 -1.4620 -1.4615 -1.1836 -1.1618 -1.1418 -1.1160 1.3828 1.3829 1.5953 1.6033 1.6089 1.6160 2.1920 2.1922 2.3615 2.3630 2.3925 2.3944 3.4543 3.4547 3.4844 3.4864 3.4873 3.4886 3.9178 3.9274 3.9298 3.9393 7.2634 7.2635 9.9611 9.9614 11.0134 11.0143 12.2132 12.2135 12.8235 12.8307 12.8513 12.8647 k = 0.0000 0.0000 0.1260 ( 5114 PWs) bands (ev): -20.0305 -20.0305 -19.2225 -19.2225 -15.4039 -15.4037 -15.2625 -15.2624 -13.8458 -13.8457 -12.8056 -12.8051 -12.7948 -12.7943 -8.6842 -8.6842 -4.7472 -4.7397 -3.9232 -3.9140 -3.8479 -3.8450 -2.8131 -2.8066 -2.3120 -2.3091 -2.1292 -2.1260 -1.4445 -1.4439 -1.1815 -1.1575 -1.1393 -1.1109 1.3856 1.3857 1.5955 1.6036 1.6105 1.6175 2.1885 2.1887 2.3611 2.3628 2.3922 2.3942 3.4364 3.4366 3.4849 3.4859 3.4881 3.4888 3.9109 3.9202 3.9242 3.9334 7.2810 7.2812 9.9456 9.9459 11.0164 11.0174 12.2170 12.2173 12.8139 12.8182 12.8438 12.8542 k = 0.0000 0.0000 0.1418 ( 5114 PWs) bands (ev): -20.0301 -20.0301 -19.2232 -19.2232 -15.4039 -15.4037 -15.2625 -15.2624 -13.8451 -13.8451 -12.8055 -12.8050 -12.7948 -12.7943 -8.6846 -8.6845 -4.7502 -4.7422 -3.9267 -3.9168 -3.8545 -3.8515 -2.8152 -2.8084 -2.3107 -2.3078 -2.1273 -2.1239 -1.4257 -1.4249 -1.1790 -1.1532 -1.1361 -1.1057 1.3886 1.3888 1.5960 1.6041 1.6120 1.6190 2.1846 2.1848 2.3608 2.3625 2.3919 2.3941 3.4165 3.4165 3.4854 3.4860 3.4890 3.4893 3.9036 3.9126 3.9180 3.9269 7.3001 7.3003 9.9288 9.9291 11.0196 11.0206 12.2211 12.2214 12.8040 12.8052 12.8355 12.8426 k = 0.0000 0.0000 0.1575 ( 5132 PWs) bands (ev): -20.0296 -20.0296 -19.2239 -19.2239 -15.4039 -15.4037 -15.2625 -15.2624 -13.8445 -13.8445 -12.8055 -12.8050 -12.7947 -12.7942 -8.6850 -8.6849 -4.7533 -4.7449 -3.9302 -3.9199 -3.8614 -3.8583 -2.8173 -2.8103 -2.3094 -2.3064 -2.1253 -2.1216 -1.4057 -1.4048 -1.1760 -1.1487 -1.1325 -1.1004 1.3919 1.3921 1.5966 1.6047 1.6135 1.6205 2.1804 2.1806 2.3604 2.3622 2.3916 2.3939 3.3952 3.3952 3.4858 3.4862 3.4898 3.4900 3.8961 3.9047 3.9113 3.9198 7.3204 7.3206 9.9110 9.9113 11.0227 11.0238 12.2254 12.2258 12.7922 12.7939 12.8263 12.8301 k = 0.0000 0.0000 0.1733 ( 5114 PWs) bands (ev): -20.0291 -20.0291 -19.2246 -19.2246 -15.4039 -15.4037 -15.2625 -15.2624 -13.8438 -13.8438 -12.8054 -12.8049 -12.7947 -12.7942 -8.6854 -8.6853 -4.7565 -4.7478 -3.9338 -3.9231 -3.8685 -3.8653 -2.8194 -2.8123 -2.3079 -2.3051 -2.1232 -2.1194 -1.3850 -1.3840 -1.1727 -1.1443 -1.1284 -1.0952 1.3954 1.3955 1.5974 1.6055 1.6150 1.6219 2.1760 2.1762 2.3601 2.3620 2.3914 2.3937 3.3729 3.3729 3.4863 3.4867 3.4906 3.4908 3.8884 3.8966 3.9042 3.9124 7.3416 7.3417 9.8924 9.8927 11.0259 11.0270 12.2300 12.2304 12.7791 12.7837 12.8165 12.8170 k = 0.0000 0.0000 0.1890 ( 5126 PWs) bands (ev): -20.0286 -20.0286 -19.2254 -19.2254 -15.4039 -15.4037 -15.2625 -15.2624 -13.8431 -13.8431 -12.8054 -12.8048 -12.7946 -12.7941 -8.6858 -8.6858 -4.7596 -4.7509 -3.9373 -3.9266 -3.8756 -3.8725 -2.8214 -2.8144 -2.3064 -2.3037 -2.1211 -2.1171 -1.3639 -1.3628 -1.1690 -1.1400 -1.1239 -1.0901 1.3990 1.3991 1.5983 1.6064 1.6163 1.6232 2.1714 2.1716 2.3597 2.3616 2.3911 2.3935 3.3501 3.3502 3.4868 3.4871 3.4914 3.4915 3.8806 3.8885 3.8969 3.9046 7.3633 7.3634 9.8733 9.8737 11.0289 11.0300 12.2347 12.2350 12.7662 12.7736 12.8034 12.8062 k = 0.0000 0.0000 0.2048 ( 5138 PWs) bands (ev): -20.0281 -20.0281 -19.2261 -19.2261 -15.4039 -15.4037 -15.2625 -15.2624 -13.8425 -13.8424 -12.8053 -12.8048 -12.7946 -12.7941 -8.6862 -8.6862 -4.7627 -4.7540 -3.9408 -3.9301 -3.8827 -3.8797 -2.8232 -2.8164 -2.3049 -2.3023 -2.1189 -2.1149 -1.3427 -1.3414 -1.1649 -1.1358 -1.1191 -1.0853 1.4027 1.4028 1.5995 1.6075 1.6175 1.6244 2.1666 2.1669 2.3593 2.3613 2.3908 2.3932 3.3271 3.3272 3.4873 3.4876 3.4921 3.4922 3.8730 3.8804 3.8894 3.8968 7.3852 7.3854 9.8541 9.8544 11.0318 11.0329 12.2394 12.2397 12.7537 12.7638 12.7897 12.7957 k = 0.0000 0.0000 0.2205 ( 5138 PWs) bands (ev): -20.0276 -20.0276 -19.2268 -19.2268 -15.4039 -15.4037 -15.2625 -15.2624 -13.8418 -13.8418 -12.8053 -12.8047 -12.7945 -12.7940 -8.6866 -8.6866 -4.7657 -4.7571 -3.9442 -3.9337 -3.8897 -3.8868 -2.8250 -2.8185 -2.3034 -2.3010 -2.1168 -2.1128 -1.3218 -1.3204 -1.1606 -1.1317 -1.1140 -1.0806 1.4064 1.4065 1.6007 1.6088 1.6186 1.6254 2.1618 2.1621 2.3590 2.3609 2.3906 2.3929 3.3044 3.3045 3.4878 3.4881 3.4927 3.4929 3.8655 3.8726 3.8819 3.8889 7.4070 7.4072 9.8349 9.8353 11.0345 11.0356 12.2441 12.2444 12.7417 12.7544 12.7760 12.7851 k = 0.0000 0.0000 0.2363 ( 5144 PWs) bands (ev): -20.0271 -20.0271 -19.2276 -19.2276 -15.4039 -15.4037 -15.2625 -15.2624 -13.8411 -13.8411 -12.8052 -12.8047 -12.7944 -12.7940 -8.6871 -8.6870 -4.7685 -4.7603 -3.9474 -3.9372 -3.8964 -3.8937 -2.8266 -2.8204 -2.3019 -2.2997 -2.1147 -2.1108 -1.3014 -1.2999 -1.1561 -1.1279 -1.1087 -1.0764 1.4100 1.4102 1.6021 1.6101 1.6195 1.6263 2.1570 2.1573 2.3587 2.3606 2.3904 2.3927 3.2823 3.2824 3.4882 3.4886 3.4932 3.4934 3.8585 3.8652 3.8745 3.8811 7.4284 7.4285 9.8162 9.8165 11.0370 11.0380 12.2487 12.2490 12.7305 12.7454 12.7626 12.7746 k = 0.0000 0.0000 0.2520 ( 5120 PWs) bands (ev): -20.0266 -20.0266 -19.2283 -19.2283 -15.4039 -15.4037 -15.2625 -15.2624 -13.8405 -13.8404 -12.8051 -12.8046 -12.7944 -12.7939 -8.6874 -8.6874 -4.7712 -4.7634 -3.9503 -3.9407 -3.9028 -3.9003 -2.8280 -2.8223 -2.3004 -2.2985 -2.1126 -2.1089 -1.2820 -1.2804 -1.1514 -1.1244 -1.1034 -1.0726 1.4136 1.4137 1.6037 1.6116 1.6203 1.6270 2.1524 2.1526 2.3585 2.3602 2.3902 2.3924 3.2611 3.2612 3.4886 3.4890 3.4935 3.4938 3.8519 3.8582 3.8674 3.8736 7.4490 7.4491 9.7981 9.7984 11.0393 11.0403 12.2531 12.2534 12.7200 12.7371 12.7497 12.7644 k = 0.0000 0.0000 0.2678 ( 5120 PWs) bands (ev): -20.0261 -20.0261 -19.2289 -19.2289 -15.4039 -15.4037 -15.2625 -15.2624 -13.8398 -13.8398 -12.8051 -12.8046 -12.7943 -12.7939 -8.6878 -8.6878 -4.7736 -4.7663 -3.9530 -3.9441 -3.9088 -3.9064 -2.8293 -2.8241 -2.2991 -2.2974 -2.1107 -2.1072 -1.2637 -1.2621 -1.1466 -1.1212 -1.0980 -1.0692 1.4170 1.4171 1.6052 1.6131 1.6208 1.6276 2.1479 2.1481 2.3582 2.3599 2.3901 2.3921 3.2412 3.2413 3.4890 3.4895 3.4938 3.4941 3.8459 3.8519 3.8605 3.8663 7.4684 7.4686 9.7810 9.7813 11.0414 11.0423 12.2573 12.2575 12.7105 12.7296 12.7375 12.7546 k = 0.0000 0.0000 0.2836 ( 5126 PWs) bands (ev): -20.0257 -20.0257 -19.2295 -19.2295 -15.4039 -15.4037 -15.2625 -15.2624 -13.8393 -13.8393 -12.8050 -12.8046 -12.7943 -12.7939 -8.6882 -8.6882 -4.7757 -4.7691 -3.9554 -3.9473 -3.9142 -3.9121 -2.8304 -2.8257 -2.2978 -2.2963 -2.1089 -2.1057 -1.2470 -1.2455 -1.1417 -1.1184 -1.0928 -1.0664 1.4201 1.4203 1.6069 1.6147 1.6211 1.6280 2.1437 2.1438 2.3580 2.3595 2.3900 2.3918 3.2228 3.2229 3.4894 3.4899 3.4939 3.4943 3.8406 3.8462 3.8540 3.8595 7.4865 7.4866 9.7651 9.7653 11.0432 11.0440 12.2611 12.2614 12.7021 12.7229 12.7261 12.7453 k = 0.0000 0.0000 0.2993 ( 5114 PWs) bands (ev): -20.0253 -20.0253 -19.2301 -19.2301 -15.4038 -15.4037 -15.2625 -15.2624 -13.8388 -13.8388 -12.8049 -12.8045 -12.7942 -12.7938 -8.6885 -8.6885 -4.7776 -4.7718 -3.9574 -3.9502 -3.9190 -3.9172 -2.8313 -2.8272 -2.2967 -2.2954 -2.1073 -2.1044 -1.2321 -1.2306 -1.1367 -1.1160 -1.0877 -1.0642 1.4230 1.4231 1.6086 1.6163 1.6213 1.6281 2.1398 2.1399 2.3579 2.3592 2.3899 2.3915 3.2063 3.2064 3.4897 3.4904 3.4939 3.4944 3.8360 3.8413 3.8480 3.8533 7.5028 7.5029 9.7507 9.7509 11.0447 11.0454 12.2646 12.2648 12.6948 12.7157 12.7171 12.7368 k = 0.0000 0.0000 0.3151 ( 5120 PWs) bands (ev): -20.0250 -20.0250 -19.2306 -19.2306 -15.4038 -15.4037 -15.2625 -15.2624 -13.8383 -13.8383 -12.8049 -12.8045 -12.7941 -12.7938 -8.6888 -8.6887 -4.7791 -4.7741 -3.9591 -3.9529 -3.9232 -3.9217 -2.8321 -2.8286 -2.2957 -2.2946 -2.1058 -2.1033 -1.2192 -1.2179 -1.1319 -1.1140 -1.0828 -1.0627 1.4256 1.4257 1.6102 1.6179 1.6212 1.6281 2.1363 2.1365 2.3577 2.3589 2.3899 2.3913 3.1918 3.1919 3.4901 3.4908 3.4937 3.4943 3.8322 3.8372 3.8425 3.8476 7.5171 7.5172 9.7381 9.7383 11.0460 11.0466 12.2677 12.2678 12.6888 12.7064 12.7124 12.7291 k = 0.0000 0.0000 0.3308 ( 5114 PWs) bands (ev): -20.0247 -20.0247 -19.2310 -19.2310 -15.4038 -15.4037 -15.2625 -15.2624 -13.8380 -13.8380 -12.8048 -12.8045 -12.7941 -12.7938 -8.6890 -8.6890 -4.7803 -4.7762 -3.9603 -3.9553 -3.9266 -3.9254 -2.8326 -2.8298 -2.2948 -2.2940 -2.1046 -2.1025 -1.2084 -1.2074 -1.1273 -1.1126 -1.0783 -1.0618 1.4278 1.4279 1.6119 1.6195 1.6209 1.6278 2.1334 2.1335 2.3577 2.3586 2.3899 2.3910 3.1797 3.1798 3.4905 3.4912 3.4935 3.4942 3.8292 3.8341 3.8378 3.8426 7.5292 7.5293 9.7274 9.7276 11.0471 11.0476 12.2702 12.2704 12.6841 12.6983 12.7088 12.7223 k = 0.0000 0.0000 0.3466 ( 5114 PWs) bands (ev): -20.0245 -20.0245 -19.2313 -19.2313 -15.4038 -15.4038 -15.2625 -15.2624 -13.8377 -13.8377 -12.8047 -12.8045 -12.7940 -12.7938 -8.6892 -8.6892 -4.7811 -4.7780 -3.9612 -3.9573 -3.9293 -3.9284 -2.8329 -2.8308 -2.2941 -2.2935 -2.1035 -2.1019 -1.1999 -1.1992 -1.1230 -1.1118 -1.0742 -1.0616 1.4295 1.4296 1.6135 1.6203 1.6210 1.6273 2.1311 2.1311 2.3576 2.3584 2.3899 2.3908 3.1701 3.1702 3.4908 3.4916 3.4932 3.4939 3.8271 3.8318 3.8337 3.8384 7.5389 7.5389 9.7189 9.7190 11.0480 11.0483 12.2723 12.2724 12.6808 12.6915 12.7063 12.7166 k = 0.0000 0.0000 0.3623 ( 5114 PWs) bands (ev): -20.0244 -20.0244 -19.2315 -19.2315 -15.4038 -15.4038 -15.2625 -15.2624 -13.8375 -13.8375 -12.8047 -12.8046 -12.7940 -12.7939 -8.6893 -8.6893 -4.7816 -4.7794 -3.9616 -3.9590 -3.9312 -3.9306 -2.8331 -2.8316 -2.2936 -2.2932 -2.1026 -2.1016 -1.1939 -1.1934 -1.1193 -1.1117 -1.0706 -1.0621 1.4308 1.4308 1.6150 1.6196 1.6224 1.6267 2.1293 2.1294 2.3577 2.3581 2.3900 2.3906 3.1631 3.1632 3.4912 3.4920 3.4929 3.4936 3.8260 3.8305 3.8306 3.8350 7.5459 7.5459 9.7127 9.7128 11.0486 11.0488 12.2738 12.2738 12.6789 12.6861 12.7050 12.7119 k = 0.0000 0.0000 0.3781 ( 5102 PWs) bands (ev): -20.0243 -20.0243 -19.2317 -19.2317 -15.4038 -15.4038 -15.2625 -15.2625 -13.8373 -13.8373 -12.8046 -12.8046 -12.7939 -12.7939 -8.6894 -8.6894 -4.7816 -4.7805 -3.9616 -3.9603 -3.9323 -3.9320 -2.8330 -2.8323 -2.2932 -2.2930 -2.1020 -2.1015 -1.1902 -1.1899 -1.1162 -1.1124 -1.0676 -1.0633 1.4316 1.4316 1.6164 1.6187 1.6237 1.6259 2.1283 2.1283 2.3577 2.3580 2.3901 2.3904 3.1589 3.1589 3.4917 3.4925 3.4925 3.4933 3.8258 3.8280 3.8303 3.8325 7.5502 7.5502 9.7090 9.7090 11.0490 11.0491 12.2747 12.2748 12.6785 12.6821 12.7049 12.7084 k = 0.0000 0.0000 0.3938 ( 5090 PWs) bands (ev): -20.0242 -20.0242 -19.2317 -19.2317 -15.4038 -15.4038 -15.2625 -15.2625 -13.8373 -13.8373 -12.8046 -12.8046 -12.7939 -12.7939 -8.6894 -8.6894 -4.7813 -4.7813 -3.9612 -3.9612 -3.9326 -3.9326 -2.8327 -2.8327 -2.2930 -2.2930 -2.1016 -2.1016 -1.1889 -1.1889 -1.1139 -1.1139 -1.0651 -1.0651 1.4319 1.4319 1.6176 1.6176 1.6248 1.6248 2.1280 2.1280 2.3578 2.3578 2.3902 2.3902 3.1575 3.1575 3.4921 3.4921 3.4929 3.4929 3.8265 3.8265 3.8309 3.8309 7.5516 7.5516 9.7078 9.7078 11.0492 11.0492 12.2751 12.2751 12.6796 12.6796 12.7060 12.7060 k = 0.0000 0.0000 0.3938 ( 5090 PWs) bands (ev): -20.0242 -20.0242 -19.2317 -19.2317 -15.4038 -15.4038 -15.2625 -15.2625 -13.8373 -13.8373 -12.8046 -12.8046 -12.7939 -12.7939 -8.6894 -8.6894 -4.7813 -4.7813 -3.9612 -3.9612 -3.9326 -3.9326 -2.8327 -2.8327 -2.2930 -2.2930 -2.1016 -2.1016 -1.1889 -1.1889 -1.1139 -1.1139 -1.0651 -1.0651 1.4319 1.4319 1.6176 1.6176 1.6248 1.6248 2.1280 2.1280 2.3578 2.3578 2.3902 2.3902 3.1575 3.1575 3.4921 3.4921 3.4929 3.4929 3.8265 3.8265 3.8309 3.8309 7.5516 7.5516 9.7078 9.7078 11.0492 11.0492 12.2751 12.2751 12.6796 12.6796 12.7060 12.7060 k = 0.0135 0.0078 0.3938 ( 5090 PWs) bands (ev): -20.0242 -20.0242 -19.2312 -19.2312 -15.4051 -15.4045 -15.2636 -15.2636 -13.8375 -13.8364 -12.8044 -12.8044 -12.7937 -12.7937 -8.6866 -8.6866 -4.7816 -4.7809 -3.9612 -3.9612 -3.9328 -3.9322 -2.8540 -2.8165 -2.3149 -2.2735 -2.1018 -2.1011 -1.2020 -1.1814 -1.1223 -1.0994 -1.0618 -1.0613 1.4330 1.4331 1.6097 1.6097 1.6210 1.6216 2.1360 2.1364 2.3562 2.3567 2.3887 2.3888 3.1575 3.1580 3.4917 3.4918 3.4927 3.4935 3.8269 3.8272 3.8315 3.8315 7.5550 7.5553 9.7090 9.7093 11.0471 11.0530 12.2732 12.2734 12.6772 12.6781 12.7046 12.7046 k = 0.0270 0.0156 0.3938 ( 5106 PWs) bands (ev): -20.0242 -20.0242 -19.2295 -19.2295 -15.4086 -15.4075 -15.2669 -15.2668 -13.8372 -13.8350 -12.8039 -12.8038 -12.7932 -12.7932 -8.6781 -8.6781 -4.7818 -4.7806 -3.9613 -3.9613 -3.9328 -3.9317 -2.8793 -2.8064 -2.3367 -2.2601 -2.1030 -2.0973 -1.2163 -1.1845 -1.1192 -1.0851 -1.0520 -1.0488 1.4366 1.4368 1.5816 1.5820 1.6162 1.6173 2.1585 2.1593 2.3514 2.3517 2.3850 2.3857 3.1580 3.1590 3.4901 3.4903 3.4935 3.4950 3.8285 3.8289 3.8333 3.8333 7.5654 7.5660 9.7131 9.7136 11.0469 11.0587 12.2678 12.2681 12.6681 12.6700 12.7033 12.7034 k = 0.0405 0.0234 0.3938 ( 5104 PWs) bands (ev): -20.0242 -20.0242 -19.2269 -19.2269 -15.4143 -15.4127 -15.2722 -15.2721 -13.8363 -13.8330 -12.8030 -12.8028 -12.7923 -12.7923 -8.6639 -8.6639 -4.7821 -4.7802 -3.9615 -3.9615 -3.9327 -3.9310 -2.9075 -2.8029 -2.3574 -2.2571 -2.1057 -2.0873 -1.2296 -1.1944 -1.1080 -1.0725 -1.0360 -1.0280 1.4425 1.4428 1.5386 