----------------------------- ------- calculate fc2 ------- ----------------------------- _ _ __ | |__ ___ _ __ ___ _ __ _ _ | '_ \| '_ \ / _ \| '_ \ / _ \ | '_ \| | | | | |_) | | | | (_) | | | | (_) || |_) | |_| | | .__/|_| |_|\___/|_| |_|\___(_) .__/ \__, | |_| |_| |___/ 2.47.1 -------------------------[time 2026-01-09 03:02:04]------------------------- Compiled with OpenMP support (max 128 threads). Running in phonopy.load mode. Python version 3.14.2 Spglib version 2.6.1 Crystal structure was read from "phonopy_mlp_eval_fc2_dataset.yaml.xz". Unit of length: angstrom Settings: Supercell: [2 2 2] Primitive matrix: [1. 0. 0.] [0. 1. 0.] [0. 0. 1.] Spacegroup: P2/c (13) Number of symmetry operations in supercell: 32 ------------------------------ primitive cell ------------------------------ Lattice vectors: a 5.192924010003664 0.000000000000000 0.000000000000000 b 0.000000000000000 6.277708829999999 0.000000000000000 c -1.622465907532208 0.000000000000000 5.035090207744963 Atomic positions (fractional): *1 Li 0.00000000000000 0.38741537426216 0.25000000000000 6.941 2 Li 0.00000000000000 0.61258462573784 0.75000000000000 6.941 *3 Li 0.50000000000000 0.15513938957465 0.25000000000000 6.941 *4 Li 0.50000000000000 0.57077446936253 0.25000000000000 6.941 5 Li 0.50000000000000 0.42922553063747 0.75000000000000 6.941 6 Li 0.50000000000000 0.84486061042535 0.75000000000000 6.941 *7 Bi 0.00000000000000 0.85061490184811 0.25000000000000 208.980 8 Bi 0.00000000000000 0.14938509815188 0.75000000000000 208.980 *9 O 0.74786043048040 0.62587595966639 0.01398319986221 15.999 *10 O 0.76195966138754 0.89260122427851 0.51350106379838 15.999 11 O 0.74786043048040 0.37412404033361 0.51398319986221 15.999 12 O 0.76195966138754 0.10739877572149 0.01350106379838 15.999 13 O 0.25213956951960 0.62587595966639 0.48601680013779 15.999 14 O 0.23804033861246 0.10739877572149 0.48649893620162 15.999 15 O 0.25213956951960 0.37412404033361 0.98601680013779 15.999 16 O 0.23804033861246 0.89260122427851 0.98649893620162 15.999 -------------------------------- unit cell --------------------------------- Lattice vectors: a 5.192924010003664 0.000000000000000 0.000000000000000 b 0.000000000000000 6.277708829999999 0.000000000000000 c -1.622465907532208 0.000000000000000 5.035090207744963 Atomic positions (fractional): *1 Li 0.00000000000000 0.38741537426216 0.25000000000000 6.941 > 1 2 Li 0.00000000000000 0.61258462573784 0.75000000000000 6.941 > 2 *3 Li 0.50000000000000 0.15513938957465 0.25000000000000 6.941 > 3 *4 Li 0.50000000000000 0.57077446936253 0.25000000000000 6.941 > 4 5 Li 0.50000000000000 0.42922553063747 0.75000000000000 6.941 > 5 6 Li 0.50000000000000 0.84486061042535 0.75000000000000 6.941 > 6 *7 Bi 0.00000000000000 0.85061490184811 0.25000000000000 208.980 > 7 8 Bi 0.00000000000000 0.14938509815188 0.75000000000000 208.980 > 8 *9 O 0.74786043048040 0.62587595966639 0.01398319986221 15.999 > 9 *10 O 0.76195966138754 0.89260122427851 0.51350106379838 15.999 > 10 11 O 0.74786043048040 0.37412404033361 0.51398319986221 15.999 > 11 12 O 0.76195966138754 0.10739877572149 0.01350106379838 15.999 > 12 13 O 0.25213956951960 0.62587595966639 0.48601680013779 15.999 > 13 14 O 0.23804033861246 0.10739877572149 0.48649893620162 15.999 > 14 15 O 0.25213956951960 0.37412404033361 0.98601680013779 15.999 > 15 16 O 0.23804033861246 0.89260122427851 0.98649893620162 15.999 > 16 -------------------------------- super cell -------------------------------- Lattice vectors: a 10.385848020007328 0.000000000000000 0.000000000000000 b 0.000000000000000 12.555417659999998 0.000000000000000 c -3.244931815064416 0.000000000000000 10.070180415489926 Atomic positions (fractional): *1 Li 0.00000000000000 0.19370768713108 0.12500000000000 6.941 > 1 2 Li 0.50000000000000 0.19370768713108 0.12500000000000 6.941 > 1 3 Li 0.00000000000000 0.69370768713108 0.12500000000000 6.941 > 1 4 Li 0.50000000000000 0.69370768713108 0.12500000000000 6.941 > 1 5 Li 0.00000000000000 0.19370768713108 0.62500000000000 6.941 > 1 6 Li 0.50000000000000 0.19370768713108 0.62500000000000 6.941 > 1 7 Li 0.00000000000000 0.69370768713108 0.62500000000000 6.941 > 1 8 Li 0.50000000000000 0.69370768713108 0.62500000000000 6.941 > 1 9 Li 0.00000000000000 0.30629231286892 0.37500000000000 6.941 > 2 10 Li 0.50000000000000 0.30629231286892 0.37500000000000 6.941 > 2 11 Li 0.00000000000000 0.80629231286892 0.37500000000000 6.941 > 2 12 Li 0.50000000000000 0.80629231286892 0.37500000000000 6.941 > 2 13 Li 0.00000000000000 0.30629231286892 0.87500000000000 6.941 > 2 14 Li 0.50000000000000 0.30629231286892 0.87500000000000 6.941 > 2 15 Li 0.00000000000000 0.80629231286892 0.87500000000000 6.941 > 2 16 Li 0.50000000000000 0.80629231286892 0.87500000000000 6.941 > 2 *17 Li 0.25000000000000 0.07756969478733 0.12500000000000 6.941 > 3 18 Li 0.75000000000000 0.07756969478733 0.12500000000000 6.941 > 3 19 Li 0.25000000000000 0.57756969478733 0.12500000000000 6.941 > 3 20 Li 0.75000000000000 0.57756969478733 0.12500000000000 6.941 > 3 21 Li 0.25000000000000 0.07756969478733 0.62500000000000 6.941 > 3 22 Li 0.75000000000000 0.07756969478733 0.62500000000000 6.941 > 3 23 Li 0.25000000000000 0.57756969478733 0.62500000000000 6.941 > 3 24 Li 0.75000000000000 0.57756969478733 0.62500000000000 6.941 > 3 *25 Li 0.25000000000000 0.28538723468126 0.12500000000000 6.941 > 4 26 Li 0.75000000000000 0.28538723468126 0.12500000000000 6.941 > 4 27 Li 0.25000000000000 0.78538723468126 0.12500000000000 6.941 > 4 28 Li 0.75000000000000 0.78538723468126 0.12500000000000 6.941 > 4 29 Li 0.25000000000000 0.28538723468126 0.62500000000000 6.941 > 4 30 Li 0.75000000000000 0.28538723468126 0.62500000000000 6.941 > 4 31 Li 0.25000000000000 0.78538723468126 0.62500000000000 6.941 > 4 32 Li 0.75000000000000 0.78538723468126 0.62500000000000 6.941 > 4 33 Li 0.25000000000000 0.21461276531874 0.37500000000000 6.941 > 5 34 Li 0.75000000000000 0.21461276531874 0.37500000000000 6.941 > 5 35 Li 0.25000000000000 0.71461276531874 0.37500000000000 6.941 > 5 36 Li 0.75000000000000 0.71461276531874 0.37500000000000 6.941 > 5 37 Li 0.25000000000000 0.21461276531874 0.87500000000000 6.941 > 5 38 Li 0.75000000000000 0.21461276531874 0.87500000000000 6.941 > 5 39 Li 0.25000000000000 0.71461276531874 0.87500000000000 6.941 > 5 40 Li 0.75000000000000 0.71461276531874 0.87500000000000 6.941 > 5 41 Li 0.25000000000000 0.42243030521267 0.37500000000000 6.941 > 6 42 Li 0.75000000000000 0.42243030521267 0.37500000000000 6.941 > 6 43 Li 0.25000000000000 0.92243030521267 0.37500000000000 6.941 > 6 44 Li 0.75000000000000 0.92243030521267 0.37500000000000 6.941 > 6 45 Li 0.25000000000000 0.42243030521267 0.87500000000000 6.941 > 6 46 Li 0.75000000000000 0.42243030521267 0.87500000000000 6.941 > 6 47 Li 0.25000000000000 0.92243030521267 0.87500000000000 6.941 > 6 48 Li 0.75000000000000 0.92243030521267 0.87500000000000 6.941 > 6 *49 Bi 0.00000000000000 0.42530745092406 0.12500000000000 208.980 > 7 50 Bi 0.50000000000000 0.42530745092406 0.12500000000000 208.980 > 7 51 Bi 0.00000000000000 0.92530745092406 0.12500000000000 208.980 > 7 52 Bi 0.50000000000000 0.92530745092406 0.12500000000000 208.980 > 7 53 Bi 0.00000000000000 0.42530745092406 0.62500000000000 208.980 > 7 54 Bi 0.50000000000000 0.42530745092406 0.62500000000000 208.980 > 7 55 Bi 0.00000000000000 0.92530745092406 0.62500000000000 208.980 > 7 56 Bi 0.50000000000000 0.92530745092406 0.62500000000000 208.980 > 7 57 Bi 0.00000000000000 0.07469254907594 0.37500000000000 208.980 > 8 58 Bi 0.50000000000000 0.07469254907594 0.37500000000000 208.980 > 8 59 Bi 0.00000000000000 0.57469254907594 0.37500000000000 208.980 > 8 60 Bi 0.50000000000000 0.57469254907594 0.37500000000000 208.980 > 8 61 Bi 0.00000000000000 0.07469254907594 0.87500000000000 208.980 > 8 62 Bi 0.50000000000000 0.07469254907594 0.87500000000000 208.980 > 8 63 Bi 0.00000000000000 0.57469254907594 0.87500000000000 208.980 > 8 64 Bi 0.50000000000000 0.57469254907594 0.87500000000000 208.980 > 8 *65 O 0.37393021524020 0.31293797983319 0.00699159993110 15.999 > 9 66 O 0.87393021524020 0.31293797983319 0.00699159993110 15.999 > 9 67 O 0.37393021524020 0.81293797983319 0.00699159993110 15.999 > 9 68 O 0.87393021524020 0.81293797983319 0.00699159993110 15.999 > 9 69 O 0.37393021524020 0.31293797983319 0.50699159993110 15.999 > 9 70 O 0.87393021524020 0.31293797983319 0.50699159993110 15.999 > 9 71 O 0.37393021524020 0.81293797983319 0.50699159993110 15.999 > 9 72 O 0.87393021524020 0.81293797983319 0.50699159993110 15.999 > 9 *73 O 0.38097983069377 0.44630061213926 0.25675053189919 15.999 > 10 74 O 0.88097983069377 0.44630061213926 0.25675053189919 15.999 > 10 75 O 0.38097983069377 0.94630061213926 0.25675053189919 15.999 > 10 76 O 0.88097983069377 0.94630061213926 0.25675053189919 15.999 > 10 77 O 0.38097983069377 0.44630061213926 0.75675053189919 15.999 > 10 78 O 0.88097983069377 0.44630061213926 0.75675053189919 15.999 > 10 79 O 0.38097983069377 0.94630061213926 0.75675053189919 15.999 > 10 80 O 0.88097983069377 0.94630061213926 0.75675053189919 15.999 > 10 81 O 0.37393021524020 0.18706202016681 0.25699159993110 15.999 > 11 82 O 0.87393021524020 0.18706202016681 0.25699159993110 15.999 > 11 83 O 0.37393021524020 0.68706202016681 0.25699159993110 15.999 > 11 84 O 0.87393021524020 0.68706202016681 0.25699159993110 15.999 > 11 85 O 0.37393021524020 0.18706202016681 0.75699159993110 15.999 > 11 86 O 0.87393021524020 0.18706202016681 0.75699159993110 15.999 > 11 87 O 0.37393021524020 0.68706202016681 0.75699159993110 15.999 > 11 88 O 0.87393021524020 0.68706202016681 0.75699159993110 15.999 > 11 89 O 0.38097983069377 0.05369938786074 0.00675053189919 15.999 > 12 90 O 0.88097983069377 0.05369938786074 0.00675053189919 15.999 > 12 91 O 0.38097983069377 0.55369938786074 0.00675053189919 15.999 > 12 92 O 0.88097983069377 0.55369938786074 0.00675053189919 15.999 > 12 93 O 0.38097983069377 0.05369938786074 0.50675053189919 15.999 > 12 94 O 0.88097983069377 0.05369938786074 0.50675053189919 15.999 > 12 95 O 0.38097983069377 0.55369938786074 0.50675053189919 15.999 > 12 96 O 0.88097983069377 0.55369938786074 0.50675053189919 15.999 > 12 97 O 0.12606978475980 0.31293797983319 0.24300840006890 15.999 > 13 98 O 0.62606978475980 0.31293797983319 0.24300840006890 15.999 > 13 99 O 0.12606978475980 0.81293797983319 0.24300840006890 15.999 > 13 100 O 0.62606978475980 0.81293797983319 0.24300840006890 15.999 > 13 101 O 0.12606978475980 0.31293797983319 0.74300840006890 15.999 > 13 102 O 0.62606978475980 0.31293797983319 0.74300840006890 15.999 > 13 103 O 0.12606978475980 0.81293797983319 0.74300840006890 15.999 > 13 104 O 0.62606978475980 0.81293797983319 0.74300840006890 15.999 > 13 105 O 0.11902016930623 0.05369938786074 0.24324946810081 15.999 > 14 106 O 0.61902016930623 0.05369938786074 0.24324946810081 15.999 > 14 107 O 0.11902016930623 0.55369938786074 0.24324946810081 15.999 > 14 108 O 0.61902016930623 0.55369938786074 0.24324946810081 15.999 > 14 109 O 0.11902016930623 0.05369938786074 0.74324946810081 15.999 > 14 110 O 0.61902016930623 0.05369938786074 0.74324946810081 15.999 > 14 111 O 0.11902016930623 0.55369938786074 0.74324946810081 15.999 > 14 112 O 0.61902016930623 0.55369938786074 0.74324946810081 15.999 > 14 113 O 0.12606978475980 0.18706202016681 0.49300840006890 15.999 > 15 114 O 0.62606978475980 0.18706202016681 0.49300840006890 15.999 > 15 115 O 0.12606978475980 0.68706202016681 0.49300840006890 15.999 > 15 116 O 0.62606978475980 0.68706202016681 0.49300840006890 15.999 > 15 117 O 0.12606978475980 0.18706202016681 0.99300840006890 15.999 > 15 118 O 0.62606978475980 0.18706202016681 0.99300840006890 15.999 > 15 119 O 0.12606978475980 0.68706202016681 0.99300840006890 15.999 > 15 120 O 0.62606978475980 0.68706202016681 0.99300840006890 15.999 > 15 121 O 0.11902016930623 0.44630061213926 0.49324946810081 15.999 > 16 122 O 0.61902016930623 0.44630061213926 0.49324946810081 15.999 > 16 123 O 0.11902016930623 0.94630061213926 0.49324946810081 15.999 > 16 124 O 0.61902016930623 0.94630061213926 0.49324946810081 15.999 > 16 125 O 0.11902016930623 0.44630061213926 0.99324946810081 15.999 > 16 126 O 0.61902016930623 0.44630061213926 0.99324946810081 15.999 > 16 127 O 0.11902016930623 0.94630061213926 0.99324946810081 15.999 > 16 128 O 0.61902016930623 0.94630061213926 0.99324946810081 15.999 > 16 ---------------------------------------------------------------------------- NAC parameters were read from "phonopy_mlp_eval_fc2_dataset.yaml.xz". --------------------------- Dielectric constant ---------------------------- 