1.5393 1.6098 1.6113 2.1910 2.1922 2.3412 2.3419 2.3811 2.3832 3.1589 3.1605 3.4873 3.4875 3.4953 3.4974 3.8310 3.8315 3.8363 3.8365 7.5828 7.5837 9.7199 9.7208 11.0486 11.0662 12.2590 12.2594 12.6493 12.6518 12.7060 12.7060 k = 0.0541 0.0312 0.3938 ( 5112 PWs) bands (ev): -20.0241 -20.0241 -19.2231 -19.2231 -15.4224 -15.4203 -15.2792 -15.2790 -13.8347 -13.8305 -12.8018 -12.8016 -12.7912 -12.7911 -8.6443 -8.6443 -4.7823 -4.7798 -3.9618 -3.9618 -3.9324 -3.9301 -2.9376 -2.8062 -2.3772 -2.2662 -2.1094 -2.0702 -1.2412 -1.2059 -1.0935 -1.0595 -1.0145 -1.0021 1.4502 1.4505 1.4856 1.4867 1.6014 1.6032 2.2284 2.2302 2.3245 2.3268 2.3791 2.3828 3.1604 3.1625 3.4835 3.4837 3.4980 3.5008 3.8342 3.8346 3.8406 3.8410 7.6068 7.6081 9.7295 9.7307 11.0520 11.0755 12.2467 12.2473 12.6217 12.6245 12.7121 12.7124 k = 0.0676 0.0390 0.3938 ( 5120 PWs) bands (ev): -20.0241 -20.0241 -19.2183 -19.2183 -15.4332 -15.4307 -15.2876 -15.2872 -13.8327 -13.8274 -12.8003 -12.8000 -12.7897 -12.7896 -8.6191 -8.6191 -4.7826 -4.7794 -3.9623 -3.9621 -3.9319 -3.9290 -2.9689 -2.8157 -2.3974 -2.2860 -2.1134 -2.0483 -1.2506 -1.2165 -1.0767 -1.0442 -0.9887 -0.9734 1.4244 1.4263 1.4605 1.4608 1.5913 1.5933 2.2640 2.2681 2.3025 2.3076 2.3813 2.3861 3.1625 3.1651 3.4787 3.4789 3.5017 3.5051 3.8378 3.8382 3.8462 3.8469 7.6373 7.6388 9.7417 9.7433 11.0573 11.0864 12.2310 12.2317 12.5871 12.5901 12.7208 12.7215 k = 0.0811 0.0468 0.3938 ( 5124 PWs) bands (ev): -20.0240 -20.0240 -19.2125 -19.2125 -15.4467 -15.4441 -15.2971 -15.2963 -13.8300 -13.8238 -12.7984 -12.7982 -12.7879 -12.7878 -8.5887 -8.5887 -4.7828 -4.7790 -3.9628 -3.9626 -3.9313 -3.9277 -3.0006 -2.8304 -2.4197 -2.3142 -2.1170 -2.0245 -1.2580 -1.2255 -1.0572 -1.0257 -0.9599 -0.9429 1.3598 1.3623 1.4701 1.4703 1.5806 1.5826 2.2716 2.2728 2.3036 2.3053 2.3915 2.3961 3.1651 3.1684 3.4730 3.4733 3.5064 3.5104 3.8418 3.8421 3.8531 3.8541 7.6737 7.6755 9.7566 9.7587 11.0642 11.0990 12.2121 12.2129 12.5469 12.5501 12.7317 12.7326 k = 0.0946 0.0546 0.3938 ( 5126 PWs) bands (ev): -20.0239 -20.0239 -19.2057 -19.2057 -15.4632 -15.4605 -15.3071 -15.3059 -13.8268 -13.8197 -12.7964 -12.7961 -12.7859 -12.7858 -8.5531 -8.5530 -4.7830 -4.7785 -3.9635 -3.9631 -3.9305 -3.9262 -3.0322 -2.8488 -2.4455 -2.3490 -2.1197 -2.0014 -1.2632 -1.2328 -1.0343 -1.0037 -0.9291 -0.9113 1.2919 1.2950 1.4773 1.4785 1.5718 1.5732 2.2425 2.2448 2.3203 2.3240 2.4148 2.4178 3.1685 3.1723 3.4665 3.4667 3.5121 3.5167 3.8461 3.8463 3.8610 3.8622 7.7157 7.7177 9.7741 9.7766 11.0728 11.1131 12.1899 12.1908 12.5024 12.5056 12.7443 12.7456 k = 0.1081 0.0624 0.3938 ( 5118 PWs) bands (ev): -20.0238 -20.0238 -19.1979 -19.1979 -15.4829 -15.4802 -15.3173 -15.3157 -13.8230 -13.8151 -12.7941 -12.7938 -12.7837 -12.7835 -8.5124 -8.5124 -4.7832 -4.7780 -3.9643 -3.9638 -3.9295 -3.9245 -3.0634 -2.8697 -2.4761 -2.3890 -2.1216 -1.9804 -1.2666 -1.2382 -1.0076 -0.9779 -0.8969 -0.8789 1.2218 1.2257 1.4772 1.4802 1.5696 1.5696 2.2085 2.2122 2.3260 2.3327 2.4489 2.4504 3.1727 3.1771 3.4592 3.4595 3.5189 3.5240 3.8504 3.8507 3.8698 3.8713 7.7628 7.7651 9.7940 9.7971 11.0831 11.1287 12.1646 12.1656 12.4546 12.4577 12.7586 12.7602 k = 0.1216 0.0702 0.3938 ( 5122 PWs) bands (ev): -20.0237 -20.0237 -19.1892 -19.1891 -15.5057 -15.5032 -15.3276 -15.3254 -13.8188 -13.8101 -12.7917 -12.7914 -12.7812 -12.7809 -8.4669 -8.4669 -4.7833 -4.7776 -3.9653 -3.9646 -3.9284 -3.9226 -3.0936 -2.8921 -2.5119 -2.4334 -2.1230 -1.9628 -1.2682 -1.2420 -0.9766 -0.9482 -0.8638 -0.8460 1.1506 1.1553 1.4661 1.4708 1.5761 1.5775 2.1722 2.1769 2.3256 2.3345 2.4872 2.4877 3.1777 3.1827 3.4512 3.4515 3.5268 3.5324 3.8548 3.8550 3.8794 3.8812 7.8144 7.8170 9.8164 9.8202 11.0948 11.1456 12.1362 12.1372 12.4046 12.4073 12.7742 12.7761 k = 0.1351 0.0780 0.3938 ( 5126 PWs) bands (ev): -20.0236 -20.0236 -19.1795 -19.1795 -15.5314 -15.5291 -15.3377 -15.3349 -13.8140 -13.8047 -12.7891 -12.7890 -12.7786 -12.7782 -8.4169 -8.4169 -4.7835 -4.7770 -3.9664 -3.9656 -3.9270 -3.9205 -3.1226 -2.9148 -2.5528 -2.4817 -2.1245 -1.9492 -1.2684 -1.2441 -0.9414 -0.9148 -0.8302 -0.8129 1.0789 1.0843 1.4454 1.4512 1.5918 1.5940 2.1345 2.1400 2.3222 2.3326 2.5257 2.5260 3.1838 3.1893 3.4426 3.4429 3.5357 3.5417 3.8591 3.8592 3.8896 3.8916 7.8702 7.8730 9.8410 9.8456 11.1080 11.1636 12.1048 12.1059 12.3531 12.3554 12.7909 12.7932 k = 0.1486 0.0858 0.3938 ( 5112 PWs) bands (ev): -20.0235 -20.0235 -19.1690 -19.1690 -15.5600 -15.5579 -15.3475 -15.3442 -13.8089 -13.7989 -12.7866 -12.7865 -12.7758 -12.7753 -8.3625 -8.3624 -4.7837 -4.7765 -3.9676 -3.9666 -3.9256 -3.9182 -3.1502 -2.9373 -2.5985 -2.5332 -2.1269 -1.9399 -1.2673 -1.2447 -0.9021 -0.8777 -0.7963 -0.7796 1.0073 1.0136 1.4179 1.4245 1.6133 1.6158 2.0963 2.1023 2.3169 2.3285 2.5627 2.5636 3.1910 3.1969 3.4335 3.4338 3.5457 3.5520 3.8632 3.8633 3.9003 3.9026 7.9294 7.9325 9.8679 9.8733 11.1226 11.1826 12.0706 12.0716 12.3010 12.3025 12.8084 12.8111 k = 0.1622 0.0936 0.3938 ( 5114 PWs) bands (ev): -20.0234 -20.0234 -19.1577 -19.1576 -15.5910 -15.5891 -15.3571 -15.3533 -13.8033 -13.7928 -12.7840 -12.7840 -12.7728 -12.7723 -8.3039 -8.3038 -4.7838 -4.7760 -3.9690 -3.9678 -3.9240 -3.9157 -3.1763 -2.9589 -2.6484 -2.5874 -2.1309 -1.9350 -1.2650 -1.2441 -0.8593 -0.8373 -0.7621 -0.7465 0.9364 0.9435 1.3856 1.3927 1.6383 1.6411 2.0581 2.0647 2.3101 2.3228 2.5976 2.5991 3.1993 3.2056 3.4238 3.4242 3.5567 3.5632 3.8669 3.8670 3.9113 3.9139 7.9917 7.9950 9.8968 9.9033 11.1384 11.2024 12.0335 12.0346 12.2489 12.2494 12.8266 12.8297 k = 0.1757 0.1014 0.3938 ( 5110 PWs) bands (ev): -20.0232 -20.0232 -19.1456 -19.1456 -15.6242 -15.6225 -15.3664 -15.3622 -13.7973 -13.7864 -12.7816 -12.7815 -12.7697 -12.7691 -8.2415 -8.2414 -4.7840 -4.7754 -3.9704 -3.9690 -3.9224 -3.9132 -3.2007 -2.9793 -2.7022 -2.6440 -2.1368 -1.9346 -1.2618 -1.2423 -0.8135 -0.7941 -0.7279 -0.7134 0.8667 0.8746 1.3493 1.3568 1.6655 1.6686 2.0210 2.0279 2.3020 2.3157 2.6302 2.6321 3.2088 3.2153 3.4138 3.4142 3.5686 3.5752 3.8703 3.8704 3.9226 3.9254 8.0565 8.0600 9.9276 9.9353 11.1553 11.2227 11.9938 11.9949 12.1967 12.1975 12.8451 12.8487 k = 0.1892 0.1092 0.3938 ( 5118 PWs) bands (ev): -20.0231 -20.0231 -19.1328 -19.1328 -15.6592 -15.6577 -15.3756 -15.3710 -13.7910 -13.7797 -12.7793 -12.7791 -12.7665 -12.7659 -8.1755 -8.1754 -4.7842 -4.7748 -3.9720 -3.9704 -3.9207 -3.9105 -3.2236 -2.9982 -2.7590 -2.7025 -2.1450 -1.9384 -1.2577 -1.2395 -0.7657 -0.7486 -0.6934 -0.6806 0.7989 0.8075 1.3097 1.3174 1.6938 1.6971 1.9857 1.9929 2.2927 2.3073 2.6602 2.6624 3.2195 3.2260 3.4033 3.4038 3.5814 3.5881 3.8733 3.8733 3.9341 3.9371 8.1232 8.1269 9.9603 9.9693 11.1731 11.2431 11.9516 11.9526 12.1449 12.1475 12.8637 12.8677 k = 0.2027 0.1170 0.3938 ( 5122 PWs) bands (ev): -20.0230 -20.0230 -19.1194 -19.1193 -15.6957 -15.6943 -15.3845 -15.3796 -13.7843 -13.7728 -12.7771 -12.7769 -12.7633 -12.7626 -8.1062 -8.1061 -4.7843 -4.7742 -3.9737 -3.9719 -3.9190 -3.9077 -3.2448 -3.0156 -2.8184 -2.7623 -2.1557 -1.9462 -1.2528 -1.2358 -0.7172 -0.7018 -0.6584 -0.6479 0.7336 0.7429 1.2674 1.2752 1.7216 1.7254 1.9539 1.9609 2.2822 2.2975 2.6876 2.6901 3.2310 3.2375 3.3925 3.3930 3.5951 3.6017 3.8758 3.8758 3.9455 3.9487 8.1915 8.1953 9.9946 10.0051 11.1917 11.2634 11.9071 11.9080 12.0945 12.0994 12.8820 12.8866 k = 0.2162 0.1248 0.3938 ( 5136 PWs) bands (ev): -20.0228 -20.0228 -19.1054 -19.1053 -15.7333 -15.7321 -15.3932 -15.3881 -13.7775 -13.7658 -12.7750 -12.7748 -12.7600 -12.7593 -8.0339 -8.0338 -4.7845 -4.7736 -3.9755 -3.9734 -3.9173 -3.9049 -3.2649 -3.0319 -2.8792 -2.8228 -2.1690 -1.9577 -1.2474 -1.2314 -0.6698 -0.6549 -0.6220 -0.6151 0.6715 0.6813 1.2227 1.2306 1.7463 1.7507 1.9280 1.9345 2.2705 2.2865 2.7124 2.7151 3.2433 3.2496 3.3814 3.3820 3.6096 3.6161 3.8777 3.8777 3.9569 3.9603 8.2608 8.2648 10.0304 10.0425 11.2108 11.2830 11.8604 11.8612 12.0461 12.0541 12.8999 12.9051 k = 0.2297 0.1326 0.3938 ( 5126 PWs) bands (ev): -20.0227 -20.0227 -19.0909 -19.0908 -15.7717 -15.7707 -15.4017 -15.3965 -13.7704 -13.7586 -12.7731 -12.7728 -12.7567 -12.7560 -7.9590 -7.9588 -4.7847 -4.7729 -3.9773 -3.9750 -3.9157 -3.9021 -3.2841 -3.0488 -2.9394 -2.8832 -2.1848 -1.9725 -1.2414 -1.2264 -0.6261 -0.6097 -0.5828 -0.5811 0.6135 0.6236 1.1763 1.1842 1.7625 1.7681 1.9133 1.9187 2.2576 2.2742 2.7350 2.7377 3.2561 3.2619 3.3701 3.3707 3.6250 3.6312 3.8790 3.8791 3.9681 3.9717 8.3307 8.3349 10.0675 10.0816 11.2300 11.3013 11.8119 11.8125 12.0001 12.0122 12.9170 12.9229 k = 0.2432 0.1404 0.3938 ( 5122 PWs) bands (ev): -20.0225 -20.0225 -19.0760 -19.0760 -15.8106 -15.8097 -15.4100 -15.4047 -13.7631 -13.7514 -12.7713 -12.7710 -12.7535 -12.7528 -7.8818 -7.8815 -4.7848 -4.7722 -3.9793 -3.9767 -3.9142 -3.8993 -3.3033 -3.0722 -2.9924 -2.9423 -2.2031 -1.9905 -1.2349 -1.2208 -0.5876 -0.5696 -0.5438 -0.5407 0.5605 0.5707 1.1286 1.1363 1.7639 1.7709 1.9159 1.9199 2.2435 2.2606 2.7554 2.7581 3.2690 3.2742 3.3585 3.3591 3.6411 3.6469 3.8798 3.8799 3.9791 3.9829 8.4009 8.4051 10.1058 10.1220 11.2489 11.3175 11.7616 11.7620 11.9574 11.9747 12.9333 12.9398 k = 0.2568 0.1482 0.3938 ( 5118 PWs) bands (ev): -20.0224 -20.0223 -19.0608 -19.0607 -15.8498 -15.8490 -15.4181 -15.4127 -13.7558 -13.7441 -12.7697 -12.7694 -12.7504 -12.7497 -7.8026 -7.8023 -4.7850 -4.7715 -3.9814 -3.9785 -3.9131 -3.8966 -3.3237 -3.1151 -3.0249 -2.9986 -2.2238 -2.0113 -1.2281 -1.2148 -0.5532 -0.5356 -0.5035 -0.4980 0.5137 0.5237 1.0802 1.0877 1.7510 1.7587 1.9352 1.9383 2.2282 2.2458 2.7739 2.7765 3.2817 3.2862 3.3466 3.3474 3.6579 3.6633 3.8800 3.8801 3.9897 3.9937 8.4708 8.4752 10.1451 10.1636 11.2669 11.3306 11.7100 11.7102 11.9185 11.9427 12.9484 12.9556 k = 0.2703 0.1560 0.3938 ( 5114 PWs) bands (ev): -20.0222 -20.0222 -19.0454 -19.0453 -15.8888 -15.8881 -15.4260 -15.4206 -13.7484 -13.7369 -12.7682 -12.7679 -12.7473 -12.7466 -7.7219 -7.7215 -4.7851 -4.7708 -3.9836 -3.9805 -3.9122 -3.8940 -3.3471 -3.1754 -3.0497 -3.0385 -2.2467 -2.0347 -1.2210 -1.2084 -0.5216 -0.5052 -0.4643 -0.4578 0.4743 0.4836 1.0315 1.0388 1.7301 1.7380 1.9645 1.9672 2.2118 2.2297 2.7908 2.7933 3.2937 3.2974 3.3347 3.3354 3.6753 3.6803 3.8797 3.8798 4.0000 4.0041 8.5402 8.5446 10.1852 10.2062 11.2831 11.3396 11.6572 11.6572 11.8844 11.9170 12.9624 12.9703 k = 0.2838 0.1638 0.3938 ( 5114 PWs) bands (ev): -20.0221 -20.0220 -19.0298 -19.0298 -15.9275 -15.9269 -15.4335 -15.4282 -13.7409 -13.7297 -12.7669 -12.7666 -12.7444 -12.7438 -7.6400 -7.6396 -4.7852 -4.7700 -3.9860 -3.9826 -3.9118 -3.8916 -3.3758 -3.2424 -3.0931 -3.0435 -2.2718 -2.0604 -1.2136 -1.2019 -0.4919 -0.4768 -0.4292 -0.4226 0.4439 0.4519 0.9831 0.9901 1.7060 1.7139 1.9988 2.0013 2.1942 2.2124 2.8063 2.8086 3.3049 3.3077 3.3225 3.3234 3.6933 3.6978 3.8788 3.8789 4.0097 4.0139 8.6087 8.6132 10.2260 10.2497 11.2965 11.3434 11.6034 11.6037 11.8561 11.8989 12.9752 12.9838 k = 0.2973 0.1716 0.3938 ( 5106 PWs) bands (ev): -20.0219 -20.0219 -19.0143 -19.0142 -15.9656 -15.9650 -15.4408 -15.4356 -13.7336 -13.7226 -12.7657 -12.7654 -12.7417 -12.7411 -7.5575 -7.5569 -4.7853 -4.7692 -3.9886 -3.9850 -3.9120 -3.8895 -3.4117 -3.3118 -3.1262 -3.0437 -2.2987 -2.0883 -1.2062 -1.1952 -0.4637 -0.4500 -0.4001 -0.3943 0.4235 0.4296 0.9355 0.9421 1.6810 1.6886 2.0355 2.0379 2.1757 2.1940 2.8207 2.8226 3.3101 3.3108 3.3151 3.3173 3.7117 3.7158 3.8774 3.8775 4.0189 4.0232 8.6759 8.6804 10.2673 10.2938 11.3060 11.3412 11.5492 11.5498 11.8348 11.8888 12.9868 12.9961 k = 0.3108 0.1794 0.3938 ( 5102 PWs) bands (ev): -20.0218 -20.0218 -18.9988 -18.9988 -16.0027 -16.0022 -15.4478 -15.4428 -13.7263 -13.7158 -12.7646 -12.7644 -12.7391 -12.7385 -7.4747 -7.4740 -4.7853 -4.7684 -3.9915 -3.9878 -3.9130 -3.8879 -3.4548 -3.3818 -3.1484 -3.0405 -2.3273 -2.1182 -1.1987 -1.1884 -0.4368 -0.4247 -0.3783 -0.3742 0.4140 0.4177 0.8890 0.8953 1.6561 1.6635 2.0732 2.0756 2.1562 2.1747 2.8341 2.8357 3.2978 3.2987 3.3237 3.3251 3.7303 3.7340 3.8755 3.8757 4.0275 4.0319 8.7415 8.7460 10.3090 10.3384 11.3102 11.3326 11.4950 11.4959 11.8215 11.8871 12.9973 13.0074 k = 0.3243 0.1872 0.3938 ( 5114 PWs) bands (ev): -20.0216 -20.0216 -18.9837 -18.9836 -16.0386 -16.0382 -15.4544 -15.4496 -13.7192 -13.7091 -12.7637 -12.7635 -12.7367 -12.7362 -7.3922 -7.3915 -4.7853 -4.7675 -3.9949 -3.9912 -3.9151 -3.8869 -3.5033 -3.4513 -3.1606 -3.0342 -2.3574 -2.1498 -1.1912 -1.1816 -0.4116 -0.4017 -0.3637 -0.3625 0.4155 0.4164 0.8442 0.8500 1.6319 1.6389 2.1113 2.1136 2.1359 2.1544 2.8466 2.8479 3.2854 3.2863 3.3310 3.3316 3.7490 3.7522 3.8733 3.8734 4.0355 4.0399 8.8052 8.8097 10.3508 10.3833 11.3083 11.3179 11.4413 11.4425 11.8169 11.8931 13.0068 13.0176 k = 0.3378 0.1951 0.3938 ( 5118 PWs) bands (ev): -20.0215 -20.0215 -18.9689 -18.9688 -16.0732 -16.0728 -15.4606 -15.4561 -13.7124 -13.7028 -12.7629 -12.7627 -12.7345 -12.7340 -7.3105 -7.3097 -4.7852 -4.7666 -3.9989 -3.9956 -3.9185 -3.8867 -3.5545 -3.5190 -3.1645 -3.0253 -2.3887 -2.1830 -1.1838 -1.1750 -0.3888 -0.3830 -0.3579 -0.3540 0.4252 0.4272 0.8013 0.8067 1.6087 1.6152 2.1150 2.1332 2.1494 2.1514 2.8584 2.8594 3.2730 3.2739 3.3369 3.3369 3.7675 3.7704 3.8707 3.8709 4.0428 4.0472 8.8668 8.8712 10.3928 10.4284 11.2975 11.2997 11.3887 11.3902 11.8210 11.9058 13.0154 13.0270 k = 0.3514 0.2029 0.3938 ( 5116 PWs) bands (ev): -20.0214 -20.0214 -18.9546 -18.9545 -16.1060 -16.1057 -15.4665 -15.4622 -13.7057 -13.6968 -12.7622 -12.7620 -12.7325 -12.7321 -7.2304 -7.2295 -4.7850 -4.7657 -4.0040 -4.0017 -3.9235 -3.8879 -3.6053 -3.5837 -3.1620 -3.0140 -2.4209 -2.2176 -1.1766 -1.1686 -0.3748 -0.3742 -0.3534 -0.3421 0.4427 0.4474 0.7608 0.7657 1.5866 1.5927 2.0937 2.1117 2.1865 2.1884 2.8695 2.8702 3.2606 3.2615 3.3408 3.3414 3.7857 3.7883 3.8679 3.8680 4.0494 4.0537 8.9258 8.9301 10.4347 10.4733 11.2723 11.2839 11.3387 11.3397 11.8330 11.9237 13.0233 13.0356 k = 0.3649 0.2107 0.3938 ( 5118 PWs) bands (ev): -20.0212 -20.0212 -18.9409 -18.9409 -16.1369 -16.1366 -15.4719 -15.4679 -13.6995 -13.6911 -12.7616 -12.7614 -12.7307 -12.7304 -7.1524 -7.1515 -4.7847 -4.7648 -4.0106 -4.0106 -3.9301 -3.8909 -3.6526 -3.6434 -3.1543 -3.0005 -2.4537 -2.2532 -1.1697 -1.1624 -0.3783 -0.3777 -0.3374 -0.3254 0.4671 0.4741 0.7228 0.7273 1.5658 1.5715 2.0723 2.0898 2.2225 2.2244 2.8799 2.8804 3.2484 3.2493 3.3435 3.3446 3.8033 3.8056 3.8649 3.8651 4.0553 4.0595 8.9818 8.9860 10.4764 10.5179 11.2424 11.2592 11.2922 11.2945 11.8517 11.9454 13.0305 13.0435 k = 0.3784 0.2185 0.3938 ( 5120 PWs) bands (ev): -20.0211 -20.0211 -18.9280 -18.9280 -16.1657 -16.1654 -15.4768 -15.4731 -13.6936 -13.6859 -12.7611 -12.7610 -12.7292 -12.7288 -7.0774 -7.0764 -4.7842 -4.7639 -4.0239 -4.0198 -3.9376 -3.8967 -3.6959 -3.6939 -3.1424 -2.9853 -2.4865 -2.2898 -1.1632 -1.1566 -0.3891 -0.3881 -0.3186 -0.3078 0.4962 0.5049 0.6878 0.6918 1.5466 1.5518 2.0509 2.0678 2.2570 2.2587 2.8897 2.8900 3.2365 3.2374 3.3452 3.3466 3.8200 3.8221 3.8620 3.8622 4.0604 4.0645 9.0347 9.0386 10.5179 10.5621 11.2082 11.2228 11.2489 11.2600 11.8756 11.9694 13.0371 13.0507 k = 0.3919 0.2263 0.3938 ( 5116 PWs) bands (ev): -20.0210 -20.0210 -18.9160 -18.9160 -16.1921 -16.1919 -15.4813 -15.4779 -13.6881 -13.6811 -12.7607 -12.7606 -12.7277 -12.7274 -7.0062 -7.0052 -4.7835 -4.7631 -4.0430 -4.0329 -3.9451 -3.9058 -3.7382 -3.7275 -3.1271 -2.9688 -2.5189 -2.3270 -1.1570 -1.1511 -0.4031 -0.4010 -0.3006 -0.2911 0.5281 0.5379 0.6558 0.6594 1.5289 1.5336 2.0301 2.0461 2.2895 2.2911 2.8988 2.8988 3.2249 3.2258 3.3460 3.3476 3.8353 3.8372 3.8594 3.8597 4.0649 4.0688 9.0839 9.0876 10.5590 10.6055 11.1707 11.1810 11.2099 11.2307 11.9029 11.9942 13.0433 13.0573 k = 0.4054 0.2341 0.3938 ( 5122 PWs) bands (ev): -20.0209 -20.0209 -18.9050 -18.9050 -16.2159 -16.2157 -15.4852 -15.4823 -13.6830 -13.6769 -12.7604 -12.7602 -12.7265 -12.7263 -6.9398 -6.9387 -4.7826 -4.7624 -4.0681 -4.0514 -3.9514 -3.9177 -3.7687 -3.7531 -3.1087 -2.9517 -2.5500 -2.3646 -1.1513 -1.1462 -0.4178 -0.4150 -0.2841 -0.2758 0.5607 0.5711 0.6273 0.6305 1.5130 1.5172 2.0102 2.0250 2.3197 2.3212 2.9070 2.9071 3.2139 3.2147 3.3461 3.3477 3.8474 3.8486 3.8590 3.8597 4.0687 4.0724 9.1290 9.1324 10.5995 10.6481 11.1323 11.1400 11.1740 11.2017 11.9321 12.0185 13.0490 13.0633 k = 0.4189 0.2419 0.3938 ( 5130 PWs) bands (ev): -20.0209 -20.0209 -18.8953 -18.8952 -16.2370 -16.2368 -15.4887 -15.4861 -13.6785 -13.6732 -12.7601 -12.7600 -12.7255 -12.7253 -6.8790 -6.8780 -4.7813 -4.7619 -4.0973 -4.0759 -3.9561 -3.9300 -3.7881 -3.7716 -3.0879 -2.9351 -2.5787 -2.4023 -1.1462 -1.1418 -0.4321 -0.4291 -0.2694 -0.2623 0.5915 0.5992 0.6060 0.6062 1.4989 1.5026 1.9916 2.0051 2.3471 2.3484 2.9144 2.9146 3.2036 3.2044 3.3456 3.3473 3.8501 3.8504 3.8668 3.8682 4.0719 4.0752 9.1695 9.1726 10.6395 10.6893 11.0955 11.1020 11.1398 11.1720 11.9618 12.0409 13.0544 13.0685 k = 0.4324 0.2497 0.3938 ( 5124 PWs) bands (ev): -20.0208 -20.0208 -18.8868 -18.8867 -16.2551 -16.2550 -15.4916 -15.4894 -13.6746 -13.6701 -12.7599 -12.7598 -12.7246 -12.7245 -6.8251 -6.8242 -4.7797 -4.7617 -4.1278 -4.1048 -3.9594 -3.9405 -3.7994 -3.7846 -3.0650 -2.9206 -2.6033 -2.4396 -1.1417 -1.1381 -0.4452 -0.4422 -0.2566 -0.2507 0.5802 0.5820 0.6237 0.6328 1.4869 1.4899 1.9748 1.9867 2.3713 2.3724 2.9209 2.9211 3.1943 3.1950 3.3448 3.3464 3.8484 3.8486 3.8775 3.8789 4.0744 4.0774 9.2051 9.2078 10.6785 10.7289 11.0620 11.0682 11.1070 11.1418 11.9908 12.0605 13.0596 13.0730 k = 0.4459 0.2575 0.3938 ( 5124 PWs) bands (ev): -20.0207 -20.0207 -18.8796 -18.8796 -16.2702 -16.2701 -15.4939 -15.4922 -13.6712 -13.6676 -12.7597 -12.7596 -12.7240 -12.7238 -6.7790 -6.7782 -4.7778 -4.7619 -4.1563 -4.1347 -3.9616 -3.9484 -3.8058 -3.7937 -3.0406 -2.9102 -2.6218 -2.4762 -1.1379 -1.1350 -0.4565 -0.4538 -0.2459 -0.2411 0.5625 0.5641 0.6501 0.6582 1.4769 1.4793 1.9604 1.9704 2.3919 2.3928 2.9264 2.9267 3.1863 3.1868 3.3440 3.3453 3.8465 3.8466 3.8871 3.8883 4.0765 4.0789 9.2351 9.2373 10.7165 10.7660 11.0325 11.0392 11.0761 11.1114 12.0179 12.0762 13.0647 13.0766 k = 0.4595 0.2653 0.3938 ( 5112 PWs) bands (ev): -20.0207 -20.0207 -18.8740 -18.8740 -16.2820 -16.2820 -15.4957 -15.4944 -13.6684 -13.6657 -12.7595 -12.7595 -12.7234 -12.7233 -6.7418 -6.7412 -4.7755 -4.7626 -4.1803 -4.1623 -3.9628 -3.9540 -3.8091 -3.8001 -3.0152 -2.9064 -2.6315 -2.5114 -1.1348 -1.1326 -0.4655 -0.4633 -0.2373 -0.2337 0.5487 0.5499 0.6723 0.6788 1.4691 1.4709 1.9489 1.9567 2.4084 2.4091 2.9308 2.9311 3.1797 3.1801 3.3431 3.3442 3.8448 3.8449 3.8950 3.8959 4.0781 4.0800 9.2592 9.2609 10.7527 10.7993 11.0078 11.0157 11.0485 11.0814 12.0419 12.0873 13.0695 13.0791 k = 0.4730 0.2731 0.3938 ( 5108 PWs) bands (ev): -20.0207 -20.0207 -18.8699 -18.8699 -16.2906 -16.2905 -15.4969 -15.4960 -13.6663 -13.6645 -12.7594 -12.7594 -12.7230 -12.7230 -6.7145 -6.7140 -4.7730 -4.7638 -4.1977 -4.1849 -3.9633 -3.9578 -3.8104 -3.8045 -2.9896 -2.9107 -2.6309 -2.5446 -1.1324 -1.1310 -0.4720 -0.4705 -0.2309 -0.2285 0.5388 0.5396 0.6892 0.6938 1.4635 1.4648 1.9407 1.9460 2.4206 2.4210 2.9341 2.9343 3.1748 3.1751 3.3425 3.3432 3.8435 3.8436 3.9008 3.9014 4.0792 4.0805 9.2768 9.2780 10.7863 10.8257 10.9888 10.9979 11.0269 11.0532 12.0621 12.0931 13.0737 13.0805 k = 0.4865 0.2809 0.3938 ( 5108 PWs) bands (ev): -20.0206 -20.0206 -18.8675 -18.8675 -16.2957 -16.2957 -15.4976 -15.4971 -13.6648 -13.6639 -12.7594 -12.7594 -12.7228 -12.7228 -6.6977 -6.6974 -4.7704 -4.7656 -4.2073 -4.2007 -3.9631 -3.9605 -3.8105 -3.8076 -2.9646 -2.9232 -2.6200 -2.5748 -1.1309 -1.1301 -0.4758 -0.4750 -0.2268 -0.2256 0.5330 0.5334 0.7001 0.7025 1.4603 1.4609 1.9362 1.9389 2.4280 2.4283 2.9361 2.9362 3.1718 3.1720 3.3421 3.3425 3.8428 3.8428 3.9044 3.9047 4.0801 4.0807 9.2876 9.2882 10.8152 10.8394 10.9781 10.9855 11.0146 11.0295 12.0778 12.0935 13.0772 13.0807 k = 0.5000 0.2887 0.3938 ( 5100 PWs) bands (ev): -20.0206 -20.0206 -18.8666 -18.8666 -16.2974 -16.2974 -15.4976 -15.4976 -13.6640 -13.6640 -12.7594 -12.7594 -12.7227 -12.7227 -6.6919 -6.6919 -4.7678 -4.7678 -4.2083 -4.2083 -3.9622 -3.9622 -3.8095 -3.8095 -2.9419 -2.9419 -2.6006 -2.6006 -1.1301 -1.1301 -0.4768 -0.4768 -0.2251 -0.2251 0.5311 0.5311 0.7047 0.7047 1.4594 1.4594 1.9356 1.9356 2.4306 2.4306 2.9368 2.9368 3.1709 3.1709 3.3421 3.3421 3.8425 3.8425 3.9057 3.9057 4.0805 4.0805 9.2915 9.2915 10.8351 10.8351 10.9781 10.9781 11.0152 11.0152 12.0884 12.0884 13.0796 13.0796 k = 0.5000 0.2887 0.3938 ( 5100 PWs) bands (ev): -20.0206 -20.0206 -18.8666 -18.8666 -16.2974 -16.2974 -15.4976 -15.4976 -13.6640 -13.6640 -12.7594 -12.7594 -12.7227 -12.7227 -6.6919 -6.6919 -4.7678 -4.7678 -4.2083 -4.2083 -3.9622 -3.9622 -3.8095 -3.8095 -2.9419 -2.9419 -2.6006 -2.6006 -1.1301 -1.1301 -0.4768 -0.4768 -0.2251 -0.2251 0.5311 0.5311 0.7047 0.7047 1.4594 1.4594 1.9356 1.9356 2.4306 2.4306 2.9368 2.9368 3.1709 3.1709 3.3421 3.3421 3.8425 3.8425 3.9057 3.9057 4.0805 4.0805 9.2915 9.2915 10.8351 10.8351 10.9781 10.9781 11.0152 11.0152 12.0884 12.0884 13.0796 13.0796 k = 0.4921 0.3024 0.3938 ( 5114 PWs) bands (ev): -20.0206 -20.0206 -18.8665 -18.8663 -16.3012 -16.2940 -15.5029 -15.4937 -13.6643 -13.6637 -12.7636 -12.7620 -12.7192 -12.7185 -6.6908 -6.6897 -4.7688 -4.7671 -4.2226 -4.2007 -3.9635 -3.9603 -3.8134 -3.8067 -2.9513 -2.9282 -2.6023 -2.5943 -1.1335 -1.1302 -0.4786 -0.4760 -0.2247 -0.2239 0.5292 0.5304 0.6992 0.6997 1.4631 1.4640 1.9369 1.9372 2.4299 2.4306 2.9371 2.9375 3.1708 3.1717 3.3413 3.3416 3.8419 3.8435 3.9055 3.9070 4.0804 4.0805 9.2915 9.2926 10.8346 10.8377 10.9699 10.9841 11.0123 11.0185 12.0831 12.0892 13.0463 13.0946 k = 0.4841 0.3162 0.3938 ( 5108 PWs) bands (ev): -20.0206 -20.0206 -18.8658 -18.8653 -16.3053 -16.2908 -15.5096 -15.4912 -13.6644 -13.6632 -12.7719 -12.7692 -12.7103 -12.7094 -6.6863 -6.6841 -4.7699 -4.7665 -4.2431 -4.2001 -3.9640 -3.9580 -3.8180 -3.8052 -2.9561 -2.9110 -2.5994 -2.5835 -1.1402 -1.1337 -0.4814 -0.4761 -0.2227 -0.2213 0.5245 0.5270 0.6840 0.6849 1.4747 1.4764 1.9411 1.9418 2.4286 2.4299 2.9384 2.9392 3.1716 3.1732 3.3392 3.3397 3.8419 3.8450 3.9064 3.9094 4.0801 4.0804 9.2926 9.2949 10.8361 10.8425 10.9605 10.9860 11.0119 11.0214 12.0736 12.0856 13.0050 13.0844 k = 0.4762 0.3299 0.3938 ( 5108 PWs) bands (ev): -20.0206 -20.0206 -18.8646 -18.8639 -16.3097 -16.2880 -15.5175 -15.4900 -13.6643 -13.6626 -12.7815 -12.7781 -12.6991 -12.6983 -6.6785 -6.6753 -4.7713 -4.7660 -4.2693 -4.2062 -3.9638 -3.9557 -3.8230 -3.8049 -2.9562 -2.8910 -2.5920 -2.5682 -1.1504 -1.1406 -0.4851 -0.4772 -0.2193 -0.2172 0.5169 0.5207 0.6605 0.6618 1.4931 1.4953 1.9482 1.9492 2.4267 2.4286 2.9405 2.9416 3.1731 3.1756 3.3358 3.3365 3.8423 3.8468 3.9085 3.9127 4.0797 4.0802 9.2950 9.2984 10.8391 10.8490 10.9506 10.9827 11.0149 11.0238 12.0602 12.0780 12.9605 13.0573 k = 0.4683 0.3437 0.3938 ( 5112 PWs) bands (ev): -20.0206 -20.0206 -18.8629 -18.8620 -16.3144 -16.2855 -15.5266 -15.4901 -13.6641 -13.6619 -12.7911 -12.7872 -12.6871 -12.6861 -6.6675 -6.6633 -4.7729 -4.7658 -4.3006 -4.2190 -3.9628 -3.9533 -3.8282 -3.8058 -2.9516 -2.8692 -2.5802 -2.5484 -1.1640 -1.1510 -0.4895 -0.4792 -0.2146 -0.2117 0.5059 0.5111 0.6309 0.6325 1.5167 1.5193 1.9581 1.9594 2.4244 2.4268 2.9434 2.9448 3.1753 3.1786 3.3313 3.3322 3.8432 3.8489 3.9116 3.9169 4.0792 4.0799 9.2985 9.3030 10.8430 10.8569 10.9410 10.9761 11.0201 11.0259 12.0433 12.0665 12.9151 13.0227 k = 0.4603 0.3574 0.3938 ( 5116 PWs) bands (ev): -20.0206 -20.0206 -18.8608 -18.8596 -16.3194 -16.2834 -15.5367 -15.4914 -13.6638 -13.6611 -12.8006 -12.7961 -12.6747 -12.6735 -6.6532 -6.6481 -4.7747 -4.7657 -4.3363 -4.2377 -3.9613 -3.9512 -3.8332 -3.8076 -2.9428 -2.8464 -2.5640 -2.5241 -1.1810 -1.1650 -0.4945 -0.4820 -0.2084 -0.2048 0.4908 0.4974 0.5980 0.5999 1.5439 1.5468 1.9705 1.9721 2.4216 2.4245 2.9467 2.9483 3.1782 3.1823 3.3258 3.3268 3.8445 3.8512 3.9157 3.9219 4.0787 4.0795 9.3032 9.3087 10.8467 10.8652 10.9327 10.9675 11.0257 11.0287 12.0235 12.0519 12.8697 12.9848 k = 0.4524 0.3712 0.3938 ( 5116 PWs) bands (ev): -20.0206 -20.0206 -18.8582 -18.8568 -16.3246 -16.2818 -15.5476 -15.4938 -13.6633 -13.6602 -12.8096 -12.8046 -12.6622 -12.6607 -6.6357 -6.6298 -4.7769 -4.7658 -4.3759 -4.2617 -3.9595 -3.9493 -3.8378 -3.8102 -2.9303 -2.8231 -2.5436 -2.4957 -1.2014 -1.1826 -0.5001 -0.4855 -0.2010 -0.1967 0.4701 0.4781 0.5651 0.5671 1.5734 1.5763 1.9852 1.9872 2.4186 2.4219 2.9502 2.9519 3.1816 3.1866 3.3195 3.3207 3.8461 3.8535 3.9206 3.9275 4.0781 4.0791 9.3091 9.3155 10.8485 10.8727 10.9274 10.9580 11.0292 11.0354 12.0015 12.0345 12.8251 12.9457 k = 0.4444 0.3849 0.3938 ( 5108 PWs) bands (ev): -20.0205 -20.0205 -18.8552 -18.8536 -16.3301 -16.2805 -15.5592 -15.4971 -13.6627 -13.6592 -12.8180 -12.8126 -12.6498 -12.6480 -6.6152 -6.6087 -4.7796 -4.7661 -4.4185 -4.2901 -3.9576 -3.9477 -3.8420 -3.8132 -2.9149 -2.8000 -2.5194 -2.4634 -1.2251 -1.2037 -0.5060 -0.4895 -0.1925 -0.1874 0.4425 0.4511 0.5359 0.5373 1.6040 1.6067 2.0022 2.0044 2.4155 2.4190 2.9537 2.9554 3.1856 3.1913 3.3128 3.3139 3.8480 3.8559 3.9262 3.9335 4.0776 4.0787 9.3161 9.3234 10.8466 10.8786 10.9256 10.9480 11.0333 11.0447 11.9781 12.0152 12.7819 12.9063 k = 0.4365 0.3986 0.3938 ( 5116 PWs) bands (ev): -20.0205 -20.0205 -18.8519 -18.8501 -16.3358 -16.2797 -15.5713 -15.5011 -13.6619 -13.6581 -12.8259 -12.8200 -12.6376 -12.6356 -6.5919 -6.5848 -4.7827 -4.7667 -4.4635 -4.3222 -3.9557 -3.9463 -3.8457 -3.8165 -2.8970 -2.7773 -2.4919 -2.4275 -1.2522 -1.2285 -0.5123 -0.4939 -0.1827 -0.1770 0.4079 0.4168 0.5116 0.5118 1.6346 1.6372 2.0210 2.0235 2.4123 2.4160 2.9569 2.9586 3.1898 3.1963 3.3056 3.3068 3.8501 3.8582 3.9323 3.9398 4.0771 4.0784 9.3243 9.3324 10.8405 10.8825 10.9249 10.9389 11.0401 11.0559 11.9539 11.9945 12.7406 12.8675 k = 0.4286 0.4124 0.3938 ( 5108 PWs) bands (ev): -20.0205 -20.0205 -18.8483 -18.8462 -16.3417 -16.2793 -15.5836 -15.5058 -13.6610 -13.6570 -12.8332 -12.8269 -12.6258 -12.6235 -6.5660 -6.5584 -4.7865 -4.7676 -4.5101 -4.3569 -3.9541 -3.9450 -3.8488 -3.8199 -2.8773 -2.7551 -2.4614 -2.3887 -1.2823 -1.2569 -0.5187 -0.4987 -0.1719 -0.1655 0.3687 0.3777 0.4896 0.4909 1.6647 1.6669 2.0414 2.0442 2.4091 2.4128 2.9597 2.9614 3.1942 