4.2215548 0.0000000 -0.0361731 0.0000000 4.7069027 0.0000000 -0.0361728 0.0000000 4.7950241 -------------------------- Born effective charges -------------------------- 1 Li 0.7415392 -0.0000000 -0.1505251 -0.0000000 1.3242102 0.0000000 -0.2365923 0.0000000 1.0204411 2 Li 0.7415392 -0.0000000 -0.1505251 -0.0000000 1.3242102 0.0000000 -0.2365923 0.0000000 1.0204411 3 Li 1.5100392 -0.0000000 0.0236876 -0.0000000 0.7738909 0.0000000 -0.0086559 0.0000000 1.1844805 4 Li 1.3312634 -0.0000000 0.2057294 -0.0000000 1.4353411 0.0000000 0.3262932 0.0000000 1.1862139 5 Li 1.3312634 -0.0000000 0.2057294 -0.0000000 1.4353411 0.0000000 0.3262932 0.0000000 1.1862139 6 Li 1.5100392 -0.0000000 0.0236876 -0.0000000 0.7738909 0.0000000 -0.0086559 0.0000000 1.1844805 7 Bi 3.2265806 -0.0000000 -0.4046259 -0.0000000 4.2220931 0.0000000 -0.5090930 0.0000000 5.0549750 8 Bi 3.2265806 -0.0000000 -0.4046259 -0.0000000 4.2220931 0.0000000 -0.5090930 0.0000000 5.0549750 9 O -1.6866535 -0.3170963 -0.2740280 -0.2572670 -2.1326851 -0.3051454 -0.1476581 -0.1939499 -1.8832800 10 O -1.7180577 0.0813261 0.4368950 0.0904180 -1.7450825 -0.4236079 0.3616821 -0.5126576 -2.3397752 11 O -1.6866535 0.3170963 -0.2740280 0.2572670 -2.1326851 0.3051454 -0.1476581 0.1939499 -1.8832800 12 O -1.7180577 -0.0813261 0.4368950 -0.0904180 -1.7450825 0.4236079 0.3616821 0.5126576 -2.3397752 13 O -1.6866535 0.3170963 -0.2740280 0.2572670 -2.1326851 0.3051454 -0.1476581 0.1939499 -1.8832800 14 O -1.7180577 0.0813261 0.4368950 0.0904180 -1.7450825 -0.4236079 0.3616821 -0.5126576 -2.3397752 15 O -1.6866535 -0.3170963 -0.2740280 -0.2572670 -2.1326851 -0.3051454 -0.1476581 -0.1939499 -1.8832800 16 O -1.7180577 -0.0813261 0.4368950 -0.0904180 -1.7450825 0.4236079 0.3616821 0.5126576 -2.3397752 ---------------------------------------------------------------------------- Displacement-force dataset was read from "phonopy_mlp_eval_fc2_dataset.yaml.xz". -------------------------------- Symfc start ------------------------------- Symfc version 1.5.4 (https://github.com/symfc/symfc) Citation: A. Seko and A. Togo, Phys. Rev. B, 110, 214302 (2024) Computing [2] order force constants. Permutation basis: 384/384 Permutation basis: 9696/9696 Construct permutation basis matrix. Finding block diagonal structure in projector. Using scipy connected_components. Rank of projector: 2464 Number of blocks in projector: 2464 Finding block diagonal structure in projector. Using scipy connected_components. Number of blocks in projector (Sum rule): 6 --- Eigsh_solver_block: 1 / 6 --- Block_size: 544 Use submatrix version of eigh solver. (1) Block: 544 / 544 (2) Block: 250 / 544 (2) 239 eigenvectors found. (2) Block: 544 / 544 (2) 285 eigenvectors found. (2) Complementary block size: 20 (2) Compute compressed projector. (2) Use standard solver. (2) 9 eigenvectors found. (1) 533 eigenvectors found. (1) Complementary block size: 10 (1) Compute compressed projector. (1) Use standard solver. (1) 0 eigenvectors found. --- Eigsh_solver_block: 2 / 6 --- Block_size: 480 Use standard eigh solver. --- Eigsh_solver_block: 3 / 6 --- Block_size: 480 Use standard eigh solver. --- Eigsh_solver_block: 4 / 6 --- Block_size: 320 Use standard eigh solver. --- Eigsh_solver_block: 5 / 6 --- Block_size: 320 Use standard eigh solver. --- Eigsh_solver_block: 6 / 6 --- Block_size: 320 Use standard eigh solver. Tree of FC basis block matrices: - (2464, 2427), data: False |-- (320, 314), data: True |-- (320, 314), data: True |-- (320, 314), data: True |-- (480, 476), data: True |-- (480, 476), data: True |-- (544, 533), data: False |-- (544, 533), data: False |-- (544, 9), data: (544, 20) @ (20, 9) |-- (294, 285), data: True |-- (250, 239), data: True ----- Solver_atoms: 1 -- 128 / 128 Time (Solver_compr_matrix_reshape): 0.005 Solver_block: 100 / 480 - Time: 0.806 Solver_block: 200 / 480 - Time: 0.744 Solver_block: 300 / 480 - Time: 0.731 Solver_block: 400 / 480 - Time: 0.733 Solver_block: 480 / 480 - Time: 0.619 Solver: Calculate X.T @ X and X.T @ y (disp @ compr @ eigvecs).T @ (disp @ compr @ eigvecs): 3.732 --------------------------------- Symfc end -------------------------------- Max drift of force constants: -0.00000000 (yy) -0.00000000 (yy) Permutation basis: 384/384 Permutation basis: 9696/9696 Construct permutation basis matrix. Finding block diagonal structure in projector. Using scipy connected_components. Rank of projector: 2464 Number of blocks in projector: 2464 Finding block diagonal structure in projector. Using scipy connected_components. Number of blocks in projector (Sum rule): 6 --- Eigsh_solver_block: 1 / 6 --- Block_size: 544 Use submatrix version of eigh solver. (1) Block: 544 / 544 (2) Block: 250 / 544 (2) 239 eigenvectors found. (2) Block: 544 / 544 (2) 285 eigenvectors found. (2) Complementary block size: 20 (2) Compute compressed projector. (2) Use standard solver. (2) 9 eigenvectors found. (1) 533 eigenvectors found. (1) Complementary block size: 10 (1) Compute compressed projector. (1) Use standard solver. (1) 0 eigenvectors found. --- Eigsh_solver_block: 2 / 6 --- Block_size: 480 Use standard eigh solver. --- Eigsh_solver_block: 3 / 6 --- Block_size: 480 Use standard eigh solver. --- Eigsh_solver_block: 4 / 6 --- Block_size: 320 Use standard eigh solver. --- Eigsh_solver_block: 5 / 6 --- Block_size: 320 Use standard eigh solver. --- Eigsh_solver_block: 6 / 6 --- Block_size: 320 Use standard eigh solver. Tree of FC basis block matrices: - (2464, 2427), data: False |-- (320, 314), data: True |-- (320, 314), data: True |-- (320, 314), data: True |-- (480, 476), data: True |-- (480, 476), data: True |-- (544, 533), data: False |-- (544, 533), data: False |-- (544, 9), data: (544, 20) @ (20, 9) |-- (294, 285), data: True |-- (250, 239), data: True Max drift after symmetrization by symfc projector: -0.00000000 (yy) -0.00000000 (yy) Force constants are written into "force_constants.hdf5". ---------------------------------------------------------------------------- One of the following run modes may be specified for phonon calculations. - Mesh sampling (MESH, --mesh) - Q-points (QPOINTS, --qpoints) - Band structure (BAND, --band) - Animation (ANIME, --anime) - Modulation (MODULATION, --modulation) - Characters of Irreps (IRREPS, --irreps) - Create displacements (CREATE_DISPLACEMENTS, -d) ---------------------------------------------------------------------------- Summary of calculation was written in "phonopy.yaml". -------------------------[time 2026-01-09 03:02:31]------------------------- _ ___ _ __ __| | / _ \ '_ \ / _` | | __/ | | | (_| | \___|_| |_|\__,_| ---------------------------- ------ calculate fc3 ------- ---------------------------- _ _____ _ __ | |__ ___ _ __ ___|___ / _ __ _ _ | '_ \| '_ \ / _ \| '_ \ / _ \ |_ \| '_ \| | | | | |_) | | | | (_) | | | | (_) |__) | |_) | |_| | | .__/|_| |_|\___/|_| |_|\___/____/| .__/ \__, | |_| |_| |___/ 3.23.0 -------------------------[time 2026-01-09 03:02:31]------------------------- Compiled with OpenMP support (max 128 threads). Running in phono3py.load mode. Python version 3.14.2 Spglib version 2.6.1 ----------------------------- General settings ----------------------------- Run mode: force constants HDF5 data compression filter: gzip Crystal structure was read from "phono3py_mlp_eval_fc3_disp.yaml.xz". Supercell (dim): [2 2 2] Primitive matrix: [1. 0. 0.] [0. 1. 0.] [0. 0. 1.] Spacegroup: P2/c (13) ------------------------------ primitive cell ------------------------------ Lattice vectors: a 5.192924010003664 0.000000000000000 0.000000000000000 b 0.000000000000000 6.277708829999999 0.000000000000000 c -1.622465907532208 0.000000000000000 5.035090207744963 Atomic positions (fractional): 1 Li 0.00000000000000 0.38741537426216 0.25000000000000 6.941 2 Li 0.00000000000000 0.61258462573784 0.75000000000000 6.941 3 Li 0.50000000000000 0.15513938957465 0.25000000000000 6.941 4 Li 0.50000000000000 0.57077446936253 0.25000000000000 6.941 5 Li 0.50000000000000 0.42922553063747 0.75000000000000 6.941 6 Li 0.50000000000000 0.84486061042535 0.75000000000000 6.941 7 Bi 0.00000000000000 0.85061490184811 0.25000000000000 208.980 8 Bi 0.00000000000000 0.14938509815188 0.75000000000000 208.980 9 O 0.74786043048040 0.62587595966639 0.01398319986221 15.999 10 O 0.76195966138754 0.89260122427851 0.51350106379838 15.999 11 O 0.74786043048040 0.37412404033361 0.51398319986221 15.999 12 O 0.76195966138754 0.10739877572149 0.01350106379838 15.999 13 O 0.25213956951960 0.62587595966639 0.48601680013779 15.999 14 O 0.23804033861246 0.10739877572149 0.48649893620162 15.999 15 O 0.25213956951960 0.37412404033361 0.98601680013779 15.999 16 O 0.23804033861246 0.89260122427851 0.98649893620162 15.999 -------------------------------- supercell --------------------------------- Lattice vectors: a 10.385848020007328 0.000000000000000 0.000000000000000 b 0.000000000000000 12.555417659999998 0.000000000000000 c -3.244931815064416 0.000000000000000 10.070180415489926 Atomic positions (fractional): 1 Li 0.00000000000000 0.19370768713108 0.12500000000000 6.941 > 1 2 Li 0.50000000000000 0.19370768713108 0.12500000000000 6.941 > 1 3 Li 0.00000000000000 0.69370768713108 0.12500000000000 6.941 > 1 4 Li 0.50000000000000 0.69370768713108 0.12500000000000 6.941 > 1 5 Li 0.00000000000000 0.19370768713108 0.62500000000000 6.941 > 1 6 Li 0.50000000000000 0.19370768713108 0.62500000000000 6.941 > 1 7 Li 0.00000000000000 0.69370768713108 0.62500000000000 6.941 > 1 8 Li 0.50000000000000 0.69370768713108 0.62500000000000 6.941 > 1 9 Li 0.00000000000000 0.30629231286892 0.37500000000000 6.941 > 9 10 Li 0.50000000000000 0.30629231286892 0.37500000000000 6.941 > 9 11 Li 0.00000000000000 0.80629231286892 0.37500000000000 6.941 > 9 12 Li 0.50000000000000 0.80629231286892 0.37500000000000 6.941 > 9 13 Li 0.00000000000000 0.30629231286892 0.87500000000000 6.941 > 9 14 Li 0.50000000000000 0.30629231286892 0.87500000000000 6.941 > 9 15 Li 0.00000000000000 0.80629231286892 0.87500000000000 6.941 > 9 16 Li 0.50000000000000 0.80629231286892 0.87500000000000 6.941 > 9 17 Li 0.25000000000000 0.07756969478733 0.12500000000000 6.941 > 17 18 Li 0.75000000000000 0.07756969478733 0.12500000000000 6.941 > 17 19 Li 0.25000000000000 0.57756969478733 0.12500000000000 6.941 > 17 20 Li 0.75000000000000 0.57756969478733 0.12500000000000 6.941 > 17 21 Li 0.25000000000000 0.07756969478733 0.62500000000000 6.941 > 17 22 Li 0.75000000000000 0.07756969478733 0.62500000000000 6.941 > 17 23 Li 0.25000000000000 0.57756969478733 0.62500000000000 6.941 > 17 24 Li 0.75000000000000 0.57756969478733 0.62500000000000 6.941 > 17 25 Li 0.25000000000000 0.28538723468126 0.12500000000000 6.941 > 25 26 Li 0.75000000000000 0.28538723468126 0.12500000000000 6.941 > 25 27 Li 0.25000000000000 0.78538723468126 0.12500000000000 6.941 > 25 28 Li 0.75000000000000 0.78538723468126 0.12500000000000 6.941 > 25 29 Li 0.25000000000000 0.28538723468126 0.62500000000000 6.941 > 25 30 Li 0.75000000000000 0.28538723468126 0.62500000000000 6.941 > 25 31 Li 0.25000000000000 0.78538723468126 0.62500000000000 6.941 > 25 32 Li 0.75000000000000 0.78538723468126 0.62500000000000 6.941 > 25 33 Li 0.25000000000000 0.21461276531874 0.37500000000000 6.941 > 33 34 Li 0.75000000000000 0.21461276531874 0.37500000000000 6.941 > 33 35 Li 0.25000000000000 0.71461276531874 0.37500000000000 6.941 > 33 36 Li 0.75000000000000 0.71461276531874 0.37500000000000 6.941 > 33 37 Li 0.25000000000000 0.21461276531874 0.87500000000000 6.941 > 33 38 Li 0.75000000000000 0.21461276531874 0.87500000000000 6.941 > 33 39 Li 0.25000000000000 0.71461276531874 0.87500000000000 6.941 > 33 40 Li 0.75000000000000 0.71461276531874 0.87500000000000 6.941 > 33 41 Li 0.25000000000000 0.42243030521267 0.37500000000000 6.941 > 41 42 Li 0.75000000000000 0.42243030521267 0.37500000000000 6.941 > 41 43 Li 0.25000000000000 0.92243030521267 0.37500000000000 6.941 > 41 44 Li 0.75000000000000 0.92243030521267 0.37500000000000 6.941 > 41 45 Li 0.25000000000000 0.42243030521267 0.87500000000000 6.941 > 41 46 Li 0.75000000000000 0.42243030521267 0.87500000000000 6.941 > 41 47 Li 0.25000000000000 0.92243030521267 0.87500000000000 6.941 > 41 48 Li 0.75000000000000 0.92243030521267 0.87500000000000 6.941 > 41 49 Bi 0.00000000000000 0.42530745092406 0.12500000000000 208.980 > 49 50 Bi 0.50000000000000 0.42530745092406 0.12500000000000 208.980 > 49 51 Bi 0.00000000000000 0.92530745092406 0.12500000000000 208.980 > 49 52 Bi 0.50000000000000 0.92530745092406 0.12500000000000 208.980 > 49 53 Bi 0.00000000000000 0.42530745092406 0.62500000000000 208.980 > 49 54 Bi 0.50000000000000 