3.2014 3.2984 3.2995 3.8523 3.8604 3.9387 3.9463 4.0767 4.0783 9.3336 9.3423 10.8313 10.8847 10.9196 10.9340 11.0506 11.0695 11.9300 11.9732 12.7017 12.8301 k = 0.4206 0.4261 0.3938 ( 5106 PWs) bands (ev): -20.0204 -20.0204 -18.8444 -18.8422 -16.3478 -16.2794 -15.5958 -15.5109 -13.6600 -13.6558 -12.8399 -12.8333 -12.6145 -12.6119 -6.5377 -6.5298 -4.7911 -4.7691 -4.5576 -4.3933 -3.9527 -3.9439 -3.8513 -3.8231 -2.8563 -2.7336 -2.4286 -2.3473 -1.3154 -1.2888 -0.5251 -0.5037 -0.1600 -0.1529 0.3275 0.3368 0.4694 0.4719 1.6935 1.6953 2.0632 2.0662 2.4057 2.4096 2.9619 2.9635 3.1985 3.2063 3.2913 3.2924 3.8544 3.8625 3.9452 3.9527 4.0764 4.0782 9.3439 9.3531 10.8204 10.8849 10.9098 10.9313 11.0651 11.0851 11.9071 11.9520 12.6657 12.7947 k = 0.4127 0.4399 0.3938 ( 5114 PWs) bands (ev): -20.0204 -20.0204 -18.8405 -18.8381 -16.3540 -16.2800 -15.6079 -15.5162 -13.6589 -13.6546 -12.8459 -12.8390 -12.6038 -12.6010 -6.5073 -6.4992 -4.7969 -4.7714 -4.6050 -4.4303 -3.9517 -3.9427 -3.8534 -3.8263 -2.8345 -2.7128 -2.3940 -2.3041 -1.3512 -1.3241 -0.5316 -0.5088 -0.1471 -0.1393 0.2862 0.2959 0.4501 0.4536 1.7207 1.7222 2.0860 2.0892 2.4023 2.4061 2.9635 2.9651 3.2026 3.2108 3.2845 3.2858 3.8565 3.8644 3.9516 3.9590 4.0763 4.0783 9.3551 9.3647 10.8089 10.8830 10.8991 10.9273 11.0827 11.1023 11.8860 11.9314 12.6331 12.7619 k = 0.4048 0.4536 0.3938 ( 5110 PWs) bands (ev): -20.0204 -20.0204 -18.8364 -18.8339 -16.3602 -16.2810 -15.6194 -15.5215 -13.6577 -13.6534 -12.8514 -12.8442 -12.5939 -12.5909 -6.4755 -6.4671 -4.8040 -4.7752 -4.6507 -4.4669 -3.9510 -3.9417 -3.8551 -3.8292 -2.8124 -2.6929 -2.3583 -2.2596 -1.3891 -1.3625 -0.5379 -0.5140 -0.1332 -0.1247 0.2462 0.2564 0.4313 0.4355 1.7460 1.7471 2.1094 2.1129 2.3985 2.4023 2.9645 2.9660 3.2062 3.2145 3.2781 3.2798 3.8585 3.8661 3.9579 3.9651 4.0764 4.0786 9.3670 9.3769 10.7975 10.8780 10.8898 10.9214 11.1020 11.1204 11.8676 11.9123 12.6042 12.7323 k = 0.3968 0.4674 0.3938 ( 5098 PWs) bands (ev): -20.0203 -20.0203 -18.8324 -18.8297 -16.3663 -16.2825 -15.6302 -15.5268 -13.6565 -13.6522 -12.8562 -12.8488 -12.5847 -12.5816 -6.4427 -6.4340 -4.8131 -4.7826 -4.6919 -4.5019 -3.9506 -3.9406 -3.8563 -3.8319 -2.7901 -2.6739 -2.3222 -2.2144 -1.4288 -1.4034 -0.5441 -0.5191 -0.1182 -0.1092 0.2085 0.2189 0.4128 0.4176 1.7692 1.7700 2.1333 2.1369 2.3943 2.3981 2.9648 2.9665 3.2092 3.2174 3.2724 3.2747 3.8603 3.8676 3.9638 3.9708 4.0767 4.0790 9.3795 9.3895 10.7867 10.8692 10.8834 10.9140 11.1214 11.1386 11.8527 11.8953 12.5796 12.7064 k = 0.3889 0.4811 0.3938 ( 5096 PWs) bands (ev): -20.0203 -20.0203 -18.8285 -18.8256 -16.3723 -16.2843 -15.6401 -15.5318 -13.6552 -13.6510 -12.8604 -12.8528 -12.5765 -12.5733 -6.4096 -6.4004 -4.8249 -4.7974 -4.7233 -4.5343 -3.9504 -3.9397 -3.8572 -3.8344 -2.7681 -2.6561 -2.2864 -2.1691 -1.4696 -1.4462 -0.5500 -0.5241 -0.1024 -0.0927 0.1736 0.1841 0.3947 0.3998 1.7899 1.7908 2.1571 2.1608 2.3895 2.3933 2.9648 2.9665 3.2116 3.2192 3.2673 3.2706 3.8619 3.8689 3.9694 3.9761 4.0770 4.0795 9.3921 9.4021 10.7766 10.8581 10.8790 10.9059 11.1394 11.1561 11.8416 11.8809 12.5595 12.6847 k = 0.3810 0.4949 0.3938 ( 5096 PWs) bands (ev): -20.0203 -20.0203 -18.8248 -18.8218 -16.3780 -16.2864 -15.6490 -15.5364 -13.6540 -13.6499 -12.8641 -12.8562 -12.5693 -12.5660 -6.3772 -6.3672 -4.8425 -4.8198 -4.7409 -4.5630 -3.9504 -3.9389 -3.8579 -3.8365 -2.7468 -2.6398 -2.2518 -2.1243 -1.5111 -1.4896 -0.5555 -0.5288 -0.0858 -0.0755 0.1419 0.1523 0.3771 0.3824 1.8082 1.8092 2.1806 2.1844 2.3837 2.3877 2.9644 2.9663 3.2133 3.2200 3.2628 3.2675 3.8633 3.8699 3.9744 3.9810 4.0775 4.0801 9.4046 9.4145 10.7676 10.8467 10.8753 10.8976 11.1548 11.1721 11.8348 11.8696 12.5441 12.6675 k = 0.3730 0.5086 0.3938 ( 5100 PWs) bands (ev): -20.0203 -20.0203 -18.8214 -18.8182 -16.3833 -16.2886 -15.6566 -15.5405 -13.6529 -13.6489 -12.8671 -12.8591 -12.5631 -12.5597 -6.3464 -6.3353 -4.8699 -4.8397 -4.7492 -4.5873 -3.9504 -3.9382 -3.8583 -3.8383 -2.7265 -2.6254 -2.2194 -2.0808 -1.5531 -1.5313 -0.5605 -0.5331 -0.0686 -0.0578 0.1136 0.1237 0.3603 0.3658 1.8240 1.8252 2.2033 2.2071 2.3770 2.3811 2.9639 2.9659 3.2144 3.2200 3.2589 3.2652 3.8644 3.8707 3.9789 3.9854 4.0779 4.0806 9.4166 9.4264 10.7597 10.8356 10.8722 10.8897 11.1668 11.1860 11.8319 11.8617 12.5336 12.6550 k = 0.3651 0.5224 0.3938 ( 5100 PWs) bands (ev): -20.0202 -20.0202 -18.8184 -18.8151 -16.3880 -16.2909 -15.6629 -15.5440 -13.6518 -13.6480 -12.8696 -12.8615 -12.5580 -12.5546 -6.3183 -6.3058 -4.9013 -4.8559 -4.7534 -4.6068 -3.9506 -3.9377 -3.8586 -3.8398 -2.7077 -2.6133 -2.1903 -2.0396 -1.5954 -1.5685 -0.5649 -0.5369 -0.0510 -0.0396 0.0890 0.0983 0.3448 0.3502 1.8374 1.8386 2.2247 2.2285 2.3691 2.3737 2.9634 2.9656 3.2151 3.2195 3.2556 3.2635 3.8652 3.8713 3.9828 3.9893 4.0784 4.0810 9.4276 9.4372 10.7531 10.8253 10.8698 10.8827 11.1753 11.1971 11.8323 11.8572 12.5276 12.6471 k = 0.3571 0.5361 0.3938 ( 5096 PWs) bands (ev): -20.0202 -20.0202 -18.8159 -18.8125 -16.3920 -16.2930 -15.6679 -15.5468 -13.6509 -13.6472 -12.8715 -12.8633 -12.5540 -12.5506 -6.2942 -6.2802 -4.9300 -4.8702 -4.7558 -4.6215 -3.9507 -3.9373 -3.8587 -3.8410 -2.6910 -2.6040 -2.1660 -2.0024 -1.6360 -1.5994 -0.5686 -0.5401 -0.0338 -0.0216 0.0681 0.0762 0.3311 0.3363 1.8481 1.8494 2.2441 2.2479 2.3604 2.3656 2.9630 2.9654 3.2155 3.2188 3.2528 3.2622 3.8658 3.8718 3.9859 3.9925 4.0789 4.0814 9.4371 9.4465 10.7477 10.8165 10.8681 10.8772 11.1808 11.2049 11.8348 11.8558 12.5254 12.6432 k = 0.3492 0.5499 0.3938 ( 5112 PWs) bands (ev): -20.0202 -20.0202 -18.8140 -18.8106 -16.3951 -16.2947 -15.6714 -15.5488 -13.6502 -13.6467 -12.8728 -12.8646 -12.5512 -12.5477 -6.2755 -6.2600 -4.9527 -4.8819 -4.7573 -4.6317 -3.9509 -3.9370 -3.8588 -3.8419 -2.6772 -2.5976 -2.1476 -1.9715 -1.6712 -1.6223 -0.5714 -0.5425 -0.0178 -0.0044 0.0511 0.0572 0.3201 0.3248 1.8561 1.8572 2.2605 2.2644 2.3514 2.3575 2.9629 2.9654 3.2157 3.2181 3.2506 3.2611 3.8662 3.8720 3.9883 3.9949 4.0792 4.0816 9.4445 9.4538 10.7437 10.8096 10.8669 10.8733 11.1838 11.2096 11.8377 11.8568 12.5258 12.6423 k = 0.3413 0.5636 0.3938 ( 5112 PWs) bands (ev): -20.0202 -20.0202 -18.8128 -18.8093 -16.3970 -16.2960 -15.6735 -15.5500 -13.6498 -13.6463 -12.8736 -12.8654 -12.5495 -12.5460 -6.2634 -6.2468 -4.9673 -4.8897 -4.7581 -4.6378 -3.9510 -3.9369 -3.8588 -3.8423 -2.6677 -2.5941 -2.1364 -1.9508 -1.6956 -1.6364 -0.5732 -0.5441 -0.0053 0.0110 0.0391 0.0416 0.3127 0.3169 1.8613 1.8621 2.2721 2.2761 2.3440 2.3511 2.9629 2.9655 3.2158 3.2175 3.2492 3.2604 3.8664 3.8722 3.9898 3.9964 4.0794 4.0817 9.4494 9.4585 10.7413 10.8051 10.8662 10.8711 11.1851 11.2116 11.8401 11.8588 12.5272 12.6428 k = 0.3333 0.5774 0.3938 ( 5112 PWs) bands (ev): -20.0202 -20.0202 -18.8124 -18.8089 -16.3977 -16.2964 -15.6742 -15.5505 -13.6496 -13.6462 -12.8739 -12.8656 -12.5490 -12.5455 -6.2591 -6.2422 -4.9725 -4.8925 -4.7584 -4.6398 -3.9510 -3.9369 -3.8589 -3.8425 -2.6641 -2.5931 -2.1327 -1.9437 -1.7042 -1.6410 -0.5738 -0.5447 -0.0004 0.0202 0.0319 0.0354 0.3100 0.3139 1.8631 1.8637 2.2764 2.2804 2.3410 2.3486 2.9630 2.9655 3.2158 3.2172 3.2487 3.2602 3.8665 3.8722 3.9904 3.9970 4.0795 4.0817 9.4511 9.4602 10.7405 10.8036 10.8660 10.8704 11.1855 11.2120 11.8411 11.8599 12.5280 12.6432 k = 0.3333 0.5774 0.3938 ( 5112 PWs) bands (ev): -20.0202 -20.0202 -18.8124 -18.8089 -16.3977 -16.2964 -15.6742 -15.5505 -13.6496 -13.6462 -12.8739 -12.8656 -12.5490 -12.5455 -6.2591 -6.2422 -4.9725 -4.8925 -4.7584 -4.6398 -3.9510 -3.9369 -3.8589 -3.8425 -2.6641 -2.5931 -2.1327 -1.9437 -1.7042 -1.6410 -0.5738 -0.5447 -0.0004 0.0202 0.0319 0.0354 0.3100 0.3139 1.8631 1.8637 2.2764 2.2804 2.3410 2.3486 2.9630 2.9655 3.2158 3.2172 3.2487 3.2602 3.8665 3.8722 3.9904 3.9970 4.0795 4.0817 9.4511 9.4602 10.7405 10.8036 10.8660 10.8704 11.1855 11.2120 11.8411 11.8599 12.5280 12.6432 k = 0.3254 0.5636 0.3938 ( 5120 PWs) bands (ev): -20.0202 -20.0202 -18.8128 -18.8094 -16.3970 -16.2959 -15.6735 -15.5500 -13.6498 -13.6463 -12.8736 -12.8654 -12.5495 -12.5460 -6.2636 -6.2471 -4.9671 -4.8897 -4.7581 -4.6377 -3.9510 -3.9369 -3.8588 -3.8424 -2.6682 -2.5939 -2.1361 -1.9494 -1.6965 -1.6367 -0.5732 -0.5441 -0.0041 0.0132 0.0369 0.0395 0.3130 0.3174 1.8610 1.8620 2.2724 2.2766 2.3437 2.3508 2.9628 2.9654 3.2158 3.2176 3.2492 3.2605 3.8664 3.8722 3.9898 3.9964 4.0794 4.0817 9.4492 9.4583 10.7412 10.8052 10.8661 10.8711 11.1852 11.2121 11.8398 11.8583 12.5271 12.6428 k = 0.3175 0.5499 0.3938 ( 5120 PWs) bands (ev): -20.0202 -20.0202 -18.8142 -18.8108 -16.3946 -16.2941 -15.6716 -15.5488 -13.6503 -13.6467 -12.8729 -12.8646 -12.5511 -12.5477 -6.2775 -6.2623 -4.9511 -4.8814 -4.7570 -4.6308 -3.9508 -3.9370 -3.8588 -3.8419 -2.6808 -2.5967 -2.1453 -1.9616 -1.6771 -1.6249 -0.5711 -0.5422 -0.0117 0.0044 0.0399 0.0468 0.3226 0.3283 1.8547 1.8566 2.2628 2.2678 2.3493 2.3557 2.9623 2.9647 3.2162 3.2188 3.2507 3.2614 3.8663 3.8721 3.9880 3.9946 4.0791 4.0817 9.4434 9.4526 10.7432 10.8103 10.8663 10.8731 11.1847 11.2136 11.8353 11.8531 12.5248 12.6423 k = 0.3095 0.5361 0.3938 ( 5116 PWs) bands (ev): -20.0202 -20.0202 -18.8166 -18.8133 -16.3905 -16.2910 -15.6683 -15.5467 -13.6513 -13.6475 -12.8716 -12.8634 -12.5538 -12.5503 -6.3009 -6.2876 -4.9250 -4.8687 -4.7546 -4.6182 -3.9505 -3.9370 -3.8587 -3.8413 -2.7013 -2.6024 -2.1583 -1.9743 -1.6514 -1.6074 -0.5674 -0.5389 -0.0209 -0.0033 0.0402 0.0520 0.3392 0.3467 1.8438 1.8468 2.2509 2.2573 2.3548 2.3606 2.9609 2.9633 3.2173 3.2209 3.2531 3.2630 3.8661 3.8719 3.9850 3.9914 4.0787 4.0816 9.4332 9.4426 10.7456 10.8186 10.8669 10.8766 11.1843 11.2178 11.8260 11.8444 12.5227 12.6437 k = 0.3016 0.5224 0.3938 ( 5112 PWs) bands (ev): -20.0203 -20.0202 -18.8201 -18.8168 -16.3844 -16.2862 -15.6640 -15.5439 -13.6527 -13.6485 -12.8699 -12.8618 -12.5574 -12.5539 -6.3336 -6.3225 -4.8908 -4.8536 -4.7498 -4.5986 -3.9500 -3.9370 -3.8584 -3.8404 -2.7285 -2.6124 -2.1726 -1.9839 -1.6232 -1.5859 -0.5622 -0.5342 -0.0314 -0.0106 0.0384 0.0552 0.3628 0.3721 1.8281 1.8323 2.2392 2.2469 2.3588 2.3640 2.9587 2.9608 3.2196 3.2242 3.2562 3.2653 3.8658 3.8717 3.9806 3.9869 4.0780 4.0815 9.4185 9.4282 10.7468 10.8284 10.8690 10.8826 11.1850 11.2254 11.8106 11.8328 12.5227 12.6492 k = 0.2937 0.5086 0.3938 ( 5110 PWs) bands (ev): -20.0203 -20.0203 -18.8247 -18.8215 -16.3763 -16.2796 -15.6586 -15.5403 -13.6545 -13.6500 -12.8678 -12.8597 -12.5619 -12.5585 -6.3749 -6.3662 -4.8526 -4.8382 -4.7396 -4.5705 -3.9492 -3.9370 -3.8580 -3.8393 -2.7607 -2.6277 -2.1859 -1.9895 -1.5944 -1.5620 -0.5553 -0.5279 -0.0434 -0.0187 0.0359 0.0574 0.3925 0.4035 1.8074 1.8129 2.2288 2.2380 2.3602 2.3649 2.9553 2.9571 3.2234 3.2287 3.2597 3.2681 3.8655 3.8714 3.9750 3.9811 4.0771 4.0812 9.3993 9.4093 10.7451 10.8349 10.8761 10.8928 11.1877 11.2364 11.7890 11.8188 12.5270 12.6605 k = 0.2857 0.4949 0.3938 ( 5110 PWs) bands (ev): -20.0203 -20.0203 -18.8304 -18.8273 -16.3660 -16.2711 -15.6522 -15.5360 -13.6568 -13.6518 -12.8652 -12.8573 -12.5673 -12.5639 -6.4243 -6.4175 -4.8248 -4.8183 -4.7168 -4.5332 -3.9482 -3.9368 -3.8573 -3.8380 -2.7965 -2.6485 -2.1964 -1.9911 -1.5662 -1.5370 -0.5467 -0.5201 -0.0568 -0.0288 0.0345 0.0594 0.4275 0.4399 1.7821 1.7888 2.2207 2.2312 2.3587 2.3630 2.9508 2.9523 3.2288 3.2346 3.2636 3.2712 3.8650 3.8709 3.9681 3.9740 4.0760 4.0806 9.3756 9.3860 10.7390 10.8324 10.8927 10.9089 11.1935 11.2507 11.7623 11.8026 12.5368 12.6786 k = 0.2778 0.4811 0.3938 ( 5106 PWs) bands (ev): -20.0204 -20.0204 -18.8372 -18.8343 -16.3535 -16.2606 -15.6449 -15.5310 -13.6595 -13.6541 -12.8623 -12.8544 -12.5734 -12.5701 -6.4809 -6.4752 -4.8136 -4.7974 -4.6743 -4.4871 -3.9467 -3.9364 -3.8561 -3.8365 -2.8345 -2.6742 -2.2032 -1.9895 -1.5393 -1.5117 -0.5365 -0.5107 -0.0715 -0.0412 0.0349 0.0618 0.4672 0.4807 1.7526 1.7602 2.2151 2.2267 2.3541 2.3579 2.9452 2.9465 3.2357 3.2418 3.2676 3.2746 3.8643 3.8702 3.9601 3.9658 4.0746 4.0796 9.3477 9.3583 10.7280 10.8213 10.9175 10.9313 11.2029 11.2680 11.7320 11.7843 12.5531 12.7037 k = 0.2698 0.4674 0.3938 ( 5106 PWs) bands (ev): -20.0204 -20.0204 -18.8451 -18.8424 -16.3387 -16.2479 -15.6368 -15.5255 -13.6628 -13.6567 -12.8590 -12.8513 -12.5802 -12.5769 -6.5439 -6.5384 -4.8053 -4.7868 -4.6157 -4.4333 -3.9448 -3.9357 -3.8543 -3.8347 -2.8737 -2.7038 -2.2065 -1.9855 -1.5140 -1.4869 -0.5249 -0.5000 -0.0875 -0.0557 0.0372 0.0649 0.5107 0.5252 1.7196 1.7280 2.2120 2.2245 2.3462 2.3496 2.9386 2.9399 3.2439 3.2502 3.2715 3.2781 3.8632 3.8690 3.9514 3.9567 4.0728 4.0782 9.3156 9.3265 10.7122 10.8035 10.9480 10.9595 11.2160 11.2879 11.6995 11.7647 12.5759 12.7353 k = 0.2619 0.4536 0.3938 ( 5106 PWs) bands (ev): -20.0205 -20.0205 -18.8542 -18.8516 -16.3217 -16.2329 -15.6280 -15.5193 -13.6664 -13.6599 -12.8555 -12.8478 -12.5877 -12.5844 -6.6124 -6.6062 -4.7994 -4.7812 -4.5482 -4.3737 -3.9423 -3.9346 -3.8516 -3.8324 -2.9129 -2.7361 -2.2066 -1.9795 -1.4905 -1.4630 -0.5122 -0.4881 -0.1044 -0.0715 0.0410 0.0687 0.5576 0.5729 1.6841 1.6931 2.2113 2.2246 2.3349 2.3380 2.9313 2.9327 3.2531 3.2594 3.2753 3.2815 3.8613 