0.42530745092406 0.62500000000000 208.980 > 49 55 Bi 0.00000000000000 0.92530745092406 0.62500000000000 208.980 > 49 56 Bi 0.50000000000000 0.92530745092406 0.62500000000000 208.980 > 49 57 Bi 0.00000000000000 0.07469254907594 0.37500000000000 208.980 > 57 58 Bi 0.50000000000000 0.07469254907594 0.37500000000000 208.980 > 57 59 Bi 0.00000000000000 0.57469254907594 0.37500000000000 208.980 > 57 60 Bi 0.50000000000000 0.57469254907594 0.37500000000000 208.980 > 57 61 Bi 0.00000000000000 0.07469254907594 0.87500000000000 208.980 > 57 62 Bi 0.50000000000000 0.07469254907594 0.87500000000000 208.980 > 57 63 Bi 0.00000000000000 0.57469254907594 0.87500000000000 208.980 > 57 64 Bi 0.50000000000000 0.57469254907594 0.87500000000000 208.980 > 57 65 O 0.37393021524020 0.31293797983319 0.00699159993110 15.999 > 65 66 O 0.87393021524020 0.31293797983319 0.00699159993110 15.999 > 65 67 O 0.37393021524020 0.81293797983319 0.00699159993110 15.999 > 65 68 O 0.87393021524020 0.81293797983319 0.00699159993110 15.999 > 65 69 O 0.37393021524020 0.31293797983319 0.50699159993110 15.999 > 65 70 O 0.87393021524020 0.31293797983319 0.50699159993110 15.999 > 65 71 O 0.37393021524020 0.81293797983319 0.50699159993110 15.999 > 65 72 O 0.87393021524020 0.81293797983319 0.50699159993110 15.999 > 65 73 O 0.38097983069377 0.44630061213926 0.25675053189919 15.999 > 73 74 O 0.88097983069377 0.44630061213926 0.25675053189919 15.999 > 73 75 O 0.38097983069377 0.94630061213926 0.25675053189919 15.999 > 73 76 O 0.88097983069377 0.94630061213926 0.25675053189919 15.999 > 73 77 O 0.38097983069377 0.44630061213926 0.75675053189919 15.999 > 73 78 O 0.88097983069377 0.44630061213926 0.75675053189919 15.999 > 73 79 O 0.38097983069377 0.94630061213926 0.75675053189919 15.999 > 73 80 O 0.88097983069377 0.94630061213926 0.75675053189919 15.999 > 73 81 O 0.37393021524020 0.18706202016681 0.25699159993110 15.999 > 81 82 O 0.87393021524020 0.18706202016681 0.25699159993110 15.999 > 81 83 O 0.37393021524020 0.68706202016681 0.25699159993110 15.999 > 81 84 O 0.87393021524020 0.68706202016681 0.25699159993110 15.999 > 81 85 O 0.37393021524020 0.18706202016681 0.75699159993110 15.999 > 81 86 O 0.87393021524020 0.18706202016681 0.75699159993110 15.999 > 81 87 O 0.37393021524020 0.68706202016681 0.75699159993110 15.999 > 81 88 O 0.87393021524020 0.68706202016681 0.75699159993110 15.999 > 81 89 O 0.38097983069377 0.05369938786074 0.00675053189919 15.999 > 89 90 O 0.88097983069377 0.05369938786074 0.00675053189919 15.999 > 89 91 O 0.38097983069377 0.55369938786074 0.00675053189919 15.999 > 89 92 O 0.88097983069377 0.55369938786074 0.00675053189919 15.999 > 89 93 O 0.38097983069377 0.05369938786074 0.50675053189919 15.999 > 89 94 O 0.88097983069377 0.05369938786074 0.50675053189919 15.999 > 89 95 O 0.38097983069377 0.55369938786074 0.50675053189919 15.999 > 89 96 O 0.88097983069377 0.55369938786074 0.50675053189919 15.999 > 89 97 O 0.12606978475980 0.31293797983319 0.24300840006890 15.999 > 97 98 O 0.62606978475980 0.31293797983319 0.24300840006890 15.999 > 97 99 O 0.12606978475980 0.81293797983319 0.24300840006890 15.999 > 97 100 O 0.62606978475980 0.81293797983319 0.24300840006890 15.999 > 97 101 O 0.12606978475980 0.31293797983319 0.74300840006890 15.999 > 97 102 O 0.62606978475980 0.31293797983319 0.74300840006890 15.999 > 97 103 O 0.12606978475980 0.81293797983319 0.74300840006890 15.999 > 97 104 O 0.62606978475980 0.81293797983319 0.74300840006890 15.999 > 97 105 O 0.11902016930623 0.05369938786074 0.24324946810081 15.999 > 105 106 O 0.61902016930623 0.05369938786074 0.24324946810081 15.999 > 105 107 O 0.11902016930623 0.55369938786074 0.24324946810081 15.999 > 105 108 O 0.61902016930623 0.55369938786074 0.24324946810081 15.999 > 105 109 O 0.11902016930623 0.05369938786074 0.74324946810081 15.999 > 105 110 O 0.61902016930623 0.05369938786074 0.74324946810081 15.999 > 105 111 O 0.11902016930623 0.55369938786074 0.74324946810081 15.999 > 105 112 O 0.61902016930623 0.55369938786074 0.74324946810081 15.999 > 105 113 O 0.12606978475980 0.18706202016681 0.49300840006890 15.999 > 113 114 O 0.62606978475980 0.18706202016681 0.49300840006890 15.999 > 113 115 O 0.12606978475980 0.68706202016681 0.49300840006890 15.999 > 113 116 O 0.62606978475980 0.68706202016681 0.49300840006890 15.999 > 113 117 O 0.12606978475980 0.18706202016681 0.99300840006890 15.999 > 113 118 O 0.62606978475980 0.18706202016681 0.99300840006890 15.999 > 113 119 O 0.12606978475980 0.68706202016681 0.99300840006890 15.999 > 113 120 O 0.62606978475980 0.68706202016681 0.99300840006890 15.999 > 113 121 O 0.11902016930623 0.44630061213926 0.49324946810081 15.999 > 121 122 O 0.61902016930623 0.44630061213926 0.49324946810081 15.999 > 121 123 O 0.11902016930623 0.94630061213926 0.49324946810081 15.999 > 121 124 O 0.61902016930623 0.94630061213926 0.49324946810081 15.999 > 121 125 O 0.11902016930623 0.44630061213926 0.99324946810081 15.999 > 121 126 O 0.61902016930623 0.44630061213926 0.99324946810081 15.999 > 121 127 O 0.11902016930623 0.94630061213926 0.99324946810081 15.999 > 121 128 O 0.61902016930623 0.94630061213926 0.99324946810081 15.999 > 121 ---------------------------------------------------------------------------- NAC parameters were read from "phono3py_mlp_eval_fc3_disp.yaml.xz". --------------------------- Dielectric constant ---------------------------- 4.2215548 0.0000000 -0.0361731 0.0000000 4.7069027 0.0000000 -0.0361728 0.0000000 4.7950241 -------------------------- Born effective charges -------------------------- 1 Li 0.7415392 -0.0000000 -0.1505251 -0.0000000 1.3242102 0.0000000 -0.2365923 0.0000000 1.0204411 2 Li 0.7415392 -0.0000000 -0.1505251 -0.0000000 1.3242102 0.0000000 -0.2365923 0.0000000 1.0204411 3 Li 1.5100392 -0.0000000 0.0236876 -0.0000000 0.7738909 0.0000000 -0.0086559 0.0000000 1.1844805 4 Li 1.3312634 -0.0000000 0.2057294 -0.0000000 1.4353411 0.0000000 0.3262932 0.0000000 1.1862139 5 Li 1.3312634 -0.0000000 0.2057294 -0.0000000 1.4353411 0.0000000 0.3262932 0.0000000 1.1862139 6 Li 1.5100392 -0.0000000 0.0236876 -0.0000000 0.7738909 0.0000000 -0.0086559 0.0000000 1.1844805 7 Bi 3.2265806 -0.0000000 -0.4046259 -0.0000000 4.2220931 0.0000000 -0.5090930 0.0000000 5.0549750 8 Bi 3.2265806 -0.0000000 -0.4046259 -0.0000000 4.2220931 0.0000000 -0.5090930 0.0000000 5.0549750 9 O -1.6866535 -0.3170963 -0.2740280 -0.2572670 -2.1326851 -0.3051454 -0.1476581 -0.1939499 -1.8832800 10 O -1.7180577 0.0813261 0.4368950 0.0904180 -1.7450825 -0.4236079 0.3616821 -0.5126576 -2.3397752 11 O -1.6866535 0.3170963 -0.2740280 0.2572670 -2.1326851 0.3051454 -0.1476581 0.1939499 -1.8832800 12 O -1.7180577 -0.0813261 0.4368950 -0.0904180 -1.7450825 0.4236079 0.3616821 0.5126576 -2.3397752 13 O -1.6866535 0.3170963 -0.2740280 0.2572670 -2.1326851 0.3051454 -0.1476581 0.1939499 -1.8832800 14 O -1.7180577 0.0813261 0.4368950 0.0904180 -1.7450825 -0.4236079 0.3616821 -0.5126576 -2.3397752 15 O -1.6866535 -0.3170963 -0.2740280 -0.2572670 -2.1326851 -0.3051454 -0.1476581 -0.1939499 -1.8832800 16 O -1.7180577 -0.0813261 0.4368950 -0.0904180 -1.7450825 0.4236079 0.3616821 0.5126576 -2.3397752 ---------------------------------------------------------------------------- Sets of supercell forces were read from "FORCES_FC3.xz". Displacement dataset for fc3 was read from "phono3py_mlp_eval_fc3_disp.yaml.xz". ----------------------------- Force constants ------------------------------ Computing fc3[ 1, x, x ] using numpy.linalg.pinv. Displacements (in Angstrom): [ 0.0100 0.0000 0.0000] [-0.0100 0.0000 0.0000] [ 0.0000 0.0100 0.0000] [ 0.0000 -0.0100 0.0000] [-0.0031 0.0000 0.0095] [ 0.0031 0.0000 -0.0095] Computing fc3[ 17, x, x ] using numpy.linalg.pinv. Displacements (in Angstrom): [ 0.0100 0.0000 0.0000] [-0.0100 0.0000 0.0000] [ 0.0000 0.0100 0.0000] [ 0.0000 -0.0100 0.0000] [-0.0031 0.0000 0.0095] [ 0.0031 0.0000 -0.0095] Computing fc3[ 25, x, x ] using numpy.linalg.pinv. Displacements (in Angstrom): [ 0.0100 0.0000 0.0000] [-0.0100 0.0000 0.0000] [ 0.0000 0.0100 0.0000] [ 0.0000 -0.0100 0.0000] [-0.0031 0.0000 0.0095] [ 0.0031 0.0000 -0.0095] Computing fc3[ 49, x, x ] using numpy.linalg.pinv. Displacements (in Angstrom): [ 0.0100 0.0000 0.0000] [-0.0100 0.0000 0.0000] [ 0.0000 0.0100 0.0000] [ 0.0000 -0.0100 0.0000] [-0.0031 0.0000 0.0095] [ 0.0031 0.0000 -0.0095] Computing fc3[ 65, x, x ] using numpy.linalg.pinv. Displacements (in Angstrom): [ 0.0100 0.0000 0.0000] [-0.0100 0.0000 0.0000] [ 0.0000 0.0100 0.0000] [ 0.0000 -0.0100 0.0000] [-0.0031 0.0000 0.0095] [ 0.0031 0.0000 -0.0095] Computing fc3[ 73, x, x ] using numpy.linalg.pinv. Displacements (in Angstrom): [ 0.0100 0.0000 0.0000] [-0.0100 0.0000 0.0000] [ 0.0000 0.0100 0.0000] [ 0.0000 -0.0100 0.0000] [-0.0031 0.0000 0.0095] [ 0.0031 0.0000 -0.0095] Expanding fc3. Symmetrizing fc3 by traditional approach (N=3). Symmetrizing fc2 by traditional approach (N=3). Max drift of fc3: 0.00000013 (yyy) 0.00000013 (yyy) 0.00000013 (yyy) fc3 was written into "fc3.hdf5". Max drift of fc2: -0.00000003 (yz) -0.00000003 (yz) fc2 was written into "fc2.hdf5". --------------------------- Calculation settings --------------------------- Non-analytical term correction (NAC): True NAC unit conversion factor: 14.39965 BZ integration: Tetrahedron-method Temperatures: 0.0 300.0 Cutoff frequency: 0.01 Frequency conversion factor to THz: 15.63330 ----------- None of ph-ph interaction calculation was performed. ----------- Summary of calculation was written in "phono3py.yaml". -------------------------[time 2026-01-09 03:03:00]------------------------- _ ___ _ __ __| | / _ \ '_ \ / _` | | __/ | | | (_| | \___|_| |_|\__,_| ---------------------------- ------ calculate LTC ------- ---------------------------- _ _____ _ __ | |__ ___ _ __ ___|___ / _ __ _ _ | '_ \| '_ \ / _ \| '_ \ / _ \ |_ \| '_ \| | | | | |_) | | | | (_) | | | | (_) |__) | |_) | |_| | | .__/|_| |_|\___/|_| |_|\___/____/| .__/ \__, | |_| |_| |___/ 3.23.0 -------------------------[time 2026-01-09 03:03:01]------------------------- Compiled with OpenMP support (max 128 threads). Running in phono3py.load mode. Python version 3.14.2 Spglib version 2.6.1 ----------------------------- General settings ----------------------------- Run mode: conductivity-RTA HDF5 data compression filter: gzip Crystal structure was read from "phono3py.yaml". Supercell (dim): [2 2 2] Primitive matrix: [1. 0. 0.] [0. 1. 0.] [0. 0. 1.] Spacegroup: P2/c (13) ------------------------------ primitive cell ------------------------------ Lattice vectors: a 5.192924010003664 0.000000000000000 0.000000000000000 b 0.000000000000000 6.277708829999999 0.000000000000000 c -1.622465907532208 0.000000000000000 5.035090207744963 Atomic positions (fractional): 1 Li 0.00000000000000 0.38741537426216 0.25000000000000 6.941 2 Li 0.00000000000000 0.61258462573784 0.75000000000000 6.941 3 Li 0.50000000000000 0.15513938957465 0.25000000000000 6.941 4 Li 0.50000000000000 0.57077446936253 0.25000000000000 6.941 5 Li 0.50000000000000 0.42922553063747 0.75000000000000 6.941 6 Li 0.50000000000000 0.84486061042535 0.75000000000000 6.941 7 Bi 0.00000000000000 0.85061490184811 0.25000000000000 208.980 8 Bi 0.00000000000000 0.14938509815188 0.75000000000000 208.980 9 O 0.74786043048040 0.62587595966639 0.01398319986221 15.999 10 O 0.76195966138754 0.89260122427851 0.51350106379838 15.999 11 O 0.74786043048040 0.37412404033361 0.51398319986221 15.999 12 O 0.76195966138754 0.10739877572149 0.01350106379838 15.999 13 O 0.25213956951960 0.62587595966639 0.48601680013779 15.999 14 O 0.23804033861246 0.10739877572149 0.48649893620162 15.999 15 O 0.25213956951960 0.37412404033361 0.98601680013779 15.999 16 O 0.23804033861246 0.89260122427851 0.98649893620162 15.999 -------------------------------- supercell --------------------------------- Lattice vectors: a 10.385848020007328 0.000000000000000 0.000000000000000 b 0.000000000000000 12.555417659999998 0.000000000000000 c -3.244931815064416 0.000000000000000 10.070180415489926 Atomic positions (fractional): 1 Li 0.00000000000000 0.19370768713108 0.12500000000000 6.941 > 1 2 Li 0.50000000000000 0.19370768713108 0.12500000000000 6.941 > 1 3 Li 0.00000000000000 0.69370768713108 0.12500000000000 6.941 > 1 4 Li 0.50000000000000 0.69370768713108 0.12500000000000 6.941 > 1 5 Li 0.00000000000000 0.19370768713108 0.62500000000000 6.941 > 1 6 Li 0.50000000000000 0.19370768713108 0.62500000000000 6.941 > 1 7 Li 0.00000000000000 0.69370768713108 0.62500000000000 6.941 > 1 8 Li 0.50000000000000 0.69370768713108 0.62500000000000 6.941 > 1 9 Li 0.00000000000000 0.30629231286892 0.37500000000000 