3.8669 3.9421 3.9470 4.0706 4.0763 9.2797 9.2907 10.6921 10.7802 10.9830 10.9927 11.2324 11.3101 11.6661 11.7448 12.6049 12.7728 k = 0.2540 0.4399 0.3938 ( 5110 PWs) bands (ev): -20.0206 -20.0206 -18.8643 -18.8619 -16.3023 -16.2158 -15.6185 -15.5126 -13.6705 -13.6634 -12.8516 -12.8441 -12.5956 -12.5925 -6.6853 -6.6782 -4.7952 -4.7777 -4.4758 -4.3104 -3.9391 -3.9329 -3.8472 -3.8293 -2.9514 -2.7696 -2.2041 -1.9722 -1.4691 -1.4404 -0.4987 -0.4756 -0.1217 -0.0882 0.0460 0.0731 0.6075 0.6235 1.6470 1.6565 2.2126 2.2265 2.3205 2.3231 2.9234 2.9251 3.2631 3.2691 3.2788 3.2848 3.8583 3.8635 3.9330 3.9373 4.0679 4.0738 9.2401 9.2512 10.6681 10.7519 11.0218 11.0301 11.2515 11.3341 11.6332 11.7254 12.6394 12.8150 k = 0.2460 0.4261 0.3938 ( 5108 PWs) bands (ev): -20.0207 -20.0207 -18.8754 -18.8732 -16.2806 -16.1964 -15.6085 -15.5055 -13.6751 -13.6674 -12.8476 -12.8402 -12.6041 -12.6010 -6.7617 -6.7538 -4.7924 -4.7753 -4.4011 -4.2463 -3.9349 -3.9306 -3.8402 -3.8248 -2.9885 -2.8033 -2.1998 -1.9639 -1.4496 -1.4193 -0.4851 -0.4629 -0.1393 -0.1053 0.0520 0.0783 0.6600 0.6765 1.6095 1.6193 2.2156 2.2299 2.3029 2.3052 2.9152 2.9174 3.2732 3.2782 3.2828 3.2882 3.8534 3.8581 3.9247 3.9281 4.0646 4.0707 9.1972 9.2082 10.6407 10.7193 11.0638 11.0711 11.2728 11.3594 11.6020 11.7075 12.6784 12.8607 k = 0.2381 0.4124 0.3938 ( 5108 PWs) bands (ev): -20.0208 -20.0208 -18.8875 -18.8854 -16.2566 -16.1748 -15.5980 -15.4979 -13.6801 -13.6718 -12.8434 -12.8361 -12.6129 -12.6100 -6.8411 -6.8326 -4.7905 -4.7737 -4.3264 -4.1844 -3.9297 -3.9274 -3.8295 -3.8170 -3.0235 -2.8363 -2.1941 -1.9550 -1.4322 -1.3998 -0.4723 -0.4510 -0.1567 -0.1225 0.0592 0.0844 0.7148 0.7316 1.5725 1.5826 2.2196 2.2343 2.2828 2.2846 2.9068 2.9095 3.2815 3.2834 3.2897 3.2936 3.8460 3.8502 3.9180 3.9203 4.0608 4.0670 9.1511 9.1620 10.6100 10.6830 11.1085 11.1150 11.2954 11.3850 11.5740 11.6919 12.7207 12.9080 k = 0.2302 0.3986 0.3938 ( 5104 PWs) bands (ev): -20.0209 -20.0209 -18.9004 -18.8985 -16.2305 -16.1511 -15.5870 -15.4900 -13.6854 -13.6767 -12.8391 -12.8318 -12.6220 -12.6192 -6.9228 -6.9139 -4.7891 -4.7725 -4.2539 -4.1289 -3.9239 -3.9231 -3.8161 -3.8004 -3.0558 -2.8678 -2.1876 -1.9458 -1.4168 -1.3820 -0.4612 -0.4410 -0.1738 -0.1397 0.0680 0.0919 0.7716 0.7887 1.5371 1.5474 2.2234 2.2376 2.2620 2.2627 2.8984 2.9015 3.2840 3.2875 3.2984 3.3030 3.8356 3.8394 3.9131 3.9143 4.0564 4.0627 9.1021 9.1128 10.5766 10.6435 11.1553 11.1612 11.3186 11.4087 11.5518 11.6794 12.7648 12.9548 k = 0.2222 0.3849 0.3938 ( 5108 PWs) bands (ev): -20.0210 -20.0210 -18.9141 -18.9124 -16.2023 -16.1253 -15.5757 -15.4818 -13.6912 -13.6819 -12.8347 -12.8276 -12.6313 -12.6287 -7.0063 -6.9972 -4.7881 -4.7717 -4.1869 -4.0838 -3.9185 -3.9174 -3.8003 -3.7683 -3.0852 -2.8972 -2.1805 -1.9364 -1.4032 -1.3659 -0.4529 -0.4339 -0.1907 -0.1570 0.0790 0.1016 0.8301 0.8474 1.5043 1.5147 2.2199 2.2265 2.2464 2.2542 2.8899 2.8935 3.2848 3.2890 3.3086 3.3132 3.8223 3.8260 3.9098 3.9103 4.0514 4.0577 9.0504 9.0607 10.5406 10.6013 11.2033 11.2091 11.3415 11.4259 11.5405 11.6710 12.8091 12.9981 k = 0.2143 0.3712 0.3938 ( 5108 PWs) bands (ev): -20.0211 -20.0211 -18.9284 -18.9269 -16.1722 -16.0976 -15.5641 -15.4733 -13.6973 -13.6875 -12.8303 -12.8233 -12.6408 -12.6384 -7.0913 -7.0822 -4.7874 -4.7712 -4.1289 -4.0508 -3.9140 -3.9108 -3.7770 -3.7207 -3.1110 -2.9242 -2.1731 -1.9271 -1.3913 -1.3514 -0.4485 -0.4309 -0.2077 -0.1750 0.0934 0.1144 0.8899 0.9073 1.4749 1.4855 2.1981 2.2004 2.2470 2.2597 2.8813 2.8853 3.2846 3.2892 3.3189 3.3233 3.8066 3.8105 3.9074 3.9081 4.0458 4.0520 8.9960 9.0060 10.5024 10.5571 11.2512 11.2579 11.3635 11.4310 11.5463 11.6676 12.8516 13.0346 k = 0.2063 0.3574 0.3938 ( 5108 PWs) bands (ev): -20.0213 -20.0212 -18.9434 -18.9420 -16.1402 -16.0680 -15.5522 -15.4646 -13.7037 -13.6934 -12.8260 -12.8190 -12.6504 -12.6481 -7.1773 -7.1684 -4.7868 -4.7709 -4.0832 -4.0284 -3.9107 -3.9045 -3.7420 -3.6601 -3.1330 -2.9483 -2.1656 -1.9179 -1.3810 -1.3385 -0.4488 -0.4326 -0.2259 -0.1947 0.1122 0.1317 0.9507 0.9682 1.4497 1.4605 2.1690 2.1706 2.2537 2.2675 2.8725 2.8769 3.2834 3.2884 3.3290 3.3331 3.7892 3.7933 3.9058 3.9068 4.0395 4.0457 8.9392 8.9488 10.4624 10.5114 11.2958 11.3060 11.3854 11.4267 11.5685 11.6704 12.8901 13.0613 k = 0.1984 0.3437 0.3938 ( 5116 PWs) bands (ev): -20.0214 -20.0214 -18.9588 -18.9576 -16.1065 -16.0367 -15.5401 -15.4558 -13.7104 -13.6997 -12.8217 -12.8148 -12.6600 -12.6579 -7.2640 -7.2554 -4.7864 -4.7708 -4.0505 -4.0134 -3.9088 -3.8993 -3.6938 -3.5906 -3.1504 -2.9694 -2.1582 -1.9090 -1.3721 -1.3270 -0.4540 -0.4391 -0.2464 -0.2171 0.1366 0.1545 1.0121 1.0295 1.4294 1.4406 2.1373 2.1388 2.2618 2.2760 2.8633 2.8681 3.2812 3.2865 3.3387 3.3425 3.7706 3.7749 3.9047 3.9059 4.0327 4.0388 8.8801 8.8892 10.4209 10.4645 11.3294 11.3481 11.4112 11.4265 11.6001 11.6802 12.9225 13.0762 k = 0.1905 0.3299 0.3938 ( 5116 PWs) bands (ev): -20.0215 -20.0215 -18.9746 -18.9735 -16.0713 -16.0040 -15.5278 -15.4468 -13.7173 -13.7062 -12.8176 -12.8108 -12.6695 -12.6677 -7.3509 -7.3427 -4.7861 -4.7709 -4.0286 -4.0032 -3.9078 -3.8958 -3.6351 -3.5158 -3.1627 -2.9871 -2.1511 -1.9006 -1.3644 -1.3168 -0.4641 -0.4501 -0.2705 -0.2433 0.1673 0.1837 1.0733 1.0906 1.4148 1.4262 2.1042 2.1058 2.2705 2.2849 2.8536 2.8587 3.2779 3.2837 3.3479 3.3514 3.7513 3.7558 3.9040 3.9052 4.0254 4.0313 8.8189 8.8275 10.3785 10.4171 11.3411 11.3716 11.4463 11.4512 11.6369 11.6974 12.9473 13.0797 k = 0.1825 0.3162 0.3938 ( 5120 PWs) bands (ev): -20.0217 -20.0217 -18.9906 -18.9897 -16.0348 -15.9699 -15.5155 -15.4378 -13.7245 -13.7130 -12.8137 -12.8069 -12.6790 -12.6774 -7.4378 -7.4301 -4.7858 -4.7710 -4.0140 -3.9959 -3.9077 -3.8940 -3.5702 -3.4387 -3.1687 -3.0014 -2.1444 -1.8927 -1.3577 -1.3077 -0.4785 -0.4649 -0.2991 -0.2742 0.2045 0.2195 1.1336 1.1505 1.4065 1.4183 2.0703 2.0720 2.2795 2.2940 2.8431 2.8484 3.2736 3.2799 3.3566 3.3598 3.7315 3.7364 3.9032 3.9045 4.0175 4.0233 8.7557 8.7638 10.3354 10.3694 11.3345 11.3775 11.4913 11.4963 11.6771 11.7217 12.9636 13.0740 k = 0.1746 0.3024 0.3938 ( 5132 PWs) bands (ev): -20.0218 -20.0218 -19.0068 -19.0060 -15.9971 -15.9347 -15.5030 -15.4287 -13.7317 -13.7200 -12.8100 -12.8033 -12.6884 -12.6869 -7.5242 -7.5171 -4.7856 -4.7713 -4.0041 -3.9904 -3.9081 -3.8935 -3.5040 -3.3617 -3.1662 -3.0121 -2.1382 -1.8856 -1.3519 -1.2997 -0.4967 -0.4829 -0.3325 -0.3099 0.2479 0.2616 1.1913 1.2076 1.4059 1.4177 2.0360 2.0380 2.2885 2.3030 2.8315 2.8371 3.2683 3.2751 3.3648 3.3678 3.7117 3.7169 3.9023 3.9035 4.0091 4.0148 8.6907 8.6983 10.2920 10.3219 11.3203 11.3750 11.5421 11.5466 11.7199 11.7523 12.9715 13.0614 k = 0.1667 0.2887 0.3938 ( 5134 PWs) bands (ev): -20.0220 -20.0220 -19.0230 -19.0223 -15.9584 -15.8986 -15.4906 -15.4196 -13.7391 -13.7272 -12.8067 -12.7999 -12.6976 -12.6962 -7.6098 -7.6033 -4.7854 -4.7716 -3.9970 -3.9862 -3.9090 -3.8940 -3.4410 -3.2876 -3.1514 -3.0190 -2.1326 -1.8793 -1.3468 -1.2925 -0.5179 -0.5035 -0.3705 -0.3502 0.2970 0.3096 1.2441 1.2591 1.4150 1.4261 2.0022 2.0044 2.2974 2.3119 2.8187 2.8244 3.2621 3.2695 3.3726 3.3753 3.6921 3.6975 3.9012 3.9023 4.0003 4.0058 8.6241 8.6313 10.2487 10.2749 11.3034 11.3675 11.5946 11.5984 11.7647 11.7883 12.9722 13.0443 k = 0.1587 0.2749 0.3938 ( 5142 PWs) bands (ev): -20.0221 -20.0221 -19.0392 -19.0386 -15.9191 -15.8618 -15.4781 -15.4106 -13.7466 -13.7345 -12.8036 -12.7968 -12.7067 -12.7051 -7.6944 -7.6885 -4.7852 -4.7720 -3.9917 -3.9827 -3.9102 -3.8952 -3.3863 -3.2200 -3.1185 -3.0217 -2.1277 -1.8740 -1.3421 -1.2861 -0.5417 -0.5263 -0.4128 -0.3947 0.3512 0.3628 1.2889 1.3012 1.4365 1.4459 1.9695 1.9719 2.3061 2.3205 2.8043 2.8100 3.2551 3.2630 3.3801 3.3825 3.6729 3.6787 3.8997 3.9007 3.9911 3.9964 8.5561 8.5629 10.2057 10.2286 11.2855 11.3561 11.6473 11.6506 11.8115 11.8286 12.9668 13.0243 k = 0.1508 0.2612 0.3938 ( 5138 PWs) bands (ev): -20.0223 -20.0223 -19.0552 -19.0547 -15.8793 -15.8247 -15.4656 -15.4017 -13.7540 -13.7418 -12.8009 -12.7941 -12.7155 -12.7137 -7.7775 -7.7722 -4.7850 -4.7724 -3.9875 -3.9798 -3.9116 -3.8970 -3.3435 -3.1600 -3.0657 -3.0191 -2.1235 -1.8700 -1.3378 -1.2803 -0.5678 -0.5511 -0.4586 -0.4424 0.4100 0.4207 1.3233 1.3323 1.4706 1.4778 1.9390 1.9418 2.3145 2.3288 2.7880 2.7936 3.2475 3.2559 3.3872 3.3895 3.6543 3.6604 3.8979 3.8987 3.9815 3.9865 8.4871 8.4934 10.1634 10.1833 11.2670 11.3418 11.6996 11.7024 11.8599 11.8725 12.9567 13.0025 k = 0.1429 0.2474 0.3938 ( 5132 PWs) bands (ev): -20.0225 -20.0224 -19.0709 -19.0705 -15.8392 -15.7873 -15.4531 -15.3929 -13.7614 -13.7492 -12.7986 -12.7917 -12.7242 -12.7219 -7.8589 -7.8542 -4.7848 -4.7728 -3.9840 -3.9773 -3.9132 -3.8992 -3.3121 -3.1050 -3.0110 -2.9978 -2.1203 -1.8673 -1.3337 -1.2751 -0.5960 -0.5776 -0.5074 -0.4919 0.4727 0.4825 1.3489 1.3560 1.5117 1.5178 1.9124 1.9155 2.3224 2.3366 2.7695 2.7749 3.2395 3.2482 3.3941 3.3962 3.6365 3.6429 3.8956 3.8963 3.9717 3.9764 8.4173 8.4232 10.1221 10.1393 11.2483 11.3254 11.7510 11.7535 11.9098 11.9193 12.9432 12.9796 k = 0.1349 0.2337 0.3938 ( 5134 PWs) bands (ev): -20.0226 -20.0226 -19.0863 -19.0860 -15.7992 -15.7502 -15.4407 -15.3842 -13.7687 -13.7566 -12.7968 -12.7897 -12.7325 -12.7297 -7.9381 -7.9341 -4.7846 -4.7733 -3.9810 -3.9752 -3.9149 -3.9017 -3.2880 -3.0607 -2.9831 -2.9285 -2.1180 -1.8662 -1.3298 -1.2702 -0.6268 -0.6057 -0.5583 -0.5417 0.5387 0.5477 1.3698 1.3765 1.5529 1.5585 1.8923 1.8960 2.3298 2.3439 2.7486 2.7537 3.2313 3.2401 3.4008 3.4028 3.6197 3.6263 3.8928 3.8935 3.9615 3.9660 8.3471 8.3525 10.0818 10.0967 11.2294 11.3073 11.8012 11.8034 11.9609 11.9684 12.9272 12.9562 k = 0.1270 0.2199 0.3938 ( 5122 PWs) bands (ev): -20.0228 -20.0228 -19.1013 -19.1010 -15.7595 -15.7134 -15.4283 -15.3756 -13.7759 -13.7639 -12.7953 -12.7881 -12.7404 -12.7371 -8.0150 -8.0115 -4.7845 -4.7738 -3.9784 -3.9732 -3.9167 -3.9043 -3.2670 -3.0342 -2.9339 -2.8574 -2.1167 -1.8670 -1.3257 -1.2657 -0.6609 -0.6355 -0.6106 -0.5895 0.6075 0.6158 1.3891 1.3960 1.5871 1.5921 1.8829 1.8872 2.3366 2.3505 2.7251 2.7298 3.2230 3.2319 3.4075 3.4093 3.6040 3.6107 3.8896 3.8903 3.9511 3.9554 8.2768 8.2819 10.0428 10.0556 11.2108 11.2880 11.8501 11.8521 12.0133 12.0195 12.9094 12.9326 k = 0.1190 0.2062 0.3938 ( 5130 PWs) bands (ev): -20.0229 -20.0229 -19.1157 -19.1155 -15.7204 -15.6775 -15.4159 -15.3672 -13.7829 -13.7711 -12.7943 -12.7869 -12.7480 -12.7441 -8.0891 -8.0862 -4.7843 -4.7743 -3.9761 -3.9715 -3.9185 -3.9070 -3.2468 -3.0160 -2.8735 -2.7875 -2.1164 -1.8698 -1.3216 -1.2614 -0.6997 -0.6682 -0.6616 -0.6334 0.6787 0.6863 1.4081 1.4153 1.6081 1.6124 1.8887 1.8937 2.3428 2.3564 2.6987 2.7029 3.2149 3.2237 3.4141 3.4159 3.5893 3.5961 3.8859 3.8866 3.9406 3.9446 8.2069 8.2116 10.0054 10.0163 11.1923 11.2678 11.8972 11.8990 12.0668 12.0720 12.8905 12.9090 k = 0.1111 0.1925 0.3938 ( 5136 PWs) bands (ev): -20.0231 -20.0231 -19.1296 -19.1294 -15.6823 -15.6426 -15.4035 -15.3589 -13.7896 -13.7781 -12.7937 -12.7861 -12.7552 -12.7506 -8.1602 -8.1578 -4.7842 -4.7749 -3.9740 -3.9700 -3.9204 -3.9098 -3.2259 -2.9988 -2.8106 -2.7196 -2.1171 -1.8749 -1.3172 -1.2574 -0.7436 -0.7160 -0.6975 -0.6726 0.7518 0.7588 1.4275 1.4349 1.6134 1.6170 1.9112 1.9168 2.3483 2.3616 2.6695 2.6730 3.2072 3.2156 3.4207 3.4224 3.5757 3.5825 3.8818 3.8825 3.9300 3.9338 8.1378 8.1421 9.9696 9.9789 11.1743 11.2472 11.9423 11.9441 12.1211 12.1257 12.8710 12.8858 k = 0.1032 0.1787 0.3938 ( 5124 PWs) bands (ev): -20.0232 -20.0232 -19.1428 -19.1426 -15.6453 -15.6092 -15.3910 -15.3507 -13.7960 -13.7849 -12.7935 -12.7856 -12.7619 -12.7566 -8.2280 -8.2260 -4.7840 -4.7754 -3.9720 -3.9686 -3.9221 -3.9125 -3.2037 -2.9807 -2.7485 -2.6545 -2.1186 -1.8826 -1.3126 -1.2536 -0.7908 -0.7653 -0.7304 -0.7085 0.8264 0.8327 1.4471 1.4546 1.6061 1.6093 1.9470 1.9527 2.3531 2.3661 2.6373 2.6402 3.1999 3.2079 3.4274 3.4290 3.5633 3.5700 3.8774 3.8781 3.9194 3.9229 8.0700 8.0740 9.9356 9.9435 11.1569 11.2265 11.9853 11.9870 12.1761 12.1802 12.8512 12.8631 k = 0.0952 0.1650 0.3938 ( 5120 PWs) bands (ev): -20.0233 -20.0233 -19.1552 -19.1551 -15.6100 -15.5776 -15.3784 -15.3427 -13.8022 -13.7915 -12.7936 -12.7855 -12.7682 -12.7622 -8.2921 -8.2905 -4.7839 -4.7759 -3.9703 -3.9673 -3.9238 -3.9151 -3.1798 -2.9610 -2.6887 -2.5927 -2.1209 -1.8931 -1.3075 -1.2499 -0.8387 -0.8122 -0.7634 -0.7427 0.9019 0.9077 1.4668 1.4742 1.5911 1.5942 1.9904 1.9959 2.3573 2.3699 2.6023 2.6045 3.1932 3.2006 3.4342 3.4357 3.5520 3.5586 3.8726 3.8734 3.9089 3.9121 8.0041 8.0077 9.9035 9.9102 11.1402 11.2060 12.0259 12.0275 12.2314 12.2351 12.8316 12.8412 k = 0.0873 0.1512 0.3938 ( 5124 PWs) bands (ev): -20.0235 -20.0235 -19.1669 -19.1668 -15.5766 -15.5482 -15.3657 -15.3347 -13.8079 -13.7978 -12.7942 -12.7858 -12.7740 -12.7674 -8.3523 -8.3510 -4.7837 -4.7765 -3.9686 -3.9662 -3.9254 -3.9176 -3.1541 -2.9399 -2.6322 -2.5347 -2.1235 -1.9066 -1.3020 -1.2462 -0.8850 -0.8560 -0.7966 -0.7763 0.9779 0.9832 1.4862 1.4934 1.5726 1.5757 2.0371 2.0423 2.3607 2.3729 2.5645 2.5661 3.1870 3.1938 3.4410 3.4424 3.5419 3.5481 3.8676 3.8685 3.8985 3.9015 7.9405 7.9438 9.8735 9.8791 11.1245 11.1859 12.0640 12.0654 12.2866 12.2901 12.8124 12.8201 k = 0.0794 0.1375 0.3938 ( 5122 PWs) bands (ev): -20.0236 -20.0236 -19.1778 -19.1777 -15.5455 -15.5214 -15.3528 -15.3266 -13.8132 -13.8037 -12.7950 -12.7865 -12.7791 -12.7720 -8.4083 -8.4073 -4.7835 -4.7770 -3.9672 -3.9652 -3.9269 -3.9200 -3.1266 -2.9176 -2.5798 -2.4807 -2.1260 -1.9231 -1.2959 -1.2425 -0.9283 -0.8964 -0.8298 -0.8096 1.0541 1.0589 1.5046 1.5113 1.5532 1.5569 2.0843 2.0891 2.3636 2.3752 2.5242 2.5253 3.1814 3.1876 3.4477 3.4491 3.5327 3.5386 3.8625 3.8633 3.8885 3.8911 7.8798 7.8828 9.8457 9.8504 11.1098 11.1666 12.0992 12.1006 12.3413 12.3446 12.7940 12.8002 k = 0.0714 0.1237 0.3938 ( 5114 PWs) bands (ev): -20.0237 -20.0237 -19.1877 -19.1877 -15.5170 -15.4973 -15.3398 -15.3186 -13.8181 -13.8093 -12.7960 -12.7878 -12.7834 -12.7762 -8.4598 -8.4591 -4.7834 -4.7775 -3.9659 -3.9644 -3.9282 -3.9222 -3.0976 -2.8949 -2.5323 -2.4313 -2.1278 -1.9428 -1.2892 -1.2386 -0.9676 -0.9330 -0.8629 -0.8427 1.1298 1.1342 1.5182 1.5226 1.5379 1.5441 2.1301 2.1345 2.3658 2.3769 2.4817 2.4827 3.1765 3.1819 3.4545 3.4557 3.5246 3.5301 3.8573 3.8582 3.8787 3.8811 7.8226 7.8253 9.8202 9.8240 11.0964 11.1482 12.1316 12.1328 12.3950 12.3982 12.7766 12.7815 k = 0.0635 0.1100 0.3938 ( 5122 PWs) bands (ev): -20.0238 -20.0238 -19.1968 -19.1967 -15.4916 -15.4762 -15.3268 -15.3104 -13.8225 -13.8145 -12.7972 -12.7902 -12.7862 -12.7800 -8.5067 -8.5062 -4.7832 -4.7780 -3.9648 -3.9636 -3.9294 -3.9242 -3.0673 -2.8724 -2.4906 -2.3867 -2.1283 -1.9652 -1.2818 -1.2343 -1.0022 -0.9656 -0.8957 -0.8756 1.2045 1.2085 1.5104 1.5108 1.5456 1.5526 2.1729 2.1771 2.3673 2.3779 2.4377 2.4390 3.1721 3.1769 3.4610 3.4622 3.5174 3.5225 3.8522 3.8530 3.8695 3.8715 7.7695 7.7719 9.7970 9.8002 11.0844 11.1309 12.1609 12.1620 12.4469 12.4501 12.7604 12.7642 k = 0.0556 0.0962 0.3938 ( 5130 PWs) bands (ev): -20.0239 -20.0239 -19.2048 -19.2048 -15.4694 -15.4581 -15.3140 -15.3021 -13.8264 -13.8192 -12.7985 -12.7933 -12.7879 -12.7833 -8.5486 -8.5482 -4.7830 -4.7785 -3.9638 -3.9630 -3.9304 -3.9260 -3.0359 -2.8510 -2.4549 -2.3472 -2.1268 -1.9900 -1.2735 -1.2293 -1.0318 -0.9941 -0.9279 -0.9081 1.2776 1.2811 1.4940 1.4948 1.5608 1.5671 2.2111 2.2154 2.3665 2.3783 2.3942 2.3965 3.1684 3.1724 3.4673 3.4684 3.5112 3.5158 3.8472 3.8480 3.8609 3.8626 7.7210 7.7232 9.7764 9.7790 11.0739 11.1149 12.1870 12.1880 12.4963 12.4995 12.7456 12.7486 k = 0.0476 0.0825 0.3938 ( 5128 PWs) bands (ev): -20.0240 -20.0240 -19.2119 -19.2118 -15.4507 -15.4428 -15.3018 -15.2939 -13.8297 -13.8234 -12.7997 -12.7963 -12.7892 -12.7862 -8.5853 -8.5851 -4.7828 -4.7789 -3.9630 -3.9625 -3.9313 -3.9276 -3.0038 -2.8320 -2.4253 -2.3133 -2.1232 -2.0163 -1.2644 -1.2230 -1.0566 -1.0185 -0.9589 -0.9399 1.3480 1.3511 1.4789 1.4799 1.5753 1.5809 2.2409 2.2468 2.3446 2.3539 2.3751 2.3803 3.1652 3.1686 3.4732 3.4741 3.5059 3.5099 3.8425 3.8433 3.8532 3.8545 7.6778 7.6796 9.7583 9.7604 11.0650 11.1004 12.2099 12.2108 12.5422 12.5454 12.7325 12.7348 k = 0.0397 0.0687 0.3938 ( 5132 PWs) bands (ev): -20.0241 -20.0241 -19.2179 -19.2179 -15.4355 -15.4304 -15.2907 -15.2858 -13.8324 -13.8271 -12.8010 -12.7989 -12.7904 -12.7886 -8.6168 -8.6167 -4.7826 -4.7794 -3.9624 -3.9621 -3.9319 -3.9289 -2.9716 -2.8168 -2.4006 -2.2859 -2.1180 -2.0425 -1.2543 -1.2151 -1.0769 -1.0391 -0.9880 -0.9707 1.4140 1.4163 1.4667 1.4682 1.5884 1.5932 2.2508 2.2582 2.3190 2.3281 2.3752 2.3802 3.1626 3.1653 3.4785 3.4794 3.5015 3.5050 3.8382 3.8389 3.8464 3.8474 7.6402 7.6417 9.7429 9.7445 11.0578 11.0875 12.2295 12.2302 12.5837 12.5868 12.7213 12.7230 k = 0.0317 0.0550 0.3938 ( 5128 PWs) bands (ev): -20.0241 -20.0241 -19.2228 -19.2228 -15.4236 -15.4204 -15.2809 -15.2784 -13.8346 -13.8303 -12.8021 -12.8010 -12.7915 -12.7906 -8.6427 -8.6427 -4.7824 -4.7798 -3.9619 -3.9617 -3.9324 -3.9301 -2.9397 -2.8067 -2.3791 -2.2663 -2.1122 -2.0666 -1.2431 -1.2054 -1.0937 -1.0564 -1.0141 -0.9999 1.4490 1.4490 1.4829 1.4860 1.5995 1.6035 2.2279 2.2318 2.3257 2.3306 2.3772 2.3810 3.1605 3.1627 3.4832 3.4839 3.4980 3.5008 3.8344 3.8350 3.8407 3.8414 7.6087 7.6100 9.7302 9.7315 11.0523 11.0762 12.2457 12.2463 12.6194 12.6223 12.7123 12.7134 k = 0.0238 0.0412 0.3938 ( 5112 PWs) bands (ev): -20.0242 -20.0242 -19.2267 -19.2267 -15.4148 -15.4128 -15.2730 -15.2719 -13.8362 -13.8329 -12.8031 -12.8026 -12.7925 -12.7921 -8.6631 -8.6630 -4.7821 -4.7802 -3.9616 -3.9615 -3.9327 -3.9310 -2.9090 -2.8029 -2.3585 -2.2570 -2.1071 -2.0855 -1.2306 -1.1945 -1.1079 -1.0709 -1.0359 -1.0264 1.4427 1.4430 1.5354 1.5378 1.6086 1.6117 2.1924 2.1941 2.3406 2.3424 2.3805 2.3827 3.1590 3.1606 3.4871 3.4876 3.4953 3.4975 3.8311 3.8316 3.8364 3.8367 7.5839 7.5848 9.7203 9.7212 11.0487 11.0667 12.2584 12.2589 12.6480 12.6506 12.7059 12.7066 k = 0.0159 0.0275 0.3938 ( 5100 PWs) bands (ev): -20.0242 -20.0242 -19.2295 -19.2295 -15.4088 -15.4076 -15.2672 -15.2668 -13.8372 -13.8350 -12.8039 -12.8037 -12.7932 -12.7931 -8.6777 -8.6777 -4.7819 -4.7806 -3.9613 -3.9613 -3.9328 -3.9317 -2.8802 -2.8061 -2.3374 -2.2598 -2.1035 -2.0967 -1.2168 -1.1846 -1.1190 -1.0844 -1.0519 -1.0480 1.4368 1.4370 1.5798 1.5814 1.6155 1.6176 2.1595 2.1603 2.3511 2.3517 2.3848 2.3856 3.1580 3.1590 3.4899 3.4903 3.4935 3.4950 3.8286 3.8290 3.8333 3.8334 7.5659 7.5665 9.7133 9.7138 11.0470 11.0590 12.2676 12.2679 12.6676 12.6695 12.7032 12.7036 k = 0.0079 0.0137 0.3938 ( 5094 PWs) bands (ev): -20.0242 -20.0242 -19.2311 -19.2311 -15.4052 -15.4046 -15.2636 -15.2636 -13.8375 -13.8364 -12.8044 -12.8044 -12.7937 -12.7937 -8.6865 -8.6865 -4.7816 -4.7809 -3.9612 -3.9612 -3.9328 -3.9322 -2.8544 -2.8163 -2.3153 -2.2732 -2.1018 -2.1010 -1.2023 -1.1814 -1.1223 -1.0991 -1.0617 -1.0611 1.4331 1.4332 1.6090 1.6097 1.6207 1.6217 2.1363 2.1367 2.3561 2.3566 2.3887 2.3888 3.1575 3.1580 3.4917 3.4919 3.4927 3.4935 3.8270 3.8272 3.8315 3.8315 7.5551 7.5554 9.7091 9.7094 11.0471 11.0531 12.2731 12.2733 12.6771 12.6781 12.7045 12.7046 k = 0.0000 0.0000 0.3938 ( 5090 PWs) bands (ev): -20.0242 -20.0242 -19.2317 -19.2317 -15.4038 -15.4038 -15.2625 -15.2625 -13.8373 -13.8373 -12.8046 -12.8046 -12.7939 -12.7939 -8.6894 -8.6894 -4.7813 -4.7813 -3.9612 -3.9612 -3.9326 -3.9326 -2.8327 -2.8327 -2.2930 -2.2930 -2.1016 -2.1016 -1.1889 -1.1889 -1.1139 -1.1139 -1.0651 -1.0651 1.4319 1.4319 1.6176 1.6176 1.6248 1.6248 2.1280 2.1280 2.3578 2.3578 2.3902 2.3902 3.1575 3.1575 3.4921 3.4921 3.4929 3.4929 3.8265 3.8265 3.8309 3.8309 7.5516 7.5516 9.7078 9.7078 11.0492 11.0492 12.2751 12.2751 12.6796 12.6796 12.7060 12.7060 k = 0.5000 0.2887 0.3938 ( 5100 PWs) bands (ev): -20.0206 -20.0206 -18.8666 -18.8666 -16.2974 -16.2974 -15.4976 -15.4976 -13.6640 -13.6640 -12.7594 -12.7594 -12.7227 -12.7227 -6.6919 -6.6919 -4.7678 -4.7678 -4.2083 -4.2083 -3.9622 -3.9622 -3.8095 -3.8095 -2.9419 -2.9419 -2.6006 -2.6006 -1.1301 -1.1301 -0.4768 -0.4768 -0.2251 -0.2251 0.5311 0.5311 0.7047 0.7047 1.4594 1.4594 1.9356 1.9356 2.4306 2.4306 2.9368 2.9368 3.1709 3.1709 3.3421 3.3421 3.8425 3.8425 3.9057 3.9057 4.0805 4.0805 9.2915 9.2915 10.8351 10.8351 10.9781 10.9781 11.0152 11.0152 12.0884 12.0884 13.0796 13.0796 k = 0.5000 0.2887 0.3781 ( 5112 PWs) bands (ev): -20.0206 -20.0206 -18.8666 -18.8666 -16.2974 -16.2974 -15.4977 -15.4976 -13.6640 -13.6640 -12.7594 -12.7593 -12.7227 -12.7227 -6.6920 -6.6918 -4.7687 -4.7672 -4.2092 -4.2073 -3.9633 -3.9613 -3.8113 -3.8084 -2.9422 -2.9414 -2.6012 -2.5996 -1.1306 -1.1294 -0.4766 -0.4757 -0.2258 -0.2250 0.5309 0.5310 0.7046 0.7048 1.4594 1.4597 1.9356 1.9357 2.4305 2.4305 2.9368 2.9372 3.1704 3.1707 3.3421 3.3427 3.8415 3.8421 3.9051 3.9058 4.0807 4.0809 9.2913 9.2914 10.8336 10.8352 10.9749 10.9814 11.0131 11.0187 12.0837 12.0902 13.0511 13.0965 k = 0.5000 0.2887 0.3623 ( 5112 PWs) bands (ev): -20.0207 -20.0207 -18.8666 -18.8666 -16.2974 -16.2974 -15.4977 -15.4976 -13.6640 -13.6640 -12.7593 -12.7592 -12.7228 -12.7227 -6.6921 -6.6916 -4.7696 -4.7668 -4.2100 -4.2061 -3.9645 -3.9606 -3.8135 -3.8078 -2.9425 -2.9408 -2.6015 -2.5983 -1.1308 -1.1284 -0.4751 -0.4732 -0.2272 -0.2255 0.5303 0.5305 0.7045 0.7050 1.4597 1.4601 1.9358 1.9359 2.4302 2.4303 2.9372 2.9381 3.1694 3.1699 3.3426 3.3437 3.8391 3.8402 3.9041 3.9055 4.0813 4.0817 9.2909 9.2912 10.8307 10.8338 10.9720 10.9847 11.0129 11.0236 12.0765 12.0894 13.0183 13.0949 k = 0.5000 0.2887 0.3466 ( 5108 PWs) bands (ev): -20.0207 -20.0207 -18.8666 -18.8666 -16.2974 -16.2973 -15.4978 -15.4977 -13.6640 -13.6640 -12.7592 -12.7591 -12.7229 -12.7228 -6.6921 -6.6913 -4.7707 -4.7665 -4.2106 -4.2048 -3.9660 -3.9603 -3.8163 -3.8079 -2.9426 -2.9401 -2.6014 -2.5968 -1.1307 -1.1273 -0.4723 -0.4695 -0.2292 -0.2266 0.5294 0.5297 0.7046 0.7052 1.4601 1.4608 1.9362 1.9363 2.4297 2.4298 2.9381 2.9393 3.1678 3.1686 3.3436 3.3453 3.8354 3.8370 3.9027 3.9046 4.0823 4.0830 9.2903 9.2908 10.8265 10.8309 10.9694 10.9877 11.0145 11.0298 12.0668 12.0859 12.9846 13.0784 k = 0.5000 0.2887 0.3308 ( 5108 PWs) bands (ev): -20.0207 -20.0207 -18.8666 -18.8666 -16.2973 -16.2972 -15.4978 -15.4977 -13.6640 -13.6639 -12.7591 -12.7589 -12.7231 -12.7229 -6.6920 -6.6910 -4.7720 -4.7665 -4.2110 -4.2035 -3.9675 -3.9602 -3.8195 -3.8086 -2.9426 -2.9394 -2.6010 -2.5950 -1.1305 -1.1259 -0.4682 -0.4645 -0.2317 -0.2284 0.5282 0.5286 0.7047 0.7055 1.4608 1.4617 1.9366 1.9368 2.4290 2.4292 2.9394 2.9410 3.1657 3.1667 3.3450 3.3473 3.8304 3.8324 3.9009 3.9033 4.0839 4.0847 9.2895 9.2902 10.8210 10.8266 10.9673 10.9902 11.0182 11.0371 12.0547 12.0799 12.9513 13.0551 k = 0.5000 0.2887 0.3151 ( 5110 PWs) bands (ev): -20.0207 -20.0207 -18.8666 -18.8666 -16.2973 -16.2971 -15.4979 -15.4977 -13.6639 -13.6638 -12.7589 -12.7587 -12.7233 -12.7231 -6.6919 -6.6907 -4.7733 -4.7666 -4.2113 -4.2020 -3.9691 -3.9603 -3.8231 -3.8098 -2.9424 -2.9386 -2.6003 -2.5930 -1.1299 -1.1244 -0.4629 -0.4584 -0.2348 -0.2307 0.5267 0.5272 0.7048 0.7058 1.4616 1.4628 1.9372 1.9373 2.4282 2.4284 2.9410 2.9429 3.1630 3.1642 3.3470 3.3497 3.8242 3.8265 3.8987 3.9014 4.0859 4.0869 9.2886 9.2894 10.8144 10.8209 10.9656 10.9923 11.0238 11.0456 12.0406 12.0715 12.9192 13.0296 k = 0.5000 0.2887 0.2993 ( 5108 PWs) bands (ev): -20.0208 -20.0208 -18.8666 -18.8666 -16.2972 -16.2970 -15.4980 -15.4978 -13.6638 -13.6637 -12.7587 -12.7584 -12.7235 -12.7233 -6.6917 -6.6903 -4.7748 -4.7669 -4.2114 -4.2005 -3.9709 -3.9608 -3.8271 -3.8116 -2.9421 -2.9377 -2.5992 -2.5907 -1.1292 -1.1227 -0.4565 -0.4513 -0.2383 -0.2334 0.5249 0.5255 0.7050 0.7061 1.4627 1.4640 1.9379 1.9380 2.4272 2.4275 2.9429 2.9452 3.1598 3.1612 3.3493 3.3526 3.8170 3.8195 3.8960 3.8991 4.0885 4.0895 9.2875 9.2884 10.8069 10.8140 10.9644 10.9940 11.0312 11.0551 12.0246 12.0610 12.8885 13.0034 k = 0.5000 0.2887 0.2836 ( 5104 PWs) bands (ev): -20.0208 -20.0208 -18.8666 -18.8666 -16.2970 -16.2969 -15.4981 -15.4979 -13.6638 -13.6636 -12.7584 -12.7581 -12.7237 -12.7235 -6.6915 -6.6899 -4.7762 -4.7675 -4.2114 -4.1989 -3.9726 -3.9616 -3.8313 -3.8140 -2.9417 -2.9367 -2.5979 -2.5884 -1.1283 -1.1210 -0.4490 -0.4431 -0.2422 -0.2366 0.5229 0.5236 0.7052 0.7065 1.4640 1.4655 1.9386 1.9388 2.4261 2.4264 2.9451 2.9477 3.1563 3.1578 3.3520 3.3557 3.8089 3.8114 3.8930 3.8963 4.0915 4.0926 9.2862 9.2873 10.7984 10.8061 10.9636 10.9954 11.0402 11.0658 12.0070 12.0484 12.8596 12.9775 k = 0.5000 0.2887 0.2678 ( 5104 PWs) bands (ev): -20.0209 -20.0209 -18.8665 -18.8665 -16.2969 -16.2967 -15.4982 -15.4980 -13.6637 -13.6635 -12.7581 -12.7578 -12.7240 -12.7238 -6.6912 -6.6895 -4.7778 -4.7682 -4.2112 -4.1973 -3.9744 -3.9627 -3.8356 -3.8168 -2.9412 -2.9358 -2.5962 -2.5859 -1.1273 -1.1192 -0.4406 -0.4342 -0.2464 -0.2402 0.5207 0.5215 0.7055 0.7068 1.4654 1.4671 1.9394 1.9397 2.4249 2.4252 2.9476 2.9504 3.1523 3.1540 3.3550 3.3590 3.7999 3.8024 3.8897 3.8930 4.0949 4.0962 9.2848 9.2860 10.7893 10.7973 10.9632 10.9964 11.0505 11.0776 11.9881 12.0342 12.8325 12.9522 k = 0.5000 0.2887 0.2520 ( 5124 PWs) bands (ev): -20.0209 -20.0209 -18.8665 -18.8665 -16.2968 -16.2966 -15.4983 -15.4981 -13.6636 -13.6634 -12.7578 -12.7574 -12.7243 -12.7240 -6.6909 -6.6891 -4.7793 -4.7690 -4.2108 -4.1957 -3.9762 -3.9640 -3.8401 -3.8200 -2.9406 -2.9348 -2.5943 -2.5833 -1.1261 -1.1174 -0.4315 -0.4245 -0.2509 -0.2440 0.5183 0.5192 0.7058 0.7072 1.4669 1.4687 1.9403 1.9406 2.4236 2.4239 2.9502 2.9533 3.1479 3.1497 3.3583 3.3626 3.7903 3.7927 3.8860 3.8894 4.0987 4.1001 9.2834 9.2846 10.7796 10.7877 10.9630 10.9971 11.0619 11.0905 11.9682 12.0184 12.8072 12.9276 k = 0.5000 0.2887 0.2363 ( 5110 PWs) bands (ev): -20.0210 -20.0210 -18.8665 -18.8665 -16.2966 -16.2964 -15.4984 -15.4982 -13.6635 -13.6633 -12.7574 -12.7571 -12.7246 -12.7243 -6.6906 -6.6886 -4.7809 -4.7701 -4.2102 -4.1941 -3.9779 -3.9655 -3.8447 -3.8236 -2.9399 -2.9339 -2.5922 -2.5807 -1.1249 -1.1157 -0.4216 -0.4143 -0.2555 -0.2480 0.5159 0.5168 0.7062 0.7076 1.4686 1.4706 1.9412 1.9415 2.4222 2.4226 2.9529 2.9562 3.1433 3.1452 3.3618 3.3663 3.7802 3.7825 3.8821 3.8855 4.1029 4.1043 9.2819 9.2832 10.7696 10.7777 10.9631 