6.941 > 9 10 Li 0.50000000000000 0.30629231286892 0.37500000000000 6.941 > 9 11 Li 0.00000000000000 0.80629231286892 0.37500000000000 6.941 > 9 12 Li 0.50000000000000 0.80629231286892 0.37500000000000 6.941 > 9 13 Li 0.00000000000000 0.30629231286892 0.87500000000000 6.941 > 9 14 Li 0.50000000000000 0.30629231286892 0.87500000000000 6.941 > 9 15 Li 0.00000000000000 0.80629231286892 0.87500000000000 6.941 > 9 16 Li 0.50000000000000 0.80629231286892 0.87500000000000 6.941 > 9 17 Li 0.25000000000000 0.07756969478733 0.12500000000000 6.941 > 17 18 Li 0.75000000000000 0.07756969478733 0.12500000000000 6.941 > 17 19 Li 0.25000000000000 0.57756969478733 0.12500000000000 6.941 > 17 20 Li 0.75000000000000 0.57756969478733 0.12500000000000 6.941 > 17 21 Li 0.25000000000000 0.07756969478733 0.62500000000000 6.941 > 17 22 Li 0.75000000000000 0.07756969478733 0.62500000000000 6.941 > 17 23 Li 0.25000000000000 0.57756969478733 0.62500000000000 6.941 > 17 24 Li 0.75000000000000 0.57756969478733 0.62500000000000 6.941 > 17 25 Li 0.25000000000000 0.28538723468126 0.12500000000000 6.941 > 25 26 Li 0.75000000000000 0.28538723468126 0.12500000000000 6.941 > 25 27 Li 0.25000000000000 0.78538723468126 0.12500000000000 6.941 > 25 28 Li 0.75000000000000 0.78538723468126 0.12500000000000 6.941 > 25 29 Li 0.25000000000000 0.28538723468126 0.62500000000000 6.941 > 25 30 Li 0.75000000000000 0.28538723468126 0.62500000000000 6.941 > 25 31 Li 0.25000000000000 0.78538723468126 0.62500000000000 6.941 > 25 32 Li 0.75000000000000 0.78538723468126 0.62500000000000 6.941 > 25 33 Li 0.25000000000000 0.21461276531874 0.37500000000000 6.941 > 33 34 Li 0.75000000000000 0.21461276531874 0.37500000000000 6.941 > 33 35 Li 0.25000000000000 0.71461276531874 0.37500000000000 6.941 > 33 36 Li 0.75000000000000 0.71461276531874 0.37500000000000 6.941 > 33 37 Li 0.25000000000000 0.21461276531874 0.87500000000000 6.941 > 33 38 Li 0.75000000000000 0.21461276531874 0.87500000000000 6.941 > 33 39 Li 0.25000000000000 0.71461276531874 0.87500000000000 6.941 > 33 40 Li 0.75000000000000 0.71461276531874 0.87500000000000 6.941 > 33 41 Li 0.25000000000000 0.42243030521267 0.37500000000000 6.941 > 41 42 Li 0.75000000000000 0.42243030521267 0.37500000000000 6.941 > 41 43 Li 0.25000000000000 0.92243030521267 0.37500000000000 6.941 > 41 44 Li 0.75000000000000 0.92243030521267 0.37500000000000 6.941 > 41 45 Li 0.25000000000000 0.42243030521267 0.87500000000000 6.941 > 41 46 Li 0.75000000000000 0.42243030521267 0.87500000000000 6.941 > 41 47 Li 0.25000000000000 0.92243030521267 0.87500000000000 6.941 > 41 48 Li 0.75000000000000 0.92243030521267 0.87500000000000 6.941 > 41 49 Bi 0.00000000000000 0.42530745092406 0.12500000000000 208.980 > 49 50 Bi 0.50000000000000 0.42530745092406 0.12500000000000 208.980 > 49 51 Bi 0.00000000000000 0.92530745092406 0.12500000000000 208.980 > 49 52 Bi 0.50000000000000 0.92530745092406 0.12500000000000 208.980 > 49 53 Bi 0.00000000000000 0.42530745092406 0.62500000000000 208.980 > 49 54 Bi 0.50000000000000 0.42530745092406 0.62500000000000 208.980 > 49 55 Bi 0.00000000000000 0.92530745092406 0.62500000000000 208.980 > 49 56 Bi 0.50000000000000 0.92530745092406 0.62500000000000 208.980 > 49 57 Bi 0.00000000000000 0.07469254907594 0.37500000000000 208.980 > 57 58 Bi 0.50000000000000 0.07469254907594 0.37500000000000 208.980 > 57 59 Bi 0.00000000000000 0.57469254907594 0.37500000000000 208.980 > 57 60 Bi 0.50000000000000 0.57469254907594 0.37500000000000 208.980 > 57 61 Bi 0.00000000000000 0.07469254907594 0.87500000000000 208.980 > 57 62 Bi 0.50000000000000 0.07469254907594 0.87500000000000 208.980 > 57 63 Bi 0.00000000000000 0.57469254907594 0.87500000000000 208.980 > 57 64 Bi 0.50000000000000 0.57469254907594 0.87500000000000 208.980 > 57 65 O 0.37393021524020 0.31293797983319 0.00699159993110 15.999 > 65 66 O 0.87393021524020 0.31293797983319 0.00699159993110 15.999 > 65 67 O 0.37393021524020 0.81293797983319 0.00699159993110 15.999 > 65 68 O 0.87393021524020 0.81293797983319 0.00699159993110 15.999 > 65 69 O 0.37393021524020 0.31293797983319 0.50699159993110 15.999 > 65 70 O 0.87393021524020 0.31293797983319 0.50699159993110 15.999 > 65 71 O 0.37393021524020 0.81293797983319 0.50699159993110 15.999 > 65 72 O 0.87393021524020 0.81293797983319 0.50699159993110 15.999 > 65 73 O 0.38097983069377 0.44630061213926 0.25675053189919 15.999 > 73 74 O 0.88097983069377 0.44630061213926 0.25675053189919 15.999 > 73 75 O 0.38097983069377 0.94630061213926 0.25675053189919 15.999 > 73 76 O 0.88097983069377 0.94630061213926 0.25675053189919 15.999 > 73 77 O 0.38097983069377 0.44630061213926 0.75675053189919 15.999 > 73 78 O 0.88097983069377 0.44630061213926 0.75675053189919 15.999 > 73 79 O 0.38097983069377 0.94630061213926 0.75675053189919 15.999 > 73 80 O 0.88097983069377 0.94630061213926 0.75675053189919 15.999 > 73 81 O 0.37393021524020 0.18706202016681 0.25699159993110 15.999 > 81 82 O 0.87393021524020 0.18706202016681 0.25699159993110 15.999 > 81 83 O 0.37393021524020 0.68706202016681 0.25699159993110 15.999 > 81 84 O 0.87393021524020 0.68706202016681 0.25699159993110 15.999 > 81 85 O 0.37393021524020 0.18706202016681 0.75699159993110 15.999 > 81 86 O 0.87393021524020 0.18706202016681 0.75699159993110 15.999 > 81 87 O 0.37393021524020 0.68706202016681 0.75699159993110 15.999 > 81 88 O 0.87393021524020 0.68706202016681 0.75699159993110 15.999 > 81 89 O 0.38097983069377 0.05369938786074 0.00675053189919 15.999 > 89 90 O 0.88097983069377 0.05369938786074 0.00675053189919 15.999 > 89 91 O 0.38097983069377 0.55369938786074 0.00675053189919 15.999 > 89 92 O 0.88097983069377 0.55369938786074 0.00675053189919 15.999 > 89 93 O 0.38097983069377 0.05369938786074 0.50675053189919 15.999 > 89 94 O 0.88097983069377 0.05369938786074 0.50675053189919 15.999 > 89 95 O 0.38097983069377 0.55369938786074 0.50675053189919 15.999 > 89 96 O 0.88097983069377 0.55369938786074 0.50675053189919 15.999 > 89 97 O 0.12606978475980 0.31293797983319 0.24300840006890 15.999 > 97 98 O 0.62606978475980 0.31293797983319 0.24300840006890 15.999 > 97 99 O 0.12606978475980 0.81293797983319 0.24300840006890 15.999 > 97 100 O 0.62606978475980 0.81293797983319 0.24300840006890 15.999 > 97 101 O 0.12606978475980 0.31293797983319 0.74300840006890 15.999 > 97 102 O 0.62606978475980 0.31293797983319 0.74300840006890 15.999 > 97 103 O 0.12606978475980 0.81293797983319 0.74300840006890 15.999 > 97 104 O 0.62606978475980 0.81293797983319 0.74300840006890 15.999 > 97 105 O 0.11902016930623 0.05369938786074 0.24324946810081 15.999 > 105 106 O 0.61902016930623 0.05369938786074 0.24324946810081 15.999 > 105 107 O 0.11902016930623 0.55369938786074 0.24324946810081 15.999 > 105 108 O 0.61902016930623 0.55369938786074 0.24324946810081 15.999 > 105 109 O 0.11902016930623 0.05369938786074 0.74324946810081 15.999 > 105 110 O 0.61902016930623 0.05369938786074 0.74324946810081 15.999 > 105 111 O 0.11902016930623 0.55369938786074 0.74324946810081 15.999 > 105 112 O 0.61902016930623 0.55369938786074 0.74324946810081 15.999 > 105 113 O 0.12606978475980 0.18706202016681 0.49300840006890 15.999 > 113 114 O 0.62606978475980 0.18706202016681 0.49300840006890 15.999 > 113 115 O 0.12606978475980 0.68706202016681 0.49300840006890 15.999 > 113 116 O 0.62606978475980 0.68706202016681 0.49300840006890 15.999 > 113 117 O 0.12606978475980 0.18706202016681 0.99300840006890 15.999 > 113 118 O 0.62606978475980 0.18706202016681 0.99300840006890 15.999 > 113 119 O 0.12606978475980 0.68706202016681 0.99300840006890 15.999 > 113 120 O 0.62606978475980 0.68706202016681 0.99300840006890 15.999 > 113 121 O 0.11902016930623 0.44630061213926 0.49324946810081 15.999 > 121 122 O 0.61902016930623 0.44630061213926 0.49324946810081 15.999 > 121 123 O 0.11902016930623 0.94630061213926 0.49324946810081 15.999 > 121 124 O 0.61902016930623 0.94630061213926 0.49324946810081 15.999 > 121 125 O 0.11902016930623 0.44630061213926 0.99324946810081 15.999 > 121 126 O 0.61902016930623 0.44630061213926 0.99324946810081 15.999 > 121 127 O 0.11902016930623 0.94630061213926 0.99324946810081 15.999 > 121 128 O 0.61902016930623 0.94630061213926 0.99324946810081 15.999 > 121 ---------------------------------------------------------------------------- NAC parameters were read from "phono3py.yaml". --------------------------- Dielectric constant ---------------------------- 4.2215548 0.0000000 -0.0361731 0.0000000 4.7069027 0.0000000 -0.0361728 0.0000000 4.7950241 -------------------------- Born effective charges -------------------------- 1 Li 0.7415392 -0.0000000 -0.1505251 -0.0000000 1.3242102 0.0000000 -0.2365923 0.0000000 1.0204411 2 Li 0.7415392 -0.0000000 -0.1505251 -0.0000000 1.3242102 0.0000000 -0.2365923 0.0000000 1.0204411 3 Li 1.5100392 -0.0000000 0.0236876 -0.0000000 0.7738909 0.0000000 -0.0086559 0.0000000 1.1844805 4 Li 1.3312634 -0.0000000 0.2057294 -0.0000000 1.4353411 0.0000000 0.3262932 0.0000000 1.1862139 5 Li 1.3312634 -0.0000000 0.2057294 -0.0000000 1.4353411 0.0000000 0.3262932 0.0000000 1.1862139 6 Li 1.5100392 -0.0000000 0.0236876 -0.0000000 0.7738909 0.0000000 -0.0086559 0.0000000 1.1844805 7 Bi 3.2265806 -0.0000000 -0.4046259 -0.0000000 4.2220931 0.0000000 -0.5090930 0.0000000 5.0549750 8 Bi 3.2265806 -0.0000000 -0.4046259 -0.0000000 4.2220931 0.0000000 -0.5090930 0.0000000 5.0549750 9 O -1.6866535 -0.3170963 -0.2740280 -0.2572670 -2.1326851 -0.3051454 -0.1476581 -0.1939499 -1.8832800 10 O -1.7180577 0.0813261 0.4368950 0.0904180 -1.7450825 -0.4236079 0.3616821 -0.5126576 -2.3397752 11 O -1.6866535 0.3170963 -0.2740280 0.2572670 -2.1326851 0.3051454 -0.1476581 0.1939499 -1.8832800 12 O -1.7180577 -0.0813261 0.4368950 -0.0904180 -1.7450825 0.4236079 0.3616821 0.5126576 -2.3397752 13 O -1.6866535 0.3170963 -0.2740280 0.2572670 -2.1326851 0.3051454 -0.1476581 0.1939499 -1.8832800 14 O -1.7180577 0.0813261 0.4368950 0.0904180 -1.7450825 -0.4236079 0.3616821 -0.5126576 -2.3397752 15 O -1.6866535 -0.3170963 -0.2740280 -0.2572670 -2.1326851 -0.3051454 -0.1476581 -0.1939499 -1.8832800 16 O -1.7180577 -0.0813261 0.4368950 -0.0904180 -1.7450825 0.4236079 0.3616821 0.5126576 -2.3397752 ---------------------------------------------------------------------------- fc3 was read from "fc3.hdf5". fc2 was read from "fc2.hdf5". ----------------------------- Force constants ------------------------------ Max drift of fc3: 0.00000013 (yyy) 0.00000013 (yyy) 0.00000013 (yyy) Max drift of fc2: -0.00000000 (yy) -0.00000000 (yy) --------------------------- Calculation settings --------------------------- Non-analytical term correction (NAC): True NAC unit conversion factor: 14.39965 BZ integration: Tetrahedron-method Temperature: 0.0 10.0 20.0 30.0 40.0 ... 1000.0 Cutoff frequency: 0.01 Frequency conversion factor to THz: 15.63330 Length for sampling mesh generation: 50.00 Generating grid system ... [ 10 8 10 ] fc3-r2q-transformation over three atoms: True --------------------------- Phonon calculations ---------------------------- Use NAC by Gonze et al. (no real space sum in current implementation) PRB 50, 13035(R) (1994), PRB 55, 10355 (1997) G-cutoff distance: 0.76, Number of G-points: 297, Lambda: 0.17 Running harmonic phonon calculations... -------------------- Lattice thermal conductivity (RTA) -------------------- ======================= Grid point 0 (1/260) ======================= q-point: ( 0.00 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 260 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| -0.000 ( 0.000 0.000 0.000) 0.000 0.000 ( 0.000 0.000 0.000) 0.000 0.000 ( 0.000 0.000 0.000) 0.000 2.804 ( 0.000 0.000 0.000) 0.000 3.969 ( 0.000 0.000 0.000) 0.000 4.258 ( 0.000 0.000 0.000) 0.000 4.362 ( 0.000 0.000 0.000) 0.000 4.988 ( 0.000 0.000 0.000) 0.000 5.621 ( 0.000 0.000 0.000) 0.000 5.959 ( 0.000 0.000 0.000) 0.000 5.989 ( 0.000 0.000 0.000) 0.000 5.991 ( 0.000 0.000 0.000) 0.000 6.272 ( 0.000 0.000 0.000) 0.000 7.019 ( 0.000 0.000 0.000) 0.000 7.223 ( 0.000 0.000 0.000) 0.000 7.520 ( 0.000 0.000 0.000) 0.000 7.525 ( 0.000 0.000 0.000) 0.000 7.731 ( 0.000 0.000 0.000) 0.000 7.906 ( 0.000 0.000 0.000) 0.000 8.164 ( 0.000 0.000 0.000) 0.000 8.243 ( 0.000 0.000 0.000) 0.000 8.327 ( 0.000 0.000 0.000) 0.000 8.920 ( 0.000 0.000 0.000) 0.000 9.118 ( 0.000 0.000 0.000) 0.000 9.810 ( 0.000 0.000 0.000) 0.000 10.150 ( 0.000 0.000 0.000) 0.000 10.326 ( 0.000 0.000 0.000) 0.000 10.529 ( 0.000 0.000 0.000) 0.000 10.930 ( 0.000 0.000 0.000) 0.000 11.139 ( 0.000 0.000 0.000) 0.000 11.310 ( 0.000 0.000 0.000) 0.000 11.879 ( 0.000 0.000 0.000) 0.000 11.908 ( 0.000 0.000 0.000) 0.000 12.274 ( 0.000 0.000 0.000) 0.000 12.290 ( 0.000 0.000 0.000) 0.000 12.660 ( 0.000 0.000 0.000) 0.000 12.719 ( 0.000 0.000 0.000) 0.000 13.518 ( 0.000 0.000 0.000) 0.000 13.583 ( 0.000 0.000 0.000) 0.000 14.974 ( 0.000 0.000 0.000) 0.000 15.085 ( 0.000 0.000 0.000) 0.000 15.467 ( 0.000 0.000 0.000) 0.000 15.605 ( 0.000 0.000 0.000) 0.000 16.141 ( 0.000 0.000 0.000) 0.000 16.930 ( 0.000 0.000 0.000) 0.000 17.328 ( 0.000 0.000 0.000) 0.000 18.183 ( 0.000 0.000 0.000) 0.000 18.825 ( 0.000 0.000 0.000) 0.000 ======================= Grid point 1 (2/260) ======================= q-point: ( 0.10 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 250 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.503 ( 28.462 0.000 -8.285) 29.643 0.526 ( 22.971 0.000 10.597) 25.297 0.996 ( 43.959 0.000 17.518) 47.321 2.830 ( 1.577 0.000 2.895) 3.297 4.206 ( -4.206 0.000 -0.800) 4.281 4.359 ( -1.255 0.000 2.596) 2.884 4.526 ( -3.728 0.000 36.508) 36.697 5.029 ( 3.645 0.000 1.370) 3.894 5.576 ( -7.372 0.000 3.160) 8.020 5.955 ( 0.622 0.000 -1.501) 1.625 6.032 ( 3.359 0.000 1.757) 3.791 6.046 ( 4.656 0.000 -4.831) 6.709 6.311 ( 5.273 0.000 -5.182) 7.393 7.000 ( -1.540 0.000 -1.132) 1.911 7.194 ( -2.350 0.000 -1.911) 3.029 7.407 ( -8.314 0.000 -2.734) 8.752 7.844 ( 7.678 0.000 3.001) 8.244 7.861 ( -5.195 0.000 3.477) 6.251 8.132 ( -7.125 0.000 25.582) 26.556 8.226 ( 0.260 0.000 -3.371) 3.381 8.386 ( 4.134 0.000 6.025) 7.307 8.954 ( 1.867 0.000 4.059) 4.467 9.078 ( 3.807 0.000 -10.686) 11.344 9.254 ( -9.604 0.000 13.533) 16.595 9.840 ( 2.409 0.000 -0.221) 2.420 10.051 ( -8.096 0.000 0.925) 8.149 10.334 ( -0.568 0.000 -1.463) 1.569 10.545 ( 2.735 0.000 -3.918) 4.779 10.837 ( -7.556 0.000 -2.129) 7.850 11.067 ( -6.647 0.000 -0.922) 6.711 11.329 ( 0.592 0.000 -4.084) 4.127 11.814 ( -6.071 0.000 -2.836) 6.701 11.848 ( -4.422 0.000 5.570) 7.112 12.270 ( 0.472 0.000 -2.934) 2.972 12.625 ( 4.263 0.000 14.552) 15.163 12.830 ( 10.419 0.000 0.307) 10.423 13.516 ( -5.380 0.000 -4.111) 6.771 13.520 ( 0.760 0.000 -1.706) 1.868 14.698 ( 22.230 0.000 -65.802) 69.456 15.090 ( 0.771 0.000 -3.162) 3.254 15.243 ( -0.369 0.000 -32.910) 32.912 15.479 ( 0.758 0.000 3.306) 3.391 15.794 ( 8.391 0.000 9.073) 12.358 16.157 ( 2.506 0.000 -2.881) 3.818 17.315 ( -3.007 0.000 5.325) 6.115 18.177 ( -0.203 0.000 -1.262) 1.278 18.814 ( -1.547 0.000 2.029) 2.551 19.186 ( -13.589 0.000 50.034) 51.846 ======================= Grid point 2 (3/260) ======================= q-point: ( 0.20 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 260 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.985 ( 25.842 0.000 -6.068) 26.545 0.999 ( 19.682 0.000 8.132) 21.296 1.870 ( 35.362 0.000 14.726) 38.306 2.883 ( 1.048 0.000 4.413) 4.536 4.104 ( -4.984 0.000 -2.926) 5.779 4.343 ( -2.534 0.000 3.910) 4.659 4.725 ( 4.546 0.000 23.915) 24.343 5.140 ( 6.576 0.000 2.054) 6.889 5.437 ( -9.314 0.000 6.496) 11.356 5.963 ( 0.771 0.000 -0.829) 1.132 6.136 ( 5.302 0.000 2.951) 6.068 6.138 ( 6.574 0.000 1.659) 6.780 6.391 ( 6.721 0.000 -7.490) 10.063 6.945 ( -3.472 0.000 -1.500) 3.782 7.113 ( -4.468 0.000 -2.417) 5.080 7.217 ( -9.074 0.000 -2.607) 9.441 7.769 ( -5.912 0.000 2.141) 6.288 8.017 ( 8.274 0.000 2.168) 8.553 8.124 ( -4.194 0.000 7.410) 8.514 8.233 ( 0.392 0.000 3.704) 3.725 8.550 ( 6.873 0.000 10.919) 12.902 9.015 ( 0.302 0.000 6.054) 6.062 9.085 ( 1.587 0.000 -4.475) 4.748 9.135 ( -8.335 0.000 5.878) 10.199 9.869 ( 0.446 0.000 -0.890) 0.996 9.915 ( -6.082 0.000 2.798) 6.694 10.274 ( -2.986 0.000 -5.129) 5.935 10.565 ( 1.619 0.000 -5.020) 5.274 10.676 ( -7.431 0.000 -0.906) 7.487 10.906 ( -8.144 0.000 -1.200) 8.232 11.206 ( -7.783 0.000 -12.169) 14.445 11.725 ( -2.349 0.000 0.504) 2.402 11.795 ( -5.563 0.000 8.438) 10.107 12.252 ( 0.381 0.000 -5.942) 5.955 12.810 ( 6.145 0.000 10.217) 11.923 13.083 ( 13.674 0.000 3.295) 14.065 13.345 ( -7.733 0.000 -7.174) 10.549 13.521 ( 0.519 0.000 -2.751) 2.800 14.684 ( 0.615 0.000 -11.446) 11.462 15.036 ( -3.839 0.000 -6.493) 7.543 15.128 ( 11.662 0.000 -35.715) 37.570 15.562 ( 4.816 0.000 6.385) 7.998 15.968 ( 3.513 0.000 8.514) 9.210 16.199 ( 4.480 0.000 -5.678) 7.233 17.280 ( -5.273 0.000 9.139) 10.552 18.159 ( -0.477 0.000 -2.199) 2.250 18.800 ( -1.112 0.000 2.459) 2.699 19.245 ( -4.020 0.000 22.579) 22.934 ======================= Grid point 3 (4/260) ======================= q-point: ( 0.30 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 250 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.368 ( 14.204 0.000 4.796) 14.992 1.409 ( 20.875 0.000 -3.510) 21.168 2.510 ( 22.568 0.000 10.745) 24.996 2.908 ( -1.426 0.000 3.992) 4.239 3.988 ( -4.819 0.000 -3.123) 5.742 4.311 ( -3.034 0.000 3.599) 4.708 4.973 ( 6.659 0.000 18.580) 19.737 5.297 ( 8.204 0.000 1.556) 8.350 5.323 ( -6.206 0.000 5.919) 8.577 5.977 ( 0.898 0.000 0.981) 1.330 6.282 ( 6.824 0.000 5.334) 8.661 6.294 ( 8.123 0.000 1.049) 8.190 6.472 ( 6.615 0.000 -7.956) 10.347 6.832 ( -7.584 0.000 -1.748) 7.782 7.006 ( -4.953 0.000 -1.287) 5.118 7.052 ( -5.981 0.000 -1.936) 6.286 7.661 ( -5.861 0.000 -0.162) 5.863 8.093 ( -1.972 0.000 3.491) 4.010 8.186 ( 8.291 0.000 0.845) 8.333 8.269 ( 0.122 0.000 5.417) 5.419 8.740 ( 3.241 0.000 11.116) 11.579 9.007 ( -6.575 0.000 2.044) 6.886 9.031 ( -1.138 0.000 6.636) 6.733 9.094 ( 0.393 0.000 -1.017) 1.090 9.842 ( -2.654 0.000 -0.143) 2.658 9.871 ( -1.497 0.000 4.587) 4.825 10.180 ( -2.251 0.000 -6.752) 7.117 10.532 ( -1.270 0.000 -6.255) 6.383 10.551 ( -5.207 0.000 -0.219) 5.212 10.787 ( -3.121 0.000 0.487) 3.159 10.939 ( -9.630 0.000 -15.112) 17.920 11.695 ( -1.849 0.000 1.091) 2.147 11.734 ( -6.154 0.000 8.153) 10.215 12.198 ( -1.878 0.000 -8.063) 8.279 12.973 ( 5.122 0.000 6.900) 8.593 13.129 ( -7.373 0.000 -4.314) 8.542 13.415 ( 15.445 0.000 3.791) 15.903 13.502 ( -0.671 0.000 -2.673) 2.756 14.609 ( -3.093 0.000 -1.273) 3.344 14.867 ( -8.667 0.000 -7.847) 11.692 15.223 ( 16.206 0.000 -25.051) 29.836 15.720 ( 6.370 0.000 6.852) 9.356 16.029 ( -2.073 0.000 7.243) 7.534 16.254 ( 5.388 0.000 -7.556) 9.280 17.229 ( -6.106 0.000 10.042) 11.752 18.133 ( -0.636 0.000 -2.396) 2.479 18.804 ( -0.060 0.000 2.005) 2.006 19.303 ( -1.330 0.000 12.416) 12.487 ======================= Grid point 4 (5/260) ======================= q-point: ( 0.40 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 260 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.597 ( 7.265 0.000 1.872) 7.502 1.723 ( 12.544 0.000 -1.435) 12.625 2.873 ( 10.084 0.000 5.927) 11.696 2.883 ( -2.680 0.000 2.211) 3.475 3.892 ( -3.114 0.000 -1.947) 3.672 4.277 ( -2.169 0.000 2.090) 3.012 5.169 ( 3.137 0.000 9.324) 9.837 5.282 ( -1.104 0.000 4.908) 5.031 5.449 ( 6.157 0.000 0.196) 6.160 6.022 ( 2.636 0.000 2.694) 3.769 6.436 ( 5.733 0.000 2.758) 6.362 6.437 ( 5.581 0.000 0.351) 5.592 6.538 ( 3.747 0.000 -4.777) 6.071 6.653 ( -8.576 0.000 -1.985) 8.803 6.930 ( -2.029 0.000 0.289) 2.049 6.963 ( -2.687 0.000 -0.946) 2.849 7.555 ( -4.280 0.000 -0.954) 4.385 8.093 ( -0.197 0.000 2.320) 2.329 8.299 ( -0.080 0.000 3.654) 3.655 8.346 ( 8.033 0.000 -0.388) 8.042 8.732 ( -7.289 0.000 4.554) 8.595 8.912 ( -3.967 0.000 0.937) 4.076 9.094 ( 0.068 0.000 -0.523) 0.527 9.129 ( 4.661 0.000 8.391) 9.599 9.782 ( -3.290 0.000 0.962) 3.428 9.868 ( -1.544 0.000 1.856) 2.414 10.117 ( -0.788 0.000 -4.692) 4.758 10.472 ( -2.822 0.000 -0.010) 2.822 10.476 ( -0.413 0.000 -3.638) 3.662 10.695 ( -6.162 0.000 -11.262) 12.838 10.784 ( 1.239 0.000 1.126) 1.674 11.666 ( -1.507 0.000 0.572) 1.611 11.669 ( -4.541 0.000 5.608) 7.216 12.083 ( -4.179 0.000 -7.285) 8.399 13.002 ( -3.130 0.000 -2.782) 4.188 13.086 ( 3.115 0.000 3.392) 4.605 13.469 ( -1.160 0.000 -1.538) 1.927 13.738 ( 13.689 0.000 6.223) 15.037 14.566 ( -1.104 0.000 -0.179) 1.119 14.627 ( -10.323 0.000 -7.473) 12.744 15.392 ( 12.579 0.000 -13.273) 18.287 15.862 ( 3.993 0.000 4.824) 6.263 15.992 ( -5.170 0.000 5.501) 7.549 16.306 ( 4.251 0.000 -6.205) 7.521 17.177 ( -4.508 0.000 6.915) 8.255 18.109 ( -0.459 0.000 -1.580) 1.645 18.818 ( 0.339 0.000 1.112) 1.162 19.344 ( -0.408 0.000 5.788) 5.802 ======================= Grid point 5 (6/260) ======================= q-point: (-0.50 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 130 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.672 ( 0.000 0.000 -0.000) 0.000 1.845 ( 0.000 0.000 0.000) 0.000 2.858 ( 0.000 0.000 0.000) 0.000 2.986 ( 0.000 0.000 0.000) 0.000 3.855 ( 0.000 0.000 0.000) 0.000 4.261 ( 0.000 0.000 0.000) 0.000 5.209 ( 0.000 0.000 0.000) 0.000 5.310 ( 0.000 0.000 -0.000) 0.000 5.511 ( 0.000 0.000 0.000) 0.000 6.073 ( 0.000 0.000 0.000) 0.000 6.494 ( 0.000 0.000 0.000) 0.000 6.518 ( -0.000 0.000 -0.000) 0.000 6.541 ( 0.000 0.000 0.000) 0.000 6.544 ( 0.000 0.000 -0.000) 0.000 6.921 ( 0.000 0.000 0.000) 0.000 6.934 ( 0.000 0.000 0.000) 0.000 7.507 ( 0.000 0.000 -0.000) 0.000 8.101 ( 0.000 0.000 0.000) 0.000 8.309 ( 0.000 0.000 -0.000) 0.000 8.451 ( 0.000 0.000 -0.000) 0.000 8.638 ( 0.000 0.000 0.000) 0.000 8.875 ( 0.000 0.000 0.000) 0.000 9.092 ( 0.000 0.000 0.000) 0.000 9.214 ( 0.000 0.000 0.000) 0.000 9.749 ( 0.000 0.000 0.000) 0.000 9.852 ( 0.000 0.000 0.000) 0.000 10.091 ( 0.000 0.000 0.000) 0.000 10.445 ( 0.000 0.000 0.000) 0.000 10.467 ( 0.000 0.000 -0.000) 0.000 10.595 ( 0.000 0.000 0.000) 0.000 10.807 ( 0.000 0.000 0.000) 0.000 11.642 ( 0.000 0.000 -0.000) 0.000 11.652 ( 0.000 0.000 -0.000) 0.000 12.006 ( 0.000 0.000 -0.000) 0.000 12.966 ( 0.000 0.000 -0.000) 0.000 13.128 ( 0.000 0.000 0.000) 0.000 13.450 ( 0.000 0.000 0.000) 0.000 13.928 ( 0.000 0.000 0.000) 0.000 14.465 ( 0.000 0.000 0.000) 0.000 14.556 ( 0.000 0.000 0.000) 0.000 15.487 ( 0.000 0.000 0.000) 0.000 15.917 ( 0.000 0.000 -0.000) 0.000 15.946 ( 0.000 0.000 0.000) 0.000 16.330 ( 0.000 0.000 0.000) 0.000 17.152 ( 0.000 0.000 0.000) 0.000 18.100 ( 0.000 0.000 -0.000) 0.000 18.825 ( 0.000 0.000 0.000) 0.000 19.358 ( 0.000 0.000 0.000) 0.000 ======================= Grid point 11 (7/260) ======================= q-point: ( 0.00 0.12 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 208 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.377 ( 0.000 20.220 0.000) 20.220 0.671 ( 0.000 32.851 0.000) 32.851 0.942 ( 0.000 45.725 0.000) 45.725 2.728 ( 0.000 -7.410 0.000) 7.410 4.016 ( 0.000 4.558 0.000) 4.558 4.274 ( 0.000 1.360 0.000) 1.360 4.388 ( 0.000 2.021 0.000) 2.021 4.909 ( 0.000 -7.095 0.000) 7.095 5.620 ( 0.000 -1.052 0.000) 1.052 5.936 ( 0.000 -1.413 0.000) 1.413 6.047 ( 0.000 2.107 0.000) 2.107 6.266 ( 0.000 -0.052 0.000) 0.052 6.341 ( 0.000 2.570 0.000) 2.570 7.157 ( 0.000 -5.236 0.000) 5.236 7.304 ( 0.000 -3.052 0.000) 3.052 7.438 ( 0.000 -8.183 0.000) 8.183 7.721 ( 0.000 0.325 0.000) 0.325 8.072 ( 0.000 15.352 0.000) 15.352 8.096 ( 0.000 -6.692 0.000) 6.692 8.199 ( 0.000 2.919 0.000) 2.919 8.550 ( 0.000 13.167 0.000) 13.167 8.923 ( 0.000 0.844 0.000) 0.844 9.113 ( 0.000 -0.441 0.000) 0.441 9.761 ( 0.000 -0.838 0.000) 0.838 9.855 ( 0.000 3.480 0.000) 3.480 10.137 ( 0.000 -1.403 0.000) 1.403 10.377 ( 0.000 -1.183 0.000) 1.183 10.891 ( 0.000 -6.487 0.000) 6.487 10.901 ( 0.000 -2.582 0.000) 2.582 11.129 ( 0.000 -1.025 0.000) 1.025 11.311 ( 0.000 -0.289 0.000) 0.289 11.908 ( 0.000 0.097 0.000) 0.097 12.166 ( 0.000 -8.291 0.000) 8.291 12.323 ( 0.000 -0.782 0.000) 0.782 12.430 ( 0.000 -8.499 0.000) 8.499 13.033 ( 0.000 18.223 0.000) 18.223 13.142 ( 0.000 -2.162 0.000) 2.162 13.596 ( 0.000 6.679 0.000) 6.679 13.621 ( 0.000 3.791 0.000) 3.791 14.913 ( 0.000 -5.998 0.000) 5.998 14.991 ( 0.000 -8.828 0.000) 8.828 15.618 ( 0.000 1.038 0.000) 1.038 16.139 ( 0.000 -0.201 0.000) 0.201 16.854 ( 0.000 0.701 0.000) 0.701 16.937 ( 0.000 0.703 0.000) 0.703 17.337 ( 0.000 0.858 0.000) 0.858 18.845 ( 0.000 1.923 0.000) 1.923 19.797 ( 0.000 1.221 0.000) 1.221 ======================= Grid point 12 (8/260) ======================= q-point: ( 0.10 0.12 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 400 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.755 ( 6.745 25.433 14.177) 29.888 0.792 ( 22.995 13.177 11.368) 28.838 1.308 ( 31.948 29.463 0.055) 43.460 2.765 ( 1.878 -6.923 3.473) 7.970 4.221 ( -1.608 1.453 2.987) 3.690 4.275 ( 9.488 -6.646 14.629) 18.660 4.387 ( -0.763 1.643 3.332) 3.792 4.949 ( 3.174 -7.090 2.177) 8.067 5.564 ( -6.336 0.561 3.816) 7.418 5.970 ( 3.238 -3.107 0.771) 4.553 6.065 ( 2.290 0.254 -0.857) 2.458 6.252 ( -5.453 10.855 -0.738) 12.170 6.309 ( 4.266 -0.104 -3.105) 5.278 7.081 ( -3.706 -1.045 -5.215) 6.482 7.205 ( -4.124 -1.222 -2.602) 5.027 7.533 ( -3.287 4.841 1.990) 6.181 7.660 ( 2.659 -7.889 -5.731) 10.107 7.997 ( -6.300 6.711 8.608) 12.603 8.163 ( -1.427 2.933 8.852) 9.434 8.214 ( 3.130 4.813 2.373) 6.212 8.537 ( -0.284 11.271 1.379) 11.358 8.933 ( 0.396 -0.351 4.340) 