10.9975 11.0745 11.1044 11.9475 12.0013 12.7840 12.9038 k = 0.5000 0.2887 0.2205 ( 5106 PWs) bands (ev): -20.0211 -20.0211 -18.8665 -18.8665 -16.2965 -16.2962 -15.4985 -15.4983 -13.6633 -13.6632 -12.7570 -12.7566 -12.7250 -12.7247 -6.6902 -6.6882 -4.7824 -4.7713 -4.2095 -4.1925 -3.9797 -3.9672 -3.8492 -3.8276 -2.9391 -2.9329 -2.5899 -2.5780 -1.1236 -1.1140 -0.4113 -0.4037 -0.2601 -0.2521 0.5134 0.5143 0.7065 0.7080 1.4704 1.4724 1.9421 1.9424 2.4207 2.4211 2.9558 2.9591 3.1384 3.1404 3.3654 3.3700 3.7697 3.7719 3.8780 3.8813 4.1075 4.1089 9.2803 9.2816 10.7594 10.7673 10.9633 10.9975 11.0880 11.1193 11.9263 11.9832 12.7628 12.8810 k = 0.5000 0.2887 0.2048 ( 5106 PWs) bands (ev): -20.0211 -20.0211 -18.8664 -18.8664 -16.2963 -16.2961 -15.4986 -15.4984 -13.6632 -13.6631 -12.7566 -12.7562 -12.7253 -12.7250 -6.6898 -6.6878 -4.7838 -4.7725 -4.2086 -4.1910 -3.9815 -3.9690 -3.8537 -3.8317 -2.9383 -2.9320 -2.5874 -2.5755 -1.1222 -1.1125 -0.4008 -0.3929 -0.2646 -0.2561 0.5108 0.5117 0.7069 0.7084 1.4722 1.4743 1.9431 1.9434 2.4193 2.4197 2.9586 2.9620 3.1334 3.1354 3.3690 3.3737 3.7590 3.7610 3.8737 3.8770 4.1122 4.1136 9.2787 9.2801 10.7491 10.7568 10.9636 10.9972 11.1023 11.1349 11.9047 11.9642 12.7436 12.8591 k = 0.5000 0.2887 0.1890 ( 5098 PWs) bands (ev): -20.0212 -20.0212 -18.8664 -18.8664 -16.2962 -16.2959 -15.4987 -15.4985 -13.6631 -13.6630 -12.7562 -12.7558 -12.7257 -12.7253 -6.6894 -6.6873 -4.7852 -4.7739 -4.2076 -4.1896 -3.9832 -3.9709 -3.8580 -3.8360 -2.9373 -2.9311 -2.5848 -2.5730 -1.1209 -1.1112 -0.3901 -0.3821 -0.2689 -0.2601 0.5082 0.5092 0.7073 0.7088 1.4741 1.4763 1.9440 1.9443 2.4178 2.4182 2.9614 2.9649 3.1283 3.1303 3.3726 3.3774 3.7483 3.7501 3.8695 3.8726 4.1172 4.1185 9.2771 9.2785 10.7390 10.7463 10.9641 10.9966 11.1173 11.1512 11.8832 11.9444 12.7265 12.8382 k = 0.5000 0.2887 0.1733 ( 5110 PWs) bands (ev): -20.0213 -20.0212 -18.8664 -18.8664 -16.2960 -16.2957 -15.4989 -15.4986 -13.6630 -13.6628 -12.7558 -12.7554 -12.7260 -12.7257 -6.6890 -6.6870 -4.7865 -4.7754 -4.2064 -4.1884 -3.9850 -3.9728 -3.8621 -3.8404 -2.9364 -2.9303 -2.5822 -2.5706 -1.1196 -1.1100 -0.3795 -0.3716 -0.2729 -0.2638 0.5057 0.5067 0.7077 0.7092 1.4760 1.4782 1.9449 1.9452 2.4164 2.4168 2.9641 2.9676 3.1231 3.1251 3.3762 3.3809 3.7377 3.7393 3.8652 3.8681 4.1222 4.1235 9.2755 9.2769 10.7291 10.7360 10.9645 10.9957 11.1330 11.1679 11.8618 11.9241 12.7115 12.8183 k = 0.5000 0.2887 0.1575 ( 5108 PWs) bands (ev): -20.0213 -20.0213 -18.8664 -18.8663 -16.2958 -16.2956 -15.4990 -15.4987 -13.6629 -13.6627 -12.7553 -12.7549 -12.7264 -12.7261 -6.6885 -6.6866 -4.7877 -4.7770 -4.2051 -4.1873 -3.9866 -3.9747 -3.8659 -3.8448 -2.9354 -2.9296 -2.5795 -2.5684 -1.1183 -1.1090 -0.3694 -0.3614 -0.2765 -0.2671 0.5033 0.5042 0.7081 0.7095 1.4779 1.4800 1.9457 1.9460 2.4150 2.4154 2.9668 2.9702 3.1181 3.1200 3.3797 3.3843 3.7274 3.7288 3.8610 3.8638 4.1272 4.1284 9.2740 9.2753 10.7196 10.7261 10.9651 10.9945 11.1491 11.1848 11.8410 11.9035 12.6986 12.7994 k = 0.5000 0.2887 0.1418 ( 5098 PWs) bands (ev): -20.0214 -20.0214 -18.8663 -18.8663 -16.2957 -16.2954 -15.4991 -15.4988 -13.6628 -13.6626 -12.7549 -12.7545 -12.7268 -12.7264 -6.6881 -6.6862 -4.7887 -4.7785 -4.2036 -4.1864 -3.9882 -3.9765 -3.8695 -3.8492 -2.9345 -2.9289 -2.5769 -2.5663 -1.1171 -1.1082 -0.3598 -0.3520 -0.2795 -0.2700 0.5010 0.5019 0.7086 0.7099 1.4798 1.4818 1.9466 1.9468 2.4137 2.4140 2.9694 2.9727 3.1131 3.1150 3.3831 3.3874 3.7175 3.7187 3.8570 3.8596 4.1321 4.1333 9.2726 9.2738 10.7107 10.7167 10.9657 10.9930 11.1655 11.2017 11.8209 11.8828 12.6877 12.7816 k = 0.5000 0.2887 0.1260 ( 5094 PWs) bands (ev): -20.0214 -20.0214 -18.8663 -18.8663 -16.2955 -16.2953 -15.4992 -15.4989 -13.6626 -13.6625 -12.7545 -12.7541 -12.7271 -12.7268 -6.6877 -6.6859 -4.7896 -4.7801 -4.2021 -4.1857 -3.9896 -3.9783 -3.8726 -3.8534 -2.9335 -2.9284 -2.5743 -2.5645 -1.1160 -1.1076 -0.3511 -0.3435 -0.2818 -0.2723 0.4988 0.4997 0.7090 0.7101 1.4816 1.4835 1.9473 1.9475 2.4124 2.4128 2.9718 2.9749 3.1083 3.1101 3.3862 3.3902 3.7082 3.7093 3.8532 3.8556 4.1368 4.1379 9.2713 9.2724 10.7025 10.7078 10.9663 10.9913 11.1820 11.2180 11.8020 11.8621 12.6788 12.7649 k = 0.5000 0.2887 0.1103 ( 5098 PWs) bands (ev): -20.0215 -20.0215 -18.8663 -18.8663 -16.2954 -16.2952 -15.4992 -15.4991 -13.6625 -13.6624 -12.7541 -12.7538 -12.7274 -12.7271 -6.6873 -6.6857 -4.7903 -4.7816 -4.2005 -4.1852 -3.9908 -3.9801 -3.8752 -3.8576 -2.9326 -2.9279 -2.5718 -2.5629 -1.1149 -1.1072 -0.3435 -0.3363 -0.2831 -0.2739 0.4969 0.4976 0.7093 0.7104 1.4832 1.4850 1.9480 1.9482 2.4113 2.4116 2.9740 2.9769 3.1039 3.1056 3.3891 3.3928 3.6997 3.7006 3.8498 3.8520 4.1412 4.1422 9.2700 9.2711 10.6950 10.6997 10.9671 10.9895 11.1983 11.2335 11.7845 11.8418 12.6719 12.7493 k = 0.5000 0.2887 0.0945 ( 5100 PWs) bands (ev): -20.0215 -20.0215 -18.8663 -18.8663 -16.2952 -16.2951 -15.4993 -15.4991 -13.6624 -13.6623 -12.7537 -12.7534 -12.7277 -12.7274 -6.6869 -6.6855 -4.7908 -4.7831 -4.1988 -4.1850 -3.9918 -3.9818 -3.8774 -3.8615 -2.9317 -2.9276 -2.5695 -2.5616 -1.1138 -1.1070 -0.3372 -0.3306 -0.2833 -0.2747 0.4951 0.4958 0.7097 0.7106 1.4848 1.4863 1.9486 1.9488 2.4103 2.4105 2.9760 2.9787 3.0998 3.1013 3.3917 3.3950 3.6920 3.6928 3.8467 3.8486 4.1453 4.1461 9.2689 9.2699 10.6883 10.6924 10.9679 10.9876 11.2143 11.2477 11.7689 11.8221 12.6670 12.7349 k = 0.5000 0.2887 0.0788 ( 5114 PWs) bands (ev): -20.0216 -20.0216 -18.8662 -18.8662 -16.2951 -16.2950 -15.4994 -15.4992 -13.6624 -13.6623 -12.7534 -12.7531 -12.7280 -12.7277 -6.6865 -6.6853 -4.7911 -4.7846 -4.1971 -4.1851 -3.9924 -3.9835 -3.8790 -3.8652 -2.9308 -2.9273 -2.5673 -2.5606 -1.1129 -1.1070 -0.3323 -0.3266 -0.2824 -0.2748 0.4936 0.4942 0.7100 0.7108 1.4861 1.4875 1.9491 1.9493 2.4094 2.4096 2.9778 2.9802 3.0962 3.0975 3.3940 3.3968 3.6853 3.6859 3.8441 3.8457 4.1489 4.1496 9.2680 9.2688 10.6826 10.6861 10.9688 10.9855 11.2296 11.2602 11.7557 11.8033 12.6639 12.7216 k = 0.5000 0.2887 0.0630 ( 5116 PWs) bands (ev): -20.0216 -20.0216 -18.8662 -18.8662 -16.2950 -16.2949 -15.4994 -15.4993 -13.6623 -13.6622 -12.7531 -12.7529 -12.7282 -12.7280 -6.6862 -6.6852 -4.7913 -4.7859 -4.1954 -4.1854 -3.9927 -3.9852 -3.8800 -3.8686 -2.9301 -2.9272 -2.5653 -2.5598 -1.1120 -1.1072 -0.3286 -0.3241 -0.2807 -0.2745 0.4923 0.4928 0.7103 0.7109 1.4873 1.4885 1.9495 1.9497 2.4086 2.4088 2.9794 2.9814 3.0932 3.0943 3.3960 3.3983 3.6797 3.6802 3.8419 3.8432 4.1520 4.1525 9.2673 9.2679 10.6779 10.6807 10.9699 10.9835 11.2438 11.2704 11.7453 11.7859 12.6626 12.7095 k = 0.5000 0.2887 0.0473 ( 5120 PWs) bands (ev): -20.0216 -20.0216 -18.8662 -18.8662 -16.2949 -16.2948 -15.4995 -15.4994 -13.6622 -13.6622 -12.7529 -12.7527 -12.7283 -12.7282 -6.6859 -6.6852 -4.7912 -4.7871 -4.1937 -4.1860 -3.9927 -3.9868 -3.8805 -3.8717 -2.9294 -2.9272 -2.5636 -2.5594 -1.1111 -1.1074 -0.3261 -0.3228 -0.2785 -0.2738 0.4913 0.4917 0.7105 0.7110 1.4883 1.4892 1.9499 1.9500 2.4080 2.4082 2.9807 2.9823 3.0908 3.0916 3.3976 3.3994 3.6752 3.6756 3.8402 3.8412 4.1544 4.1549 9.2667 9.2672 10.6743 10.6764 10.9712 10.9814 11.2565 11.2779 11.7381 11.7703 12.6631 12.6987 k = 0.5000 0.2887 0.0315 ( 5138 PWs) bands (ev): -20.0217 -20.0217 -18.8662 -18.8662 -16.2949 -16.2948 -15.4995 -15.4994 -13.6622 -13.6622 -12.7527 -12.7526 -12.7285 -12.7284 -6.6857 -6.6852 -4.7910 -4.7882 -4.1921 -4.1868 -3.9924 -3.9883 -3.8803 -3.8743 -2.9287 -2.9273 -2.5622 -2.5593 -1.1103 -1.1078 -0.3244 -0.3223 -0.2764 -0.2733 0.4906 0.4909 0.7107 0.7110 1.4890 1.4896 1.9501 1.9502 2.4076 2.4077 2.9818 2.9828 3.0890 3.0896 3.3988 3.4001 3.6720 3.6722 3.8390 3.8396 4.1562 4.1565 9.2662 9.2666 10.6718 10.6732 10.9725 10.9794 11.2672 11.2823 11.7345 11.7568 12.6652 12.6892 k = 0.5000 0.2887 0.0158 ( 5136 PWs) bands (ev): -20.0217 -20.0217 -18.8662 -18.8662 -16.2948 -16.2948 -15.4995 -15.4995 -13.6622 -13.6622 -12.7526 -12.7525 -12.7285 -12.7285 -6.6855 -6.6852 -4.7906 -4.7892 -4.1905 -4.1879 -3.9917 -3.9896 -3.8796 -3.8766 -2.9282 -2.9275 -2.5610 -2.5596 -1.1096 -1.1083 -0.3233 -0.3222 -0.2747 -0.2732 0.4902 0.4903 0.7109 0.7110 1.4896 1.4899 1.9503 1.9503 2.4074 2.4074 2.9825 2.9831 3.0880 3.0883 3.3997 3.4003 3.6701 3.6702 3.8383 3.8387 4.1574 4.1575 9.2660 9.2662 10.6704 10.6711 10.9741 10.9775 11.2755 11.2833 11.7347 11.7461 12.6690 12.6810 k = 0.5000 0.2887-0.0000 ( 5132 PWs) bands (ev): -20.0217 -20.0217 -18.8662 -18.8662 -16.2948 -16.2948 -15.4995 -15.4995 -13.6621 -13.6621 -12.7525 -12.7525 -12.7285 -12.7285 -6.6853 -6.6853 -4.7900 -4.7900 -4.1891 -4.1891 -3.9908 -3.9908 -3.8784 -3.8784 -2.9278 -2.9278 -2.5601 -2.5601 -1.1089 -1.1089 -0.3226 -0.3226 -0.2736 -0.2736 0.4901 0.4901 0.7110 0.7110 1.4898 1.4898 1.9503 1.9503 2.4073 2.4073 2.9830 2.9830 3.0878 3.0878 3.4002 3.4002 3.6695 3.6695 3.8382 3.8382 4.1578 4.1578 9.2660 9.2660 10.6701 10.6701 10.9757 10.9757 11.2810 11.2810 11.7386 11.7386 12.6742 12.6742 k = 0.3333 0.5774-0.0000 ( 5082 PWs) bands (ev): -20.0207 -20.0207 -18.8128 -18.8094 -16.3986 -16.2974 -15.6712 -15.5474 -13.6468 -13.6432 -12.8708 -12.8624 -12.5518 -12.5485 -6.2636 -6.2487 -4.9541 -4.8010 -4.7728 -4.7520 -3.9980 -3.9730 -3.8840 -3.8820 -2.6684 -2.5930 -2.1387 -1.9504 -1.6681 -1.6115 -0.4595 -0.4316 0.0515 0.0744 0.0981 0.1040 0.3018 0.3051 1.8676 1.8682 2.2717 2.2763 2.3217 2.3282 2.9451 2.9514 3.1208 3.1235 3.2397 3.2494 3.8088 3.8119 3.9455 3.9467 4.0480 4.0495 9.4486 9.4553 10.7282 10.7890 10.7930 10.8067 11.1208 11.1696 11.8105 11.8391 12.8021 12.8999 k = 0.3333 0.5774 0.0158 ( 5082 PWs) bands (ev): -20.0207 -20.0206 -18.8129 -18.8094 -16.3986 -16.2974 -15.6715 -15.5477 -13.6467 -13.6432 -12.8708 -12.8623 -12.5511 -12.5477 -6.2647 -6.2503 -4.9533 -4.7979 -4.7729 -4.7573 -4.0006 -3.9719 -3.8909 -3.8888 -2.6668 -2.5925 -2.1345 -1.9463 -1.6671 -1.6107 -0.4450 -0.4177 0.0566 0.0791 0.1015 0.1069 0.3011 0.3043 1.8668 1.8673 2.2721 2.2767 2.3221 2.3284 2.9420 2.9481 3.1083 3.1111 3.2380 3.2478 3.8018 3.8052 3.9416 3.9426 4.0454 4.0470 9.4504 9.4571 10.7416 10.7902 10.8118 10.8137 11.1521 11.2011 11.7787 11.8074 12.7266 12.8258 k = 0.3333 0.5774 0.0315 ( 5091 PWs) bands (ev): -20.0206 -20.0206 -18.8129 -18.8094 -16.3986 -16.2974 -15.6718 -15.5481 -13.6467 -13.6431 -12.8707 -12.8623 -12.5503 -12.5469 -6.2658 -6.2519 -4.9528 -4.7973 -4.7729 -4.7598 -4.0027 -3.9707 -3.8973 -3.8953 -2.6653 -2.5921 -2.1303 -1.9424 -1.6664 -1.6101 -0.4315 -0.4047 0.0612 0.0834 0.1042 0.1093 0.3004 0.3036 1.8660 1.8664 2.2726 2.2771 2.3227 2.3287 2.9390 2.9450 3.0966 3.0994 3.2364 3.2462 3.7954 3.7990 3.9381 3.9389 4.0433 4.0449 9.4522 9.4588 10.7532 10.7912 10.8234 10.8321 11.1859 11.2346 11.7467 11.7755 12.6508 12.7517 k = 0.3333 0.5774 0.0473 ( 5082 PWs) bands (ev): -20.0206 -20.0206 -18.8129 -18.8094 -16.3986 -16.2974 -15.6722 -15.5484 -13.6467 -13.6431 -12.8708 -12.8623 -12.5495 -12.5461 -6.2669 -6.2533 -4.9524 -4.7997 -4.7728 -4.7591 -4.0042 -3.9693 -3.9031 -3.9012 -2.6639 -2.5916 -2.1263 -1.9386 -1.6659 -1.6097 -0.4193 -0.3930 0.0653 0.0873 0.1062 0.1111 0.2998 0.3031 1.8651 1.8655 2.2731 2.2775 2.3233 2.3292 2.9362 2.9421 3.0860 3.0887 3.2349 3.2448 3.7897 3.7934 3.9351 3.9357 4.0415 4.0432 9.4540 9.4605 10.7625 10.7923 10.8365 10.8536 11.2220 11.2700 11.7146 11.7439 12.5749 12.6780 k = 0.3333 0.5774 0.0630 ( 5082 PWs) bands (ev): -20.0206 -20.0206 -18.8128 -18.8094 -16.3986 -16.2973 -15.6725 -15.5488 -13.6467 -13.6431 -12.8708 -12.8624 -12.5487 -12.5453 -6.2678 -6.2546 -4.9522 -4.8045 -4.7726 -4.7557 -4.0051 -3.9678 -3.9083 -3.9066 -2.6625 -2.5912 -2.1225 -1.9350 -1.6658 -1.6096 -0.4087 -0.3828 0.0688 0.0906 0.1075 0.1122 0.2993 0.3026 1.8642 1.8646 2.2736 2.2780 2.3241 2.3298 2.9338 2.9395 3.0766 3.0793 3.2336 3.2435 3.7848 3.7886 3.9326 3.9331 4.0401 4.0419 9.4557 9.4621 10.7694 10.7934 10.8528 10.8761 11.2601 11.3068 11.6828 11.7127 12.4994 12.6053 k = 0.3333 0.5774 0.0788 ( 5082 PWs) bands (ev): -20.0205 -20.0205 -18.8128 -18.8094 -16.3986 -16.2973 -15.6729 -15.5492 -13.6467 -13.6432 -12.8709 -12.8624 -12.5479 -12.5446 -6.2686 -6.2558 -4.9522 -4.8107 -4.7723 -4.7508 -4.0055 -3.9663 -3.9127 -3.9114 -2.6612 -2.5909 -2.1189 -1.9317 -1.6660 -1.6097 -0.3997 -0.3742 0.0715 0.0933 0.1079 0.1126 0.2990 0.3024 1.8633 1.8636 2.2741 2.2784 2.3250 2.3306 2.9317 2.9371 3.0686 3.0713 3.2324 3.2424 3.7808 3.7846 3.9307 3.9311 4.0391 4.0409 9.4573 9.4637 10.7745 10.7946 10.8715 10.8995 11.3000 11.3449 11.6515 11.6824 12.4246 12.5338 k = 0.3333 0.5774 0.0945 ( 5097 PWs) bands (ev): -20.0205 -20.0205 -18.8128 -18.8094 -16.3986 -16.2973 -15.6732 -15.5495 -13.6468 -13.6432 -12.8710 -12.8625 -12.5472 -12.5438 -6.2694 -6.2568 -4.9523 -4.8173 -4.7720 -4.7450 -4.0052 -3.9646 -3.9163 -3.9155 -2.6600 -2.5905 -2.1156 -1.9286 -1.6666 -1.6101 -0.3926 -0.3675 0.0735 0.0954 0.1077 0.1124 0.2988 0.3022 1.8624 1.8627 2.2746 2.2788 2.3261 2.3315 2.9299 2.9351 3.0623 3.0649 3.2313 3.2415 3.7777 3.7814 3.9293 3.9297 4.0384 4.0403 9.4589 9.4653 10.7783 10.7959 10.8917 10.9233 11.3414 11.3837 11.6211 11.6535 