4.372 9.108 ( -0.386 -0.258 0.077) 0.471 9.507 ( -17.534 14.361 -0.969) 22.685 9.831 ( 1.222 -0.842 0.031) 1.484 10.122 ( -5.757 2.582 0.956) 6.382 10.327 ( -2.458 -0.972 -2.873) 3.903 10.659 ( -6.969 5.032 -3.341) 9.222 10.817 ( -6.857 -0.999 -0.418) 6.942 11.061 ( -6.470 -0.713 -0.830) 6.562 11.331 ( 0.244 0.094 -1.961) 1.979 11.767 ( -9.569 -2.606 1.043) 9.972 11.956 ( -9.744 7.033 2.475) 12.269 12.243 ( -0.068 -2.363 -2.274) 3.280 12.499 ( 8.008 -9.053 6.707) 13.822 12.949 ( 3.796 7.897 2.072) 9.004 13.514 ( 0.123 0.311 0.858) 0.921 13.570 ( -1.637 4.088 -5.577) 7.106 14.253 ( 51.291 -25.478 -35.614) 67.441 14.825 ( -8.105 -7.406 1.465) 11.076 15.008 ( 2.365 -8.457 -2.728) 9.195 15.695 ( 4.574 1.619 1.663) 5.129 16.080 ( -8.943 5.232 1.351) 10.448 16.276 ( -4.262 15.256 -21.168) 26.438 17.322 ( -3.205 0.607 5.618) 6.496 17.645 ( 17.573 -22.821 23.017) 36.870 18.893 ( 3.427 2.873 1.112) 4.608 19.515 ( -20.411 13.579 8.809) 26.050 ======================= Grid point 13 (9/260) ======================= q-point: ( 0.20 0.12 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 400 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.059 ( 14.603 12.943 11.032) 22.416 1.252 ( 21.397 15.362 -0.353) 26.343 1.977 ( 30.595 11.492 10.308) 34.269 2.824 ( 1.100 -6.042 4.902) 7.858 4.134 ( -4.455 2.670 -3.276) 6.140 4.359 ( -2.577 1.297 4.038) 4.963 4.610 ( 9.553 -7.968 19.945) 23.507 5.043 ( 4.166 -6.699 4.258) 8.965 5.462 ( -5.603 2.352 3.528) 7.027 6.065 ( 5.521 -4.290 1.441) 7.139 6.107 ( 1.130 1.105 -0.401) 1.631 6.196 ( 1.111 9.909 1.323) 10.059 6.376 ( 4.085 -1.102 -3.502) 5.492 6.995 ( -2.294 1.799 -4.906) 5.707 7.108 ( -4.006 -0.693 -3.256) 5.208 7.377 ( -8.728 14.472 -0.967) 16.928 7.704 ( 0.063 -9.215 -1.907) 9.411 7.980 ( 0.088 1.922 6.683) 6.954 8.178 ( -3.178 4.202 12.309) 13.389 8.294 ( 3.897 6.100 -2.574) 7.683 8.602 ( 4.091 4.777 8.444) 10.529 8.983 ( 0.597 -1.666 5.721) 5.988 9.095 ( -2.265 -1.140 2.562) 3.605 9.255 ( -8.330 11.809 -1.674) 14.548 9.844 ( -0.240 -2.367 -0.670) 2.472 9.987 ( -7.342 4.829 2.843) 9.236 10.253 ( -2.891 -2.123 -5.353) 6.444 10.569 ( -2.039 -1.306 -7.356) 7.745 10.687 ( -6.425 1.832 1.103) 6.771 10.908 ( -7.508 0.068 -0.636) 7.535 11.224 ( -6.984 1.915 -9.022) 11.569 11.686 ( -1.959 -3.324 4.935) 6.264 11.824 ( -7.249 2.617 4.489) 8.919 12.226 ( 0.232 -2.675 -5.327) 5.965 12.697 ( 7.347 -9.665 5.870) 13.485 13.076 ( 7.742 -0.979 0.815) 7.847 13.409 ( -6.405 5.528 -4.755) 9.705 13.572 ( 2.325 4.647 -2.221) 5.651 14.668 ( -5.787 -4.329 -2.803) 7.751 14.762 ( 22.190 -15.519 -22.727) 35.352 15.037 ( 5.101 -7.202 -9.525) 12.985 15.732 ( 0.337 8.491 -0.152) 8.499 15.996 ( -1.108 2.203 6.894) 7.322 16.235 ( 3.899 3.990 -8.448) 10.124 17.283 ( -5.438 0.305 8.927) 10.457 17.933 ( 5.377 -15.469 8.070) 18.257 18.930 ( 0.089 7.887 -3.055) 8.459 19.312 ( -8.161 5.551 14.622) 17.641 ======================= Grid point 14 (10/260) ======================= q-point: ( 0.30 0.12 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 400 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.396 ( 12.730 6.509 9.203) 17.003 1.614 ( 17.868 14.590 -4.999) 23.604 2.534 ( 19.485 2.678 10.321) 22.212 2.859 ( -0.496 -4.622 4.830) 6.704 4.026 ( -4.363 3.457 -3.411) 6.528 4.326 ( -3.119 1.292 3.542) 4.894 4.901 ( 8.784 -8.465 16.355) 20.404 5.143 ( 2.154 -4.000 6.437) 7.879 5.417 ( -0.162 1.452 0.132) 1.467 6.097 ( -0.435 8.766 0.812) 8.814 6.201 ( 6.196 -5.930 1.563) 8.718 6.294 ( 7.250 -1.527 -0.107) 7.410 6.407 ( 0.324 -3.504 -0.709) 3.590 6.925 ( -1.505 6.380 -5.185) 8.358 7.025 ( -2.523 2.413 -2.063) 4.055 7.226 ( -6.659 15.121 0.674) 16.536 7.644 ( -3.988 -2.978 -1.686) 5.255 8.047 ( 2.243 -1.711 3.548) 4.533 8.210 ( 0.166 2.573 8.847) 9.215 8.334 ( 2.106 5.371 -1.941) 6.087 8.747 ( 1.970 0.819 10.000) 10.225 9.000 ( -1.106 -2.278 4.527) 5.187 9.043 ( -4.417 2.266 4.279) 6.554 9.157 ( -1.867 6.565 -0.959) 6.892 9.802 ( -3.915 -3.428 0.583) 5.237 9.913 ( -2.469 2.861 2.831) 4.721 10.162 ( -2.179 -2.042 -6.527) 7.177 10.456 ( -4.262 -5.170 -8.686) 10.970 10.566 ( -6.673 0.085 0.622) 6.702 10.812 ( -2.410 2.282 0.904) 3.440 11.027 ( -5.512 7.466 -10.508) 14.019 11.672 ( -3.240 -1.966 1.391) 4.037 11.740 ( -4.673 0.199 8.722) 9.897 12.167 ( -2.254 -2.705 -8.777) 9.457 12.835 ( 3.986 -9.972 3.211) 11.209 13.202 ( 1.804 -2.235 -1.277) 3.143 13.300 ( 0.324 0.020 -0.784) 0.848 13.618 ( 4.082 5.970 -0.506) 7.250 14.557 ( -4.152 -6.011 -0.908) 7.361 14.844 ( -1.905 -0.290 -7.797) 8.032 15.176 ( 17.904 -4.367 -19.990) 27.189 15.780 ( 2.697 5.009 5.129) 7.660 16.023 ( -1.626 -0.692 6.669) 6.900 16.268 ( 4.329 1.443 -7.609) 8.872 17.227 ( -6.223 -0.110 9.720) 11.542 18.024 ( 1.623 -8.983 2.443) 9.449 18.886 ( -1.795 6.772 -2.173) 7.335 19.319 ( -1.308 1.301 10.980) 11.134 ======================= Grid point 15 (11/260) ======================= q-point: ( 0.40 0.12 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 400 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.632 ( 6.594 4.158 5.433) 9.502 1.870 ( 11.228 12.696 -4.211) 17.464 2.788 ( 1.098 -5.235 4.001) 6.679 2.926 ( 5.863 1.329 5.332) 8.035 3.935 ( -2.908 3.983 -2.230) 5.412 4.290 ( -2.206 1.189 2.026) 3.223 5.135 ( 6.474 -9.355 8.828) 14.400 5.198 ( -0.063 1.022 5.872) 5.960 5.439 ( 2.059 -3.401 -1.573) 4.276 6.114 ( 1.925 7.758 0.566) 8.013 6.272 ( -0.242 -11.251 -2.363) 11.499 6.387 ( 0.541 -5.253 1.187) 5.413 6.455 ( 6.083 -0.777 2.318) 6.556 6.881 ( -0.263 11.903 -3.732) 12.477 6.997 ( 0.480 5.422 -0.813) 5.503 7.129 ( -4.117 15.405 1.512) 16.017 7.560 ( -3.028 0.066 -1.731) 3.489 8.092 ( 0.715 -0.138 2.236) 2.352 8.287 ( 1.628 -0.081 7.018) 7.205 8.363 ( 3.158 1.910 -3.505) 5.090 8.720 ( -6.655 -0.627 3.259) 7.436 8.968 ( -3.702 4.340 1.889) 6.009 9.095 ( 3.231 -0.827 5.059) 6.060 9.140 ( 0.695 2.328 2.490) 3.479 9.725 ( -3.945 -4.500 1.045) 6.075 9.884 ( -1.939 0.735 0.025) 2.074 10.104 ( -0.522 -1.465 -3.833) 4.137 10.322 ( -3.661 -8.160 -6.735) 11.196 10.463 ( -3.904 -1.402 0.297) 4.159 10.807 ( 0.751 3.205 1.497) 3.616 10.911 ( -1.312 13.294 -6.434) 14.827 11.600 ( -3.381 -2.835 0.021) 4.412 11.738 ( -1.954 2.692 8.871) 9.474 12.034 ( -4.475 -3.778 -10.161) 11.728 12.896 ( 1.492 -7.755 0.232) 7.900 13.177 ( -0.565 5.609 -0.621) 5.671 13.346 ( 1.181 -10.553 0.525) 10.632 13.740 ( 7.003 -0.190 2.652) 7.491 14.482 ( -3.180 -5.890 -2.293) 7.075 14.728 ( -4.238 7.232 -3.959) 9.270 15.391 ( 13.827 -0.458 -12.632) 18.734 15.850 ( -0.123 -0.642 5.315) 5.355 16.018 ( -2.069 1.902 5.295) 5.994 16.302 ( 3.514 -0.212 -6.201) 7.131 17.172 ( -4.538 -0.400 6.669) 8.076 18.048 ( 0.351 -5.549 0.411) 5.576 18.852 ( -0.763 3.233 -0.640) 3.383 19.360 ( -0.073 1.486 5.399) 5.601 ======================= Grid point 16 (12/260) ======================= q-point: (-0.50 0.12 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 208 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.712 ( 0.000 3.780 -0.000) 3.780 1.970 ( 0.000 11.578 0.000) 11.578 2.791 ( 0.000 -5.097 -0.000) 5.097 3.014 ( 0.000 1.176 -0.000) 1.176 3.898 ( 0.000 4.132 0.000) 4.132 4.274 ( 0.000 1.155 0.000) 1.155 5.204 ( 0.000 -0.650 0.000) 0.650 5.243 ( 0.000 -5.561 0.000) 5.561 5.455 ( 0.000 -5.759 0.000) 5.759 6.160 ( -0.000 8.182 0.000) 8.182 6.217 ( 0.000 -14.483 -0.000) 14.483 6.408 ( 0.000 -4.999 -0.000) 4.999 6.530 ( -0.000 -0.746 -0.000) 0.746 6.866 ( 0.000 13.444 -0.000) 13.444 7.007 ( 0.000 6.595 0.000) 6.595 7.092 ( 0.000 15.584 -0.000) 15.584 7.523 ( 0.000 1.314 -0.000) 1.314 8.106 ( 0.000 0.223 0.000) 0.223 8.322 ( 0.000 1.963 0.000) 1.963 8.403 ( 0.000 -3.412 -0.000) 3.412 8.643 ( 0.000 0.222 0.000) 0.222 8.934 ( 0.000 4.695 0.000) 4.695 9.113 ( 0.000 1.929 0.000) 1.929 9.198 ( 0.000 -1.539 0.000) 1.539 9.686 ( 0.000 -5.049 0.000) 5.049 9.858 ( 0.000 -0.075 0.000) 0.075 10.087 ( 0.000 -0.805 0.000) 0.805 10.262 ( 0.000 -9.163 -0.000) 9.163 10.426 ( 0.000 -1.656 0.000) 1.656 10.836 ( 0.000 2.556 0.000) 2.556 10.873 ( 0.000 15.826 0.000) 15.826 11.565 ( 0.000 -3.123 -0.000) 3.123 11.758 ( 0.000 6.179 -0.000) 6.179 11.937 ( 0.000 -6.227 0.000) 6.227 12.909 ( 0.000 -5.702 -0.000) 5.702 13.175 ( 0.000 4.347 -0.000) 4.347 13.354 ( 0.000 -9.883 -0.000) 9.883 13.838 ( 0.000 -6.373 0.000) 6.373 14.428 ( 0.000 -3.637 -0.000) 3.637 14.674 ( 0.000 9.635 0.000) 9.635 15.500 ( 0.000 0.921 0.000) 0.921 15.848 ( 0.000 -3.444 -0.000) 3.444 16.020 ( 0.000 3.865 0.000) 3.865 16.318 ( 0.000 -0.915 0.000) 0.915 17.147 ( 0.000 -0.484 0.000) 0.484 18.052 ( 0.000 -4.500 -0.000) 4.500 18.844 ( 0.000 1.906 0.000) 1.906 19.376 ( 0.000 1.722 0.000) 1.722 ======================= Grid point 22 (13/260) ======================= q-point: ( 0.00 0.25 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 260 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.813 ( 0.000 23.341 0.000) 23.341 1.287 ( 0.000 28.364 0.000) 28.364 1.787 ( 0.000 38.191 0.000) 38.191 2.518 ( 0.000 -13.484 0.000) 13.484 4.143 ( 0.000 7.931 0.000) 7.931 4.297 ( 0.000 0.594 0.000) 0.594 4.395 ( 0.000 -2.808 0.000) 2.808 4.764 ( 0.000 -5.657 0.000) 5.657 5.550 ( 0.000 -5.767 0.000) 5.767 5.947 ( 0.000 2.094 0.000) 2.094 6.070 ( 0.000 0.310 0.000) 0.310 6.275 ( 0.000 0.859 0.000) 0.859 6.402 ( 0.000 3.358 0.000) 3.358 7.047 ( 0.000 -5.618 0.000) 5.618 7.221 ( 0.000 -4.628 0.000) 4.628 7.244 ( 0.000 -9.832 0.000) 9.832 7.735 ( 0.000 -0.080 0.000) 0.080 8.015 ( 0.000 -0.851 0.000) 0.851 8.261 ( 0.000 3.000 0.000) 3.000 8.462 ( 0.000 22.602 0.000) 22.602 8.732 ( 0.000 3.152 0.000) 3.152 9.004 ( 0.000 6.641 0.000) 6.641 9.126 ( 0.000 4.291 0.000) 4.291 9.746 ( 0.000 -0.686 0.000) 0.686 9.919 ( 0.000 1.931 0.000) 1.931 10.084 ( 0.000 -4.315 0.000) 4.315 10.346 ( 0.000 -1.520 0.000) 1.520 10.729 ( 0.000 -9.018 0.000) 9.018 10.847 ( 0.000 -2.379 0.000) 2.379 11.097 ( 0.000 -2.172 0.000) 2.172 11.282 ( 0.000 -2.835 0.000) 2.835 11.918 ( 0.000 1.003 0.000) 1.003 11.949 ( 0.000 -12.313 0.000) 12.313 12.254 ( 0.000 -3.499 0.000) 3.499 12.356 ( 0.000 -2.281 0.000) 2.281 13.124 ( 0.000 0.643 0.000) 0.643 13.404 ( 0.000 18.518 0.000) 18.518 13.727 ( 0.000 6.574 0.000) 6.574 13.743 ( 0.000 7.513 0.000) 7.513 14.743 ( 0.000 -10.793 0.000) 10.793 14.767 ( 0.000 -12.767 0.000) 12.767 15.634 ( 0.000 0.477 0.000) 0.477 16.134 ( 0.000 -0.246 0.000) 0.246 16.871 ( 0.000 0.916 0.000) 0.916 16.955 ( 0.000 1.078 0.000) 1.078 17.359 ( 0.000 1.211 0.000) 1.211 18.892 ( 0.000 2.576 0.000) 2.576 19.829 ( 0.000 1.748 0.000) 1.748 ======================= Grid point 23 (14/260) ======================= q-point: ( 0.10 0.25 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 400 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.078 ( 17.744 16.594 14.702) 28.397 1.297 ( -1.049 26.636 11.033) 28.849 1.954 ( 16.455 31.683 -3.236) 35.847 2.564 ( 2.830 -12.841 4.201) 13.804 4.237 ( 2.387 -0.052 3.225) 4.012 4.283 ( 2.299 4.598 4.525) 6.848 4.391 ( -1.347 -2.138 2.850) 3.809 4.807 ( 3.408 -5.641 3.043) 7.259 5.550 ( -1.483 -2.522 3.317) 4.423 5.940 ( -0.450 0.419 0.762) 0.979 6.050 ( 0.313 -1.440 -3.209) 3.531 6.303 ( 1.382 -0.702 -0.891) 1.788 6.411 ( 1.103 6.401 1.411) 6.647 7.020 ( -0.355 -4.205 -5.005) 6.547 7.142 ( -2.733 -3.866 -2.320) 5.272 7.366 ( 7.070 -10.888 -0.284) 12.985 7.711 ( -2.487 3.155 -0.341) 4.032 8.016 ( -1.485 -0.163 5.023) 5.240 8.267 ( -1.995 4.059 8.434) 9.570 8.481 ( 2.124 19.742 -1.052) 19.884 8.732 ( -1.152 5.749 2.368) 6.323 8.970 ( -2.160 4.673 -0.312) 5.157 9.118 ( -1.336 3.295 1.851) 4.008 9.703 ( -7.570 5.305 -0.756) 9.275 9.816 ( -4.160 -0.343 1.152) 4.330 10.107 ( -0.717 -3.892 -0.162) 3.961 10.303 ( -2.940 -0.695 -4.943) 5.793 10.624 ( -5.134 -5.873 -5.796) 9.718 10.813 ( -4.403 -0.161 2.700) 5.167 11.032 ( -6.201 -2.266 -0.415) 6.616 11.306 ( 0.283 -3.200 1.992) 3.780 11.710 ( -11.664 -3.156 3.372) 12.545 12.037 ( -1.637 -0.657 3.236) 3.685 12.203 ( -8.013 -0.490 -1.167) 8.112 12.336 ( 6.900 -6.276 0.792) 9.361 13.058 ( -0.363 2.701 -5.472) 6.114 13.558 ( 2.632 5.184 4.537) 7.375 13.689 ( -0.347 7.862 -5.450) 9.573 14.045 ( 29.848 -0.010 -10.376) 31.600 14.670 ( -3.574 -9.410 -5.952) 11.694 14.804 ( 3.870 -10.922 -2.438) 11.841 15.708 ( 5.089 0.063 3.929) 6.429 16.104 ( -4.074 -0.029 2.467) 4.763 16.517 ( -9.263 8.224 -17.508) 21.447 17.333 ( -1.198 -0.374 10.490) 10.565 17.376 ( 12.335 -6.189 13.468) 19.283 18.950 ( 4.373 2.872 3.315) 6.194 19.675 ( -12.754 4.604 -2.670) 13.820 ======================= Grid point 24 (15/260) ======================= q-point: ( 0.20 0.25 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 404 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.407 ( 4.782 19.498 12.342) 23.567 1.529 ( 19.238 12.791 8.757) 24.706 2.301 ( 17.558 18.220 3.824) 25.590 2.655 ( 3.049 -9.897 5.986) 11.961 4.184 ( -2.802 1.524 -4.100) 5.195 4.377 ( -2.168 -1.272 3.902) 4.641 4.485 ( 7.154 -2.649 13.325) 15.354 4.932 ( 6.448 -4.195 6.084) 9.807 5.518 ( -4.099 3.194 3.203) 6.105 5.977 ( 4.573 -3.966 0.292) 6.060 6.065 ( 3.108 -3.169 -2.439) 5.065 6.283 ( -1.862 -3.055 -3.108) 4.739 6.459 ( 1.391 9.513 3.547) 10.247 6.995 ( 1.790 -1.895 -6.624) 7.119 7.092 ( -0.916 -0.303 -2.145) 2.352 7.478 ( 5.289 -11.364 -3.455) 13.002 7.641 ( -4.596 10.310 1.245) 11.357 8.024 ( -1.362 1.224 6.839) 7.080 8.286 ( -2.907 5.659 11.951) 13.539 8.510 ( 1.233 14.496 -3.037) 14.862 8.722 ( -0.839 6.848 4.909) 8.467 8.957 ( -0.480 -0.582 2.686) 2.790 9.102 ( -1.714 2.931 3.175) 4.649 9.496 ( -10.694 10.215 -0.454) 14.795 9.784 ( -1.903 -3.372 0.122) 3.873 10.039 ( -5.574 -0.508 1.627) 5.829 10.195 ( -3.742 -2.908 -6.927) 8.393 10.509 ( -3.307 -3.387 -8.067) 9.353 10.721 ( -7.306 0.808 1.402) 7.483 10.904 ( -4.871 -0.461 0.344) 4.905 11.253 ( -5.066 -0.616 -2.465) 5.667 11.608 ( -3.276 -4.017 8.590) 10.033 11.904 ( -10.421 5.479 3.171) 12.193 12.144 ( 0.590 -5.538 -3.978) 6.844 12.492 ( 7.559 -9.668 1.316) 12.343 13.037 ( 1.731 -2.749 -7.152) 7.856 13.532 ( -4.213 6.134 -2.714) 7.921 13.686 ( 1.644 6.479 -1.078) 6.771 14.422 ( 3.893 -10.939 0.470) 11.621 14.687 ( 20.182 -1.060 -19.083) 27.795 14.873 ( 5.428 -8.040 -4.317) 10.618 15.827 ( 3.576 1.973 4.232) 5.882 16.023 ( -5.241 0.364 4.584) 6.972 16.346 ( -0.427 6.144 -11.033) 12.635 17.292 ( -5.738 0.631 8.365) 10.164 17.681 ( 7.912 -9.320 12.310) 17.350 19.058 ( 3.603 5.212 0.761) 6.382 19.414 ( -11.224 4.038 1.486) 12.020 ======================= Grid point 25 (16/260) ======================= q-point: ( 0.30 0.25 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 400 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.595 ( 6.362 12.098 10.624) 17.312 1.901 ( 16.346 12.922 0.036) 20.836 2.597 ( 6.788 0.525 8.480) 10.875 2.771 ( 6.355 -0.796 6.231) 8.936 4.103 ( -2.833 3.632 -4.073) 6.149 4.352 ( -2.834 0.696 3.464) 4.529 4.704 ( 8.257 -8.664 10.777) 16.105 5.104 ( 5.848 -2.149 8.006) 10.145 5.440 ( -4.512 2.342 -0.596) 5.119 6.076 ( 3.668 -5.902 -1.652) 7.142 6.172 ( 9.310 -2.231 1.353) 9.668 6.206 ( -3.226 -5.245 -3.375) 7.022 6.492 ( -0.275 10.873 3.940) 11.568 7.010 ( 3.737 0.798 -5.740) 6.895 7.078 ( -0.253 3.127 0.130) 3.140 7.510 ( 2.252 -2.146 -9.829) 10.310 7.580 ( -3.847 11.072 7.150) 13.730 8.053 ( 0.288 1.170 5.763) 5.888 8.296 ( -2.809 6.030 9.433) 11.543 8.485 ( -0.389 9.348 -4.879) 10.552 8.766 ( -1.283 0.856 7.480) 7.637 8.963 ( 0.204 -0.624 4.501) 4.549 9.091 ( -2.345 3.112 4.078) 5.641 9.317 ( -7.269 7.370 -0.770) 10.380 9.721 ( -4.519 -4.081 0.429) 6.104 9.959 ( -3.675 1.664 1.546) 4.320 10.090 ( -2.100 -5.279 -7.036) 9.043 10.374 ( -5.183 -1.547 -8.292) 9.900 10.558 ( -8.610 -0.836 0.433) 8.661 10.865 ( -0.952 2.718 1.523) 3.258 11.153 ( -2.088 2.671 -4.525) 5.655 11.609 ( -3.351 -4.456 6.830) 8.816 11.759 ( -5.983 2.928 5.327) 8.529 12.111 ( -0.895 -2.642 -7.850) 8.331 12.624 ( 5.094 -10.788 1.732) 12.055 13.035 ( 2.756 -9.481 -6.944) 12.071 13.422 ( -5.057 7.333 -1.840) 9.096 13.708 ( 1.175 3.222 -0.574) 3.477 14.395 ( -2.239 -8.820 -0.942) 9.149 14.878 ( 3.589 2.629 -5.730) 7.255 15.079 ( 21.492 -4.315 -14.478) 26.271 15.873 ( -1.608 3.520 4.615) 6.023 16.003 ( -0.257 -1.139 5.883) 5.998 16.311 ( 1.933 2.798 -7.613) 8.338 17.227 ( -6.408 0.174 8.945) 11.005 17.847 ( 3.606 -7.806 6.998) 11.087 19.029 ( -3.832 7.056 -5.555) 9.764 19.342 ( -0.635 0.766 8.153) 8.214 ======================= Grid point 26 (17/260) ======================= q-point: ( 0.40 0.25 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 404 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.750 ( 3.743 6.941 6.206) 10.035 2.152 ( 10.238 13.981 -2.670) 17.534 2.684 ( -0.047 -4.790 5.310) 7.151 2.939 ( 5.098 0.326 5.448) 7.469 4.032 ( -2.011 5.263 -2.637) 6.221 4.318 ( -2.147 1.381 1.943) 3.208 4.939 ( 9.829 -8.890 7.235) 15.099 5.221 ( 0.396 -0.629 6.726) 6.767 5.349 ( -2.906 -3.544 -3.693) 5.885 6.050 ( -3.174 -8.605 -5.107) 10.498 6.180 ( 1.331 -4.099 1.488) 4.559 6.382 ( 9.251 -0.140 1.121) 9.320 6.503 ( -0.575 11.114 2.636) 11.437 7.057 ( 3.136 5.309 -5.016) 7.949 7.078 ( 0.022 2.370 3.826) 4.500 7.487 ( 1.161 12.390 -5.241) 13.503 7.557 ( -2.289 5.629 2.778) 6.682 8.092 ( 0.416 0.265 3.123) 3.161 8.315 ( 0.382 3.033 5.918) 6.661 8.449 ( -0.778 6.527 -3.733) 7.559 8.704 ( -6.453 -1.523 2.401) 7.052 9.044 ( -1.072 2.689 3.532) 4.567 9.062 ( 1.277 -1.465 5.545) 5.876 9.213 ( -3.102 3.463 -0.170) 4.652 9.635 ( -3.959 -3.910 -0.373) 5.577 9.891 ( -3.166 0.112 -1.872) 3.679 10.046 ( 0.204 -4.545 -2.296) 5.096 10.237 ( -3.776 0.805 -5.240) 6.509 10.430 ( -4.544 -1.817 0.095) 4.895 10.871 ( 0.486 3.094 2.046) 3.741 11.111 ( -0.282 3.954 -3.559) 5.328 11.559 ( -2.753 -1.343 0.197) 3.069 11.754 ( -1.241 0.182 12.165) 12.229 12.005 ( -3.220 1.548 -12.137) 12.652 12.710 ( 2.790 -10.841 1.345) 11.275 13.058 ( 3.097 -14.415 -4.504) 15.416 13.327 ( -4.029 6.573 0.248) 7.714 13.729 ( 1.118 -0.665 0.091) 1.304 14.352 ( -1.358 -6.784 -1.552) 7.091 14.882 ( 0.496 7.672 -2.900) 8.217 15.366 ( 15.395 -1.968 -10.362) 18.662 15.841 ( -4.410 -0.569 4.765) 6.517 16.052 ( 0.902 1.419 5.197) 5.462 16.308 ( 1.831 1.015 -5.543) 5.925 17.166 ( -4.516 -0.084 6.049) 7.550 17.923 ( 1.324 -6.241 3.064) 7.077 18.931 ( -2.638 4.278 -3.018) 5.863 19.394 ( 0.804 1.731 4.711) 5.083 ======================= Grid point 27 (18/260) ======================= q-point: (-0.50 0.25 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 208 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.806 ( 0.000 5.098 -0.000) 5.098 2.246 ( 0.000 14.551 0.000) 14.551 2.697 ( 0.000 -3.680 0.000) 3.680 3.006 ( 0.000 -1.961 -0.000) 1.961 4.003 ( 0.000 5.915 0.000) 5.915 4.302 ( 0.000 1.511 0.000) 1.511 5.125 ( -0.000 -5.586 0.000) 5.586 5.173 ( 0.000 -2.748 0.000) 2.748 5.321 ( 0.000 -6.661 0.000) 6.661 5.991 ( 0.000 -7.820 -0.000) 7.820 6.204 ( 0.000 -5.314 0.000) 5.314 6.482 ( -0.000 4.508 0.000) 4.508 6.507 ( 0.000 7.551 -0.000) 7.551 7.057 ( 0.000 5.948 -0.000) 5.948 7.112 ( 0.000 3.143 0.000) 3.143 7.487 ( 0.000 22.123 0.000) 22.123 7.537 ( 0.000 -0.662 -0.000) 0.662 8.104 ( 0.000 -0.225 0.000) 0.225 8.366 ( 0.000 0.283 0.000) 0.283 8.410 ( -0.000 6.479 -0.000) 6.479 8.633 ( -0.000 -1.472 0.000) 1.472 9.016 ( 0.000 2.880 0.000) 2.880 9.117 ( 0.000 -2.655 0.000) 2.655 9.191 ( 0.000 1.499 0.000) 1.499 9.590 ( 0.000 -3.745 0.000) 3.745 9.847 ( 0.000 -0.709 0.000) 0.709 10.044 ( 0.000 -3.738 0.000) 3.738 10.183 ( 0.000 2.050 -0.000) 2.050 10.387 ( 0.000 -2.197 0.000) 2.197 10.890 ( 0.000 2.540 0.000) 2.540 11.093 ( 0.000 3.672 0.000) 3.672 11.532 ( 0.000 0.070 -0.000) 0.070 11.820 ( -0.000 -3.380 -0.000) 3.380 11.890 ( 0.000 6.977 0.000) 6.977 12.743 ( 0.000 -10.800 -0.000) 10.800 13.079 ( 0.000 -16.205 0.000) 16.205 13.285 ( 0.000 6.284 -0.000) 6.284 13.743 ( 0.000 -2.956 0.000) 2.956 14.331 ( -0.000 -5.619 -0.000) 5.619 14.876 ( 0.000 9.932 0.000) 9.932 15.499 ( 0.000 -1.493 0.000) 1.493 15.797 ( 0.000 -1.697 -0.000) 1.697 16.080 ( 0.000 2.073 0.000) 2.073 16.309 ( 0.000 0.320 0.000) 0.320 17.139 ( 0.000 -0.126 0.000) 0.126 17.944 ( 0.000 -5.627 0.000) 5.627 18.897 ( 0.000 3.135 -0.000) 3.135 19.417 ( 0.000 2.135 0.000) 2.135 ======================= Grid point 33 (19/260) ======================= q-point: ( 0.00 0.38 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 208 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.290 ( 0.000 24.071 0.000) 24.071 1.758 ( 0.000 17.123 0.000) 17.123 2.205 ( 0.000 -17.176 0.000) 17.176 2.415 ( 0.000 23.510 0.000) 23.510 4.243 ( 0.000 -5.058 0.000) 5.058 4.289 ( 0.000 -1.271 0.000) 1.271 4.346 ( 0.000 6.372 0.000) 6.372 4.698 ( 0.000 -2.311 0.000) 2.311 5.421 ( 0.000 -6.094 0.000) 6.094 5.994 ( 0.000 2.063 0.000) 2.063 6.069 ( 0.000 -0.179 0.000) 0.179 6.294 ( 0.000 0.850 0.000) 0.850 6.469 ( 0.000 3.089 0.000) 3.089 6.939 ( 0.000 -4.820 0.000) 4.820 7.084 ( 0.000 -5.740 0.000) 5.740 7.143 ( 0.000 -2.803 0.000) 2.803 7.703 ( 0.000 -2.369 0.000) 2.369 8.055 ( 0.000 3.570 0.000) 3.570 8.308 ( 0.000 1.559 0.000) 1.559 8.730 ( 0.000 -1.494 0.000) 1.494 8.922 ( 0.000 21.964 0.000) 21.964 9.050 ( 0.000 0.111 0.000) 0.111 9.367 ( 0.000 16.004 0.000) 16.004 9.733 ( 0.000 -0.552 0.000) 0.552 9.876 ( 0.000 -6.931 0.000) 6.931 9.950 ( 0.000 -9.445 0.000) 9.445 10.339 ( 0.000 0.964 0.000) 0.964 10.570 ( 0.000 -6.026 0.000) 6.026 10.820 ( 0.000 -0.292 0.000) 0.292 11.042 ( 0.000 -3.159 0.000) 3.159 11.210 ( 0.000 -3.670 0.000) 3.670 11.735 ( 0.000 -8.003 0.000) 8.003 11.944 ( 0.000 1.300 0.000) 1.300 12.211 ( 0.000 -0.930 0.000) 0.930 12.302 ( 0.000 -2.845 0.000) 2.845 13.160 ( 0.000 2.379 0.000) 2.379 13.719 ( 0.000 10.561 0.000) 10.561 13.881 ( 0.000 5.929 0.000) 5.929 13.896 ( 0.000 12.006 0.000) 12.006 14.494 ( 0.000 -13.965 0.000) 13.965 14.520 ( 0.000 -10.955 0.000) 10.955 15.639 ( 0.000 0.025 0.000) 0.025 16.130 ( 0.000 -0.149 0.000) 0.149 16.887 ( 0.000 0.598 0.000) 0.598 16.976 ( 0.000 0.818 0.000) 0.818 17.380 ( 0.000 0.856 0.000) 0.856 18.937 ( 0.000 1.729 0.000) 1.729 19.860 ( 0.000 1.250 0.000) 1.250 ======================= Grid point 34 (20/260) ======================= q-point: ( 0.10 0.38 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 400 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.446 ( 10.830 19.683 11.572) 25.271 1.751 ( -2.257 17.167 6.422) 18.467 2.256 ( 3.086 -15.201 5.284) 16.387 2.494 ( 7.071 18.650 2.006) 20.046 4.216 ( -2.609 -2.211 0.900) 3.536 4.260 ( 1.347 -5.765 -5.304) 7.949 4.450 ( 3.996 8.227 9.300) 13.044 4.731 ( 2.588 -3.274 3.617) 5.523 5.478 ( 4.348 -3.755 3.868) 6.926 5.976 ( -2.857 2.441 0.494) 3.790 6.020 ( -1.335 -1.258 -4.837) 5.173 6.280 ( -2.244 -1.448 -0.354) 2.694 6.519 ( 4.823 4.337 0.928) 6.553 6.927 ( 1.272 -4.510 -6.520) 8.029 7.081 ( 0.333 -2.150 0.241) 2.189 7.195 ( 5.172 -5.828 -2.807) 8.283 7.723 ( 0.749 -1.089 4.036) 4.247 8.056 ( -1.158 3.361 3.590) 5.052 8.326 ( -0.018 1.860 5.499) 5.805 8.729 ( -1.148 0.202 2.698) 2.939 8.926 ( -0.689 18.471 2.779) 18.691 9.027 ( -1.422 1.426 -2.462) 3.181 9.320 ( -4.210 14.628 0.079) 15.222 9.735 ( -1.226 -0.680 -0.355) 1.446 9.779 ( -7.397 -4.811 1.897) 9.026 9.962 ( -0.029 -10.494 -1.552) 10.608 10.324 ( -1.626 2.409 -6.360) 6.993 10.507 ( -1.493 -4.540 -4.228) 6.381 10.825 ( -2.348 1.925 3.953) 4.984 10.975 ( -6.276 -3.282 1.336) 7.208 11.208 ( -1.588 -5.787 2.654) 6.562 11.643 ( -8.744 -3.178 5.884) 11.009 11.977 ( 3.360 -3.019 -2.896) 5.366 12.213 ( -8.611 0.510 1.755) 8.803 12.255 ( 3.264 -2.348 0.914) 4.124 13.095 ( -2.016 1.607 -10.338) 10.654 13.674 ( -2.432 4.806 1.826) 5.687 13.873 ( -2.441 9.743 1.082) 10.102 14.114 ( 17.597 5.122 -4.888) 18.968 14.459 ( 2.830 -10.370 -8.057) 13.434 14.601 ( 7.470 -9.342 -3.050) 12.344 15.704 ( 4.668 -0.274 4.640) 6.587 16.101 ( -3.600 -0.174 1.838) 4.046 16.629 ( -8.196 3.491 -13.617) 16.272 17.275 ( 11.186 -2.319 16.158) 19.789 17.361 ( -3.084 0.627 4.052) 5.131 19.000 ( 4.615 1.882 4.492) 6.709 19.737 ( -9.939 1.946 -5.554) 11.551 ======================= Grid point 35 (21/260) ======================= q-point: ( 0.20 0.38 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 400 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.760 ( 3.990 14.991 11.697) 19.429 1.786 ( 9.479 12.528 9.766) 18.498 2.367 ( 3.629 -11.941 8.536) 15.121 2.682 ( 9.102 11.532 5.222) 15.591 4.181 ( -0.439 -1.378 -3.110) 3.430 4.271 ( 1.368 -6.044 0.738) 6.240 4.556 ( 1.601 6.817 6.909) 9.837 4.857 ( 6.299 -4.018 8.216) 11.105 5.587 ( 0.695 3.322 5.945) 6.845 5.921 ( 1.937 -1.378 -3.144) 3.942 6.002 ( 1.859 -2.972 -5.528) 6.546 6.205 ( -4.719 -3.801 -0.044) 6.060 6.633 ( 4.972 7.447 2.152) 9.209 6.924 ( 3.234 -4.517 -7.300) 9.174 7.105 ( 2.170 1.234 -0.802) 2.622 7.286 ( 6.404 -7.519 -4.847) 11.002 7.776 ( 1.276 3.367 5.995) 6.993 8.056 ( -1.581 2.467 5.653) 6.368 8.370 ( -0.106 2.537 8.598) 8.965 8.709 ( -3.193 3.047 2.916) 5.290 8.886 ( -5.777 7.085 1.897) 9.337 9.004 ( 0.706 8.161 0.098) 8.192 9.240 ( -4.107 10.264 1.639) 11.176 9.581 ( -10.643 -2.145 -0.103) 10.858 9.725 ( -2.882 -2.365 0.805) 3.814 9.937 ( -0.506 -8.749 -2.413) 9.090 10.179 ( -6.914 0.434 -7.625) 10.302 10.500 ( 0.880 3.612 -3.559) 5.147 10.727 ( -9.145 0.208 0.491) 9.161 10.896 ( -1.635 -0.033 2.030) 2.607 11.158 ( -4.941 -8.503 1.183) 9.905 11.548 ( -5.634 -1.723 10.092) 11.686 12.021 ( -2.141 0.960 2.037) 3.108 12.028 ( -5.270 -0.594 -2.981) 6.083 12.337 ( 3.982 -5.882 1.663) 7.295 12.986 ( -0.840 -1.901 -15.325) 15.466 13.633 ( -2.324 3.603 -2.435) 4.931 13.818 ( -3.501 6.387 0.680) 7.316 14.256 ( 0.114 -6.727 -0.532) 6.749 14.663 ( 