12.3507 12.4641 k = 0.3333 0.5774 0.1103 ( 5103 PWs) bands (ev): -20.0205 -20.0205 -18.8128 -18.8093 -16.3985 -16.2973 -15.6736 -15.5499 -13.6469 -13.6433 -12.8711 -12.8626 -12.5465 -12.5432 -6.2700 -6.2576 -4.9527 -4.8241 -4.7715 -4.7388 -4.0044 -3.9629 -3.9191 -3.9189 -2.6589 -2.5902 -2.1127 -1.9258 -1.6674 -1.6108 -0.3875 -0.3627 0.0747 0.0967 0.1067 0.1114 0.2988 0.3022 1.8615 1.8618 2.2751 2.2793 2.3272 2.3325 2.9286 2.9335 3.0576 3.0602 3.2305 3.2408 3.7757 3.7792 3.9286 3.9290 4.0381 4.0401 9.4603 9.4667 10.7814 10.7973 10.9125 10.9474 11.3838 11.4228 11.5921 11.6265 12.2783 12.3968 k = 0.3333 0.5774 0.1260 ( 5103 PWs) bands (ev): -20.0204 -20.0204 -18.8128 -18.8093 -16.3985 -16.2972 -15.6739 -15.5502 -13.6470 -13.6434 -12.8712 -12.8628 -12.5459 -12.5426 -6.2704 -6.2582 -4.9532 -4.8309 -4.7710 -4.7323 -4.0030 -3.9612 -3.9215 -3.9209 -2.6579 -2.5900 -2.1100 -1.9233 -1.6685 -1.6117 -0.3846 -0.3600 0.0750 0.0974 0.1049 0.1098 0.2989 0.3024 1.8608 1.8610 2.2756 2.2797 2.3283 2.3336 2.9276 2.9324 3.0549 3.0574 3.2299 3.2404 3.7747 3.7779 3.9285 3.9290 4.0382 4.0403 9.4615 9.4680 10.7839 10.7988 10.9333 10.9710 11.4263 11.4615 11.5650 11.6024 12.2078 12.3327 k = 0.3333 0.5774 0.1418 ( 5067 PWs) bands (ev): -20.0204 -20.0204 -18.8127 -18.8093 -16.3984 -16.2972 -15.6742 -15.5505 -13.6471 -13.6436 -12.8713 -12.8629 -12.5454 -12.5420 -6.2707 -6.2586 -4.9539 -4.8375 -4.7703 -4.7258 -4.0010 -3.9595 -3.9233 -3.9219 -2.6571 -2.5898 -2.1078 -1.9212 -1.6698 -1.6128 -0.3837 -0.3594 0.0745 0.0974 0.1025 0.1075 0.2992 0.3027 1.8601 1.8603 2.2761 2.2801 2.3296 2.3348 2.9272 2.9316 3.0540 3.0564 3.2296 3.2401 3.7747 3.7777 3.9290 3.9296 4.0387 4.0408 9.4627 9.4692 10.7862 10.8004 10.9532 10.9936 11.4673 11.4987 11.5405 11.5830 12.1400 12.2729 k = 0.3333 0.5774 0.1575 ( 5070 PWs) bands (ev): -20.0204 -20.0203 -18.8127 -18.8093 -16.3984 -16.2971 -15.6745 -15.5508 -13.6472 -13.6437 -12.8715 -12.8631 -12.5449 -12.5415 -6.2709 -6.2589 -4.9547 -4.8438 -4.7696 -4.7191 -3.9985 -3.9578 -3.9244 -3.9220 -2.6564 -2.5896 -2.1060 -1.9194 -1.6715 -1.6141 -0.3851 -0.3609 0.0732 0.0966 0.0995 0.1046 0.2995 0.3032 1.8595 1.8597 2.2765 2.2804 2.3308 2.3361 2.9271 2.9314 3.0551 3.0574 3.2294 3.2401 3.7758 3.7783 3.9301 3.9309 4.0394 4.0416 9.4637 9.4702 10.7881 10.8021 10.9713 11.0143 11.5015 11.5196 11.5329 11.5732 12.0760 12.2189 k = 0.3333 0.5774 0.1733 ( 5082 PWs) bands (ev): -20.0203 -20.0203 -18.8127 -18.8092 -16.3983 -16.2971 -15.6748 -15.5511 -13.6474 -13.6439 -12.8717 -12.8633 -12.5446 -12.5412 -6.2709 -6.2589 -4.9557 -4.8498 -4.7688 -4.7125 -3.9955 -3.9562 -3.9246 -3.9212 -2.6558 -2.5895 -2.1046 -1.9180 -1.6733 -1.6156 -0.3887 -0.3645 0.0710 0.0952 0.0958 0.1011 0.3000 0.3037 1.8590 1.8592 2.2769 2.2808 2.3321 2.3374 2.9275 2.9315 3.0581 3.0602 3.2295 3.2404 3.7779 3.7799 3.9317 3.9328 4.0405 4.0427 9.4644 9.4711 10.7898 10.8038 10.9868 11.0320 11.5032 11.5173 11.5622 11.5837 12.0177 12.1728 k = 0.3333 0.5774 0.1890 ( 5088 PWs) bands (ev): -20.0203 -20.0203 -18.8127 -18.8092 -16.3983 -16.2970 -15.6750 -15.5513 -13.6476 -13.6441 -12.8719 -12.8635 -12.5443 -12.5409 -6.2708 -6.2587 -4.9568 -4.8555 -4.7679 -4.7059 -3.9921 -3.9547 -3.9241 -3.9195 -2.6554 -2.5895 -2.1036 -1.9171 -1.6753 -1.6173 -0.3944 -0.3701 0.0680 0.0917 0.0930 0.0971 0.3006 0.3044 1.8586 1.8588 2.2772 2.2810 2.3334 2.3387 2.9283 2.9321 3.0629 3.0649 3.2299 3.2408 3.7809 3.7825 3.9340 3.9353 4.0418 4.0441 9.4650 9.4717 10.7912 10.8055 10.9988 11.0456 11.4927 11.5180 11.5838 11.6082 11.9690 12.1374 k = 0.3333 0.5774 0.2048 ( 5088 PWs) bands (ev): -20.0203 -20.0203 -18.8126 -18.8092 -16.3982 -16.2969 -15.6752 -15.5515 -13.6477 -13.6442 -12.8721 -12.8637 -12.5441 -12.5407 -6.2705 -6.2583 -4.9580 -4.8608 -4.7670 -4.6994 -3.9883 -3.9532 -3.9227 -3.9170 -2.6552 -2.5895 -2.1031 -1.9166 -1.6776 -1.6191 -0.4020 -0.3777 0.0643 0.0871 0.0902 0.0927 0.3013 0.3051 1.8583 1.8585 2.2775 2.2813 2.3346 2.3400 2.9296 2.9331 3.0695 3.0713 3.2304 3.2415 3.7850 3.7860 3.9367 3.9383 4.0435 4.0458 9.4653 9.4722 10.7922 10.8071 11.0064 11.0540 11.4890 11.5182 11.5947 11.6268 11.9362 12.1159 k = 0.3333 0.5774 0.2205 ( 5094 PWs) bands (ev): -20.0202 -20.0202 -18.8126 -18.8091 -16.3982 -16.2969 -15.6753 -15.5516 -13.6479 -13.6444 -12.8723 -12.8639 -12.5440 -12.5406 -6.2701 -6.2577 -4.9593 -4.8657 -4.7661 -4.6930 -3.9842 -3.9519 -3.9206 -3.9136 -2.6551 -2.5895 -2.1031 -1.9165 -1.6799 -1.6210 -0.4115 -0.3871 0.0599 0.0820 0.0869 0.0879 0.3020 0.3059 1.8582 1.8584 2.2777 2.2815 2.3358 2.3413 2.9312 2.9346 3.0777 3.0794 3.2312 3.2424 3.7899 3.7903 3.9400 3.9419 4.0454 4.0478 9.4654 9.4724 10.7930 10.8086 11.0092 11.0564 11.4929 11.5230 11.5927 11.6272 11.9272 12.1105 k = 0.3333 0.5774 0.2363 ( 5094 PWs) bands (ev): -20.0202 -20.0202 -18.8126 -18.8091 -16.3981 -16.2968 -15.6754 -15.5518 -13.6481 -13.6446 -12.8725 -12.8641 -12.5440 -12.5406 -6.2695 -6.2569 -4.9606 -4.8702 -4.7651 -4.6867 -3.9799 -3.9508 -3.9177 -3.9095 -2.6552 -2.5896 -2.1036 -1.9169 -1.6823 -1.6230 -0.4227 -0.3980 0.0550 0.0767 0.0829 0.0830 0.3028 0.3067 1.8582 1.8584 2.2779 2.2817 2.3369 2.3425 2.9332 2.9364 3.0874 3.0889 3.2323 3.2435 3.7953 3.7955 3.9437 3.9460 4.0476 4.0500 9.4652 9.4724 10.7932 10.8100 11.0072 11.0528 11.5045 11.5329 11.5777 11.6071 11.9437 12.1213 k = 0.3333 0.5774 0.2520 ( 5103 PWs) bands (ev): -20.0202 -20.0202 -18.8126 -18.8091 -16.3980 -16.2968 -15.6755 -15.5518 -13.6483 -13.6448 -12.8727 -12.8643 -12.5442 -12.5407 -6.2688 -6.2559 -4.9620 -4.8743 -4.7642 -4.6806 -3.9753 -3.9498 -3.9141 -3.9046 -2.6554 -2.5898 -2.1046 -1.9177 -1.6849 -1.6251 -0.4353 -0.4103 0.0496 0.0710 0.0776 0.0786 0.3035 0.3075 1.8583 1.8586 2.2780 2.2818 2.3379 2.3437 2.9355 2.9385 3.0983 3.0997 3.2335 3.2447 3.8011 3.8019 3.9477 3.9505 4.0500 4.0524 9.4648 9.4722 10.7929 10.8112 11.0007 11.0438 11.5231 11.5434 11.5520 11.5774 11.9792 12.1462 k = 0.3333 0.5774 0.2678 ( 5103 PWs) bands (ev): -20.0202 -20.0202 -18.8125 -18.8091 -16.3980 -16.2967 -15.6755 -15.5518 -13.6485 -13.6450 -12.8729 -12.8645 -12.5444 -12.5409 -6.2680 -6.2547 -4.9633 -4.8780 -4.7632 -4.6748 -3.9707 -3.9490 -3.9099 -3.8991 -2.6558 -2.5900 -2.1061 -1.9190 -1.6874 -1.6272 -0.4492 -0.4239 0.0440 0.0651 0.0722 0.0738 0.3043 0.3083 1.8585 1.8588 2.2781 2.2818 2.3388 2.3448 2.9380 2.9409 3.1104 3.1116 3.2348 3.2462 3.8074 3.8089 3.9521 3.9553 4.0526 4.0551 9.4642 9.4717 10.7919 10.8122 10.9904 11.0304 11.5187 11.5195 11.5477 11.5801 12.0260 12.1822 k = 0.3333 0.5774 0.2836 ( 5115 PWs) bands (ev): -20.0202 -20.0202 -18.8125 -18.8090 -16.3980 -16.2967 -15.6755 -15.5518 -13.6487 -13.6452 -12.8730 -12.8647 -12.5447 -12.5413 -6.2671 -6.2535 -4.9647 -4.8812 -4.7623 -4.6691 -3.9660 -3.9483 -3.9049 -3.8931 -2.6563 -2.5903 -2.1080 -1.9207 -1.6899 -1.6293 -0.4640 -0.4383 0.0381 0.0591 0.0668 0.0688 0.3051 0.3091 1.8589 1.8592 2.2781 2.2818 2.3396 2.3457 2.9408 2.9436 3.1232 3.1244 3.2363 3.2477 3.8142 3.8164 3.9568 3.9604 4.0555 4.0580 9.4632 9.4710 10.7901 10.8128 10.9773 11.0136 11.4752 11.4808 11.5771 11.6050 12.0795 12.2264 k = 0.3333 0.5774 0.2993 ( 5097 PWs) bands (ev): -20.0201 -20.0201 -18.8125 -18.8090 -16.3979 -16.2966 -15.6754 -15.5517 -13.6489 -13.6454 -12.8732 -12.8649 -12.5451 -12.5416 -6.2661 -6.2520 -4.9661 -4.8841 -4.7615 -4.6638 -3.9614 -3.9478 -3.8995 -3.8865 -2.6570 -2.5906 -2.1104 -1.9229 -1.6924 -1.6313 -0.4796 -0.4535 0.0322 0.0529 0.0615 0.0635 0.3059 0.3099 1.8593 1.8597 2.2780 2.2817 2.3403 2.3466 2.9439 2.9465 3.1366 3.1377 3.2380 3.2494 3.8215 3.8243 3.9616 3.9657 4.0586 4.0611 9.4621 9.4700 10.7873 10.8130 10.9622 10.9944 11.4288 11.4405 11.6103 11.6355 12.1374 12.2766 k = 0.3333 0.5774 0.3151 ( 5109 PWs) bands (ev): -20.0201 -20.0201 -18.8124 -18.8090 -16.3979 -16.2966 -15.6753 -15.5516 -13.6490 -13.6456 -12.8734 -12.8650 -12.5456 -12.5421 -6.2650 -6.2505 -4.9674 -4.8865 -4.7607 -4.6587 -3.9571 -3.9475 -3.8935 -3.8796 -2.6578 -2.5910 -2.1133 -1.9255 -1.6948 -1.6333 -0.4957 -0.4691 0.0262 0.0468 0.0563 0.0580 0.3067 0.3107 1.8598 1.8602 2.2779 2.2816 2.3408 2.3473 2.9470 2.9495 3.1503 3.1514 3.2397 3.2511 3.8290 3.8324 3.9666 3.9711 4.0619 4.0643 9.4607 9.4688 10.7832 10.8128 10.9460 10.9738 11.3829 11.3994 11.6462 11.6693 12.1982 12.3312 k = 0.3333 0.5774 0.3308 ( 5109 PWs) bands (ev): -20.0201 -20.0201 -18.8124 -18.8089 -16.3978 -16.2965 -15.6752 -15.5515 -13.6492 -13.6457 -12.8735 -12.8652 -12.5462 -12.5427 -6.2639 -6.2489 -4.9686 -4.8886 -4.7600 -4.6541 -3.9532 -3.9470 -3.8871 -3.8723 -2.6588 -2.5914 -2.1165 -1.9285 -1.6971 -1.6351 -0.5119 -0.4848 0.0204 0.0409 0.0514 0.0526 0.3074 0.3114 1.8604 1.8608 2.2777 2.2815 2.3412 2.3479 2.9502 2.9527 3.1641 3.1652 3.2415 3.2529 3.8367 3.8406 3.9716 3.9766 4.0653 4.0677 9.4591 9.4674 10.7778 10.8121 10.9295 10.9522 11.3385 11.3587 11.6840 11.7055 12.2613 12.3892 k = 0.3333 0.5774 0.3466 ( 5109 PWs) bands (ev): -20.0201 -20.0201 -18.8124 -18.8089 -16.3978 -16.2965 -15.6750 -15.5513 -13.6493 -13.6459 -12.8736 -12.8653 -12.5468 -12.5433 -6.2627 -6.2473 -4.9697 -4.8902 -4.7594 -4.6498 -3.9506 -3.9456 -3.8803 -3.8649 -2.6600 -2.5918 -2.1201 -1.9318 -1.6992 -1.6369 -0.5281 -0.5005 0.0147 0.0351 0.0468 0.0471 0.3081 0.3121 1.8610 1.8615 2.2774 2.2813 2.3414 2.3483 2.9534 2.9559 3.1778 3.1789 3.2433 3.2548 3.8444 3.8488 3.9765 3.9820 4.0688 4.0712 9.4573 9.4659 10.7709 10.8109 10.9133 10.9304 11.2963 11.3191 11.7230 11.7432 12.3261 12.4499 k = 0.3333 0.5774 0.3623 ( 5112 PWs) bands (ev): -20.0202 -20.0202 -18.8124 -18.8089 -16.3978 -16.2965 -15.6747 -15.5510 -13.6494 -13.6460 -12.8737 -12.8655 -12.5475 -12.5440 -6.2615 -6.2456 -4.9708 -4.8913 -4.7589 -4.6460 -3.9500 -3.9429 -3.8733 -3.8574 -2.6613 -2.5922 -2.1241 -1.9355 -1.7011 -1.6385 -0.5440 -0.5159 0.0094 0.0296 0.0418 0.0425 0.3088 0.3127 1.8617 1.8622 2.2771 2.2810 2.3414 2.3486 2.9567 2.9592 3.1912 3.1923 3.2451 3.2566 3.8520 3.8569 3.9814 3.9872 4.0724 4.0747 9.4554 9.4641 10.7623 10.8090 10.8979 10.9085 11.2566 11.2812 11.7626 11.7820 12.3923 12.5127 k = 0.3333 0.5774 0.3781 ( 5112 PWs) bands (ev): -20.0202 -20.0202 -18.8124 -18.8089 -16.3977 -16.2964 -15.6745 -15.5508 -13.6495 -13.6461 -12.8738 -12.8655 -12.5482 -12.5447 -6.2603 -6.2439 -4.9717 -4.8921 -4.7586 -4.6426 -3.9503 -3.9398 -3.8661 -3.8499 -2.6626 -2.5927 -2.1283 -1.9395 -1.7028 -1.6398 -0.5593 -0.5307 0.0043 0.0247 0.0367 0.0387 0.3094 0.3134 1.8624 1.8630 2.2768 2.2807 2.3413 2.3487 2.9599 2.9624 3.2039 3.2051 3.2469 3.2584 3.8594 3.8647 3.9860 3.9922 4.0760 4.0782 9.4533 9.4622 10.7521 10.8066 10.8836 10.8870 11.2196 11.2454 11.8021 11.8211 12.4597 12.5772 k = 0.3333 0.5774 0.3938 ( 5112 PWs) bands (ev): -20.0202 -20.0202 -18.8124 -18.8089 -16.3977 -16.2964 -15.6742 -15.5505 -13.6496 -13.6462 -12.8739 -12.8656 -12.5490 -12.5455 -6.2591 -6.2422 -4.9725 -4.8925 -4.7584 -4.6398 -3.9510 -3.9369 -3.8589 -3.8425 -2.6641 -2.5931 -2.1327 -1.9437 -1.7042 -1.6410 -0.5738 -0.5447 -0.0004 0.0202 0.0319 0.0354 0.3100 0.3139 1.8631 1.8637 2.2764 2.2804 2.3410 2.3486 2.9630 2.9655 3.2158 3.2172 3.2487 3.2602 3.8665 3.8722 3.9904 3.9970 4.0795 4.0817 9.4511 9.4602 10.7405 10.8036 10.8660 10.8704 11.1855 11.2120 11.8411 11.8599 12.5280 12.6432 Writing output data file RbGeIO6.save init_run : 1.28s CPU 0.75s WALL ( 1 calls) electrons : 434.51s CPU 326.62s WALL ( 1 calls) Called by init_run: wfcinit : 0.01s CPU 0.01s WALL ( 1 calls) potinit : 0.10s CPU 0.06s WALL ( 1 calls) Called by electrons: c_bands : 434.50s CPU 326.60s 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 : 0.27s CPU 0.15s WALL ( 1 calls) Called by c_bands: init_us_2 : 0.43s CPU 0.47s WALL ( 284 calls) cegterg : 391.34s CPU 301.26s WALL ( 641 calls) Called by sum_band: Called by *egterg: h_psi : 248.36s CPU 160.93s WALL ( 10936 calls) s_psi : 12.31s CPU 9.05s WALL ( 10936 calls) g_psi : 0.44s CPU 0.39s WALL ( 10011 calls) cdiaghg : 122.55s CPU 112.46s WALL ( 10295 calls) cegterg:over : 16.30s CPU 13.68s WALL ( 10011 calls) cegterg:upda : 14.77s CPU 13.00s WALL ( 10011 calls) cegterg:last : 5.82s CPU 5.75s WALL ( 1493 calls) cdiaghg:chol : 6.87s CPU 6.50s WALL ( 10295 calls) cdiaghg:inve : 4.73s CPU 4.39s WALL ( 10295 calls) cdiaghg:para : 8.08s CPU 7.47s WALL ( 20590 calls) Called by h_psi: h_psi:vloc : 218.65s CPU 138.34s WALL ( 10936 calls) h_psi:vnl : 29.06s CPU 22.11s WALL ( 10936 calls) add_vuspsi : 15.22s CPU 11.31s WALL ( 10936 calls) General routines calbec : 13.80s CPU 10.77s WALL ( 10936 calls) fft : 0.05s CPU 0.03s WALL ( 19 calls) ffts : 0.02s CPU 0.01s WALL ( 4 calls) fftw : 206.92s CPU 129.29s WALL ( 1115964 calls) interpolate : 0.03s CPU 0.02s WALL ( 4 calls) davcio : 0.32s CPU 1.19s WALL ( 568 calls) Parallel routines fft_scatter : 68.18s CPU 50.65s WALL ( 1115987 calls) PWSCF : 7m36.23s CPU 5m59.59s WALL This run was terminated on: 4: 7:54 12Feb2017 =------------------------------------------------------------------------------= JOB DONE. =------------------------------------------------------------------------------=