22.538 -0.690 -12.612) 25.836 14.754 ( 11.048 -3.910 -5.573) 12.977 15.843 ( 5.249 0.128 6.625) 8.453 16.021 ( -5.938 -0.334 3.297) 6.800 16.449 ( -2.999 3.748 -10.389) 11.444 17.305 ( -5.938 0.555 7.701) 9.740 17.553 ( 7.665 -3.910 12.577) 15.239 19.141 ( 5.560 2.999 5.565) 8.419 19.470 ( -12.051 1.708 -6.365) 13.735 ======================= Grid point 36 (22/260) ======================= q-point: ( 0.30 0.38 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 400 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.827 ( 0.767 10.049 7.735) 12.705 2.108 ( 12.987 7.758 8.658) 17.430 2.494 ( 3.633 -7.492 9.334) 12.508 2.869 ( 5.956 6.454 5.051) 10.131 4.152 ( -0.300 1.319 -3.888) 4.117 4.312 ( 0.938 -4.373 3.093) 5.438 4.639 ( 4.536 2.172 5.198) 7.233 5.032 ( 5.742 -4.646 7.646) 10.631 5.514 ( -8.314 4.214 0.567) 9.338 5.968 ( 0.888 -4.896 -7.234) 8.780 6.092 ( 7.718 -2.446 -0.204) 8.099 6.142 ( 1.602 -2.754 3.528) 4.754 6.718 ( 2.884 10.398 1.682) 10.920 6.971 ( 4.451 -3.588 -1.685) 5.960 7.139 ( 1.797 2.702 -2.147) 3.891 7.373 ( 6.576 -6.921 -7.561) 12.179 7.840 ( 1.351 9.914 6.375) 11.864 8.074 ( -0.201 1.328 5.763) 5.917 8.418 ( -1.095 4.840 8.519) 9.859 8.627 ( -5.119 3.914 -1.840) 6.702 8.770 ( -7.035 -1.020 2.497) 7.534 9.029 ( 0.212 7.739 4.196) 8.805 9.177 ( -4.673 5.264 3.381) 7.809 9.373 ( -9.766 -2.092 -0.979) 10.035 9.661 ( -3.061 -1.524 -1.182) 3.618 9.925 ( 0.662 -7.339 -2.506) 7.783 10.009 ( -6.161 -0.189 -4.878) 7.860 10.453 ( -3.059 9.842 -3.318) 10.827 10.539 ( -9.256 -0.881 -0.403) 9.307 10.911 ( 0.622 1.705 1.748) 2.521 11.068 ( -3.205 -10.804 -1.655) 11.391 11.534 ( -2.513 -2.201 8.697) 9.316 11.869 ( -6.944 7.107 4.363) 10.852 12.059 ( 2.374 -2.533 -3.925) 5.240 12.419 ( 2.908 -9.416 2.690) 10.216 12.877 ( 0.067 -5.704 -16.496) 17.454 13.549 ( -4.312 4.902 -2.768) 7.091 13.759 ( -2.774 2.125 0.445) 3.522 14.241 ( -0.185 -6.185 -1.901) 6.473 14.901 ( 8.618 -0.518 -3.413) 9.283 15.043 ( 21.366 0.662 -12.269) 24.647 15.909 ( -5.291 0.413 4.017) 6.656 15.987 ( 2.738 -0.378 6.608) 7.163 16.368 ( -0.225 2.460 -7.182) 7.595 17.233 ( -6.462 0.305 8.204) 10.448 17.729 ( 4.040 -3.908 8.500) 10.190 19.154 ( -6.252 5.204 -6.594) 10.472 19.343 ( 1.495 -0.698 6.427) 6.635 ======================= Grid point 37 (23/260) ======================= q-point: ( 0.40 0.38 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 400 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.876 ( 0.358 5.014 4.085) 6.477 2.374 ( 9.557 7.475 5.213) 13.205 2.609 ( 2.687 -2.561 6.213) 7.237 2.952 ( 0.643 0.984 1.619) 2.000 4.124 ( -0.478 3.600 -2.312) 4.305 4.327 ( -0.781 -0.765 2.058) 2.330 4.820 ( 10.530 -2.313 5.069) 11.913 5.152 ( 2.670 -4.884 3.930) 6.814 5.326 ( -10.142 0.069 -2.578) 10.465 5.924 ( -0.539 -3.967 -4.907) 6.334 6.101 ( -0.719 -2.831 1.697) 3.378 6.346 ( 8.455 -2.022 1.800) 8.878 6.784 ( 2.817 13.936 1.973) 14.354 7.064 ( 4.016 -1.948 4.094) 6.057 7.138 ( 0.517 2.255 -4.545) 5.100 7.443 ( 5.064 -5.514 -6.266) 9.763 7.900 ( 0.849 15.928 4.484) 16.568 8.106 ( 0.042 1.757 2.933) 3.419 8.402 ( -3.266 4.989 3.336) 6.833 8.561 ( -0.973 2.936 -0.817) 3.199 8.639 ( -7.006 -5.121 1.427) 8.794 9.048 ( -3.169 1.193 3.840) 5.120 9.102 ( -2.694 2.600 3.184) 4.915 9.232 ( -4.095 -1.706 -0.046) 4.436 9.601 ( -1.772 1.227 -2.972) 3.672 9.875 ( -3.033 -3.740 -5.117) 7.027 9.942 ( -0.084 -3.610 1.660) 3.975 10.376 ( -2.573 12.366 -1.820) 12.762 10.394 ( -5.001 -1.393 -0.658) 5.233 10.920 ( -0.484 1.190 2.556) 2.861 11.016 ( -1.499 -11.718 -2.484) 12.072 11.552 ( 0.979 0.848 1.382) 1.894 11.819 ( -2.980 5.660 9.118) 11.138 12.053 ( 0.232 2.195 -5.987) 6.380 12.477 ( 1.297 -11.666 2.544) 12.010 12.802 ( 1.332 -9.815 -11.189) 14.943 13.451 ( -3.991 5.175 -1.262) 6.656 13.721 ( -1.284 -0.051 0.162) 1.295 14.229 ( -0.003 -5.057 -1.421) 5.253 15.012 ( 4.802 4.962 -2.625) 7.388 15.325 ( 13.763 -1.796 -7.934) 15.987 15.825 ( -5.137 -0.856 3.414) 6.227 16.072 ( 1.631 0.585 4.941) 5.236 16.337 ( 0.447 1.499 -4.176) 4.459 17.168 ( -4.356 0.243 5.428) 6.964 17.822 ( 1.648 -3.570 4.235) 5.778 19.007 ( -4.065 2.961 -4.168) 6.532 19.422 ( 1.807 0.982 4.285) 4.753 ======================= Grid point 38 (24/260) ======================= q-point: (-0.50 0.38 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 208 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.892 ( 0.000 3.095 -0.000) 3.095 2.495 ( 0.000 9.447 -0.000) 9.447 2.656 ( -0.000 -0.549 0.000) 0.549 2.950 ( 0.000 -2.991 -0.000) 2.991 4.111 ( 0.000 4.403 0.000) 4.403 4.324 ( 0.000 0.512 0.000) 0.512 5.051 ( 0.000 -1.240 0.000) 1.240 5.099 ( -0.000 -3.973 -0.000) 3.973 5.203 ( 0.000 -5.274 0.000) 5.274 5.903 ( 0.000 -1.656 0.000) 1.656 6.100 ( 0.000 -3.975 0.000) 3.975 6.432 ( -0.000 -2.806 0.000) 2.806 6.825 ( 0.000 16.229 0.000) 16.229 7.119 ( 0.000 0.980 -0.000) 0.980 7.136 ( -0.000 -0.365 0.000) 0.365 7.478 ( 0.000 -5.128 0.000) 5.128 7.916 ( 0.000 19.430 -0.000) 19.430 8.108 ( 0.000 1.274 0.000) 1.274 8.407 ( 0.000 3.036 0.000) 3.036 8.494 ( -0.000 -2.678 -0.000) 2.678 8.602 ( -0.000 0.961 0.000) 0.961 9.000 ( 0.000 -3.992 0.000) 3.992 9.106 ( 0.000 2.171 -0.000) 2.171 9.198 ( 0.000 -1.105 0.000) 1.105 9.571 ( 0.000 2.452 0.000) 2.452 9.825 ( 0.000 -2.540 0.000) 2.540 9.949 ( 0.000 -4.478 0.000) 4.478 10.343 ( 0.000 -2.000 -0.000) 2.000 10.346 ( -0.000 13.352 0.000) 13.352 10.931 ( 0.000 1.502 0.000) 1.502 10.983 ( 0.000 -12.897 -0.000) 12.897 11.570 ( 0.000 3.357 0.000) 3.357 11.831 ( 0.000 2.817 -0.000) 2.817 12.025 ( 0.000 6.000 0.000) 6.000 12.497 ( 0.000 -12.541 0.000) 12.541 12.783 ( 0.000 -11.818 0.000) 11.818 13.404 ( 0.000 5.086 -0.000) 5.086 13.710 ( 0.000 -0.699 0.000) 0.699 14.224 ( 0.000 -4.562 0.000) 4.562 15.051 ( 0.000 7.186 0.000) 7.186 15.443 ( 0.000 -3.615 0.000) 3.615 15.777 ( 0.000 -0.415 -0.000) 0.415 16.104 ( 0.000 0.515 0.000) 0.515 16.328 ( 0.000 1.238 0.000) 1.238 17.142 ( 0.000 0.276 0.000) 0.276 17.850 ( 0.000 -3.405 0.000) 3.405 18.955 ( 0.000 2.366 -0.000) 2.366 19.453 ( 0.000 1.321 0.000) 1.321 ======================= Grid point 44 (25/260) ======================= q-point: ( 0.00 -0.50 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 156 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.731 ( 0.000 -0.000 0.000) 0.000 1.754 ( 0.000 0.000 0.000) 0.000 2.021 ( 0.000 0.000 0.000) 0.000 2.661 ( 0.000 0.000 0.000) 0.000 4.162 ( 0.000 0.000 0.000) 0.000 4.269 ( 0.000 0.000 0.000) 0.000 4.454 ( 0.000 0.000 0.000) 0.000 4.658 ( 0.000 0.000 0.000) 0.000 5.353 ( 0.000 0.000 0.000) 0.000 6.015 ( 0.000 0.000 0.000) 0.000 6.068 ( 0.000 0.000 0.000) 0.000 6.303 ( 0.000 0.000 0.000) 0.000 6.505 ( 0.000 0.000 0.000) 0.000 6.883 ( 0.000 0.000 0.000) 0.000 7.026 ( 0.000 0.000 0.000) 0.000 7.115 ( 0.000 0.000 0.000) 0.000 7.675 ( 0.000 0.000 0.000) 0.000 8.101 ( 0.000 0.000 0.000) 0.000 8.323 ( 0.000 0.000 0.000) 0.000 8.711 ( 0.000 0.000 0.000) 0.000 9.050 ( 0.000 0.000 0.000) 0.000 9.204 ( 0.000 0.000 0.000) 0.000 9.637 ( 0.000 0.000 0.000) 0.000 9.717 ( 0.000 0.000 0.000) 0.000 9.751 ( 0.000 -0.000 0.000) 0.000 9.753 ( 0.000 0.000 0.000) 0.000 10.356 ( 0.000 0.000 0.000) 0.000 10.510 ( 0.000 0.000 0.000) 0.000 10.823 ( 0.000 0.000 0.000) 0.000 11.000 ( 0.000 0.000 0.000) 0.000 11.167 ( 0.000 0.000 0.000) 0.000 11.654 ( 0.000 0.000 0.000) 0.000 11.958 ( 0.000 0.000 0.000) 0.000 12.206 ( 0.000 -0.000 0.000) 0.000 12.266 ( 0.000 0.000 0.000) 0.000 13.190 ( 0.000 0.000 0.000) 0.000 13.810 ( 0.000 0.000 0.000) 0.000 13.951 ( 0.000 0.000 0.000) 0.000 14.173 ( 0.000 0.000 0.000) 0.000 14.215 ( 0.000 -0.000 0.000) 0.000 14.393 ( 0.000 0.000 0.000) 0.000 15.638 ( 0.000 0.000 0.000) 0.000 16.129 ( 0.000 0.000 0.000) 0.000 16.893 ( 0.000 0.000 0.000) 0.000 16.984 ( 0.000 0.000 0.000) 0.000 17.389 ( 0.000 0.000 0.000) 0.000 18.955 ( 0.000 0.000 0.000) 0.000 19.873 ( 0.000 0.000 0.000) 0.000 ======================= Grid point 46 (26/260) ======================= q-point: ( 0.10 -0.50 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 250 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.815 ( 5.357 -0.000 6.699) 8.577 1.822 ( 3.573 0.000 8.893) 9.584 2.041 ( 1.116 0.000 4.360) 4.501 2.693 ( 1.629 0.000 6.202) 6.412 4.174 ( 1.714 -0.000 -1.835) 2.511 4.203 ( -1.926 0.000 -5.694) 6.011 4.584 ( 6.336 -0.000 11.801) 13.394 4.659 ( -0.321 0.000 1.282) 1.322 5.435 ( 6.919 0.000 4.199) 8.094 5.998 ( -0.167 -0.000 -3.970) 3.974 6.016 ( -4.842 0.000 -0.767) 4.903 6.261 ( -4.199 -0.000 -0.721) 4.260 6.568 ( 6.348 0.000 0.355) 6.358 6.874 ( 1.456 0.000 -7.202) 7.348 7.058 ( 2.500 -0.000 1.588) 2.962 7.139 ( 3.515 0.000 -3.666) 5.078 7.707 ( 1.705 0.000 5.129) 5.405 8.099 ( -1.311 0.000 3.304) 3.554 8.344 ( 0.420 0.000 4.911) 4.929 8.720 ( -0.545 0.000 3.997) 4.034 9.025 ( -2.678 -0.000 -0.278) 2.692 9.192 ( -1.006 -0.000 0.055) 1.008 9.534 ( -8.505 0.000 1.339) 8.609 9.698 ( -5.456 0.000 -0.266) 5.462 9.724 ( -2.990 -0.000 1.741) 3.460 9.769 ( 4.371 0.000 -4.732) 6.442 10.353 ( -2.651 0.000 -8.221) 8.638 10.466 ( 2.355 -0.000 -1.531) 2.809 10.877 ( 0.777 0.000 8.934) 8.968 10.915 ( -8.018 -0.000 0.392) 8.028 11.135 ( -4.112 0.000 0.475) 4.139 11.607 ( -6.191 0.000 6.401) 8.905 11.947 ( 1.466 0.000 -5.537) 5.727 12.217 ( -5.261 -0.000 1.152) 5.386 12.232 ( 0.997 -0.000 3.073) 3.231 13.115 ( -3.101 0.000 -11.491) 11.902 13.723 ( -3.861 0.000 0.057) 3.861 14.004 ( -4.675 0.000 7.341) 8.703 14.171 ( 0.711 0.000 -2.590) 2.686 14.348 ( 20.340 -0.000 -15.407) 25.517 14.475 ( 8.312 0.000 -1.168) 8.394 15.701 ( 4.462 0.000 4.832) 6.577 16.099 ( -3.561 -0.000 1.620) 3.912 16.663 ( -7.686 0.000 -12.407) 14.595 17.253 ( 10.641 0.000 14.763) 18.198 17.368 ( -3.527 0.000 4.295) 5.558 19.019 ( 4.682 0.000 4.916) 6.789 19.757 ( -9.303 0.000 -6.267) 11.217 ======================= Grid point 48 (27/260) ======================= q-point: ( 0.20 -0.50 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 252 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.929 ( 0.754 0.000 5.886) 5.934 1.980 ( 5.354 -0.000 13.618) 14.632 2.163 ( 7.663 0.000 9.573) 12.262 2.806 ( 4.688 -0.000 8.970) 10.122 4.162 ( 0.686 0.000 -4.039) 4.097 4.203 ( 2.568 0.000 -1.691) 3.075 4.662 ( -0.229 -0.000 1.867) 1.881 4.787 ( 6.189 0.000 12.879) 14.289 5.625 ( 5.070 0.000 8.084) 9.543 5.917 ( -0.614 0.000 -3.623) 3.675 5.963 ( 0.644 -0.000 -9.443) 9.465 6.161 ( -5.320 -0.000 1.696) 5.584 6.726 ( 8.192 0.000 2.664) 8.614 6.858 ( 2.345 0.000 -8.827) 9.133 7.126 ( 3.584 -0.000 0.094) 3.585 7.201 ( 5.766 0.000 -5.647) 8.070 7.802 ( 3.803 0.000 7.826) 8.701 8.092 ( -2.134 0.000 5.615) 6.007 8.393 ( 0.707 -0.000 7.092) 7.127 8.724 ( -2.714 0.000 6.211) 6.778 8.933 ( -6.528 -0.000 -2.158) 6.875 9.176 ( -1.376 -0.000 2.509) 2.861 9.366 ( -8.702 0.000 0.681) 8.728 9.543 ( -10.439 0.000 0.458) 10.450 9.677 ( -2.020 -0.000 0.331) 2.047 9.808 ( 2.990 -0.000 -5.673) 6.413 10.181 ( -7.382 0.000 -7.823) 10.756 10.575 ( 6.615 -0.000 -0.186) 6.617 10.731 ( -10.575 -0.000 -0.121) 10.575 10.919 ( -1.533 0.000 6.762) 6.934 11.013 ( -7.546 0.000 -1.874) 7.776 11.533 ( -6.170 0.000 10.689) 12.341 11.967 ( 4.046 -0.000 -5.486) 6.817 12.095 ( -7.939 -0.000 2.496) 8.323 12.268 ( 0.451 -0.000 4.017) 4.043 12.968 ( -1.905 0.000 -18.561) 18.658 13.669 ( -1.855 0.000 -2.581) 3.179 13.900 ( -7.609 0.000 2.941) 8.158 14.170 ( 1.224 -0.000 -3.560) 3.764 14.670 ( 12.192 0.000 -2.174) 12.384 14.706 ( 23.996 0.000 -13.572) 27.568 15.843 ( 5.602 -0.000 7.283) 9.188 16.017 ( -6.155 -0.000 2.885) 6.797 16.487 ( -3.543 0.000 -9.859) 10.477 17.311 ( -6.003 0.000 7.370) 9.505 17.515 ( 7.398 0.000 12.535) 14.555 19.171 ( 6.268 0.000 7.631) 9.875 19.486 ( -12.373 0.000 -9.092) 15.354 ======================= Grid point 50 (28/260) ======================= q-point: ( 0.30 -0.50 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 250 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.941 ( -1.931 0.000 4.521) 4.916 2.196 ( 7.759 -0.000 14.868) 16.771 2.396 ( 9.058 0.000 8.695) 12.556 2.940 ( 3.294 -0.000 5.264) 6.209 4.164 ( 1.090 0.000 -2.402) 2.638 4.254 ( 3.016 0.000 0.540) 3.064 4.690 ( 2.655 0.000 1.918) 3.275 4.967 ( 4.991 0.000 9.384) 10.629 5.565 ( -10.670 0.000 0.986) 10.716 5.909 ( 0.817 -0.000 -10.334) 10.366 6.085 ( 13.916 0.000 2.246) 14.096 6.100 ( -2.988 -0.000 3.629) 4.701 6.873 ( 4.498 -0.000 -5.508) 7.111 6.888 ( 5.172 0.000 6.696) 8.461 7.178 ( 3.195 -0.000 -5.651) 6.492 7.283 ( 6.235 0.000 -5.676) 8.432 7.934 ( 4.488 0.000 7.347) 8.609 8.102 ( -0.283 0.000 6.922) 6.927 8.459 ( 1.838 -0.000 6.780) 7.025 8.680 ( -6.014 0.000 5.757) 8.325 8.737 ( -11.197 -0.000 -4.724) 12.152 9.166 ( -1.996 -0.000 4.716) 5.121 9.233 ( -6.023 0.000 1.865) 6.305 9.317 ( -12.506 -0.000 0.010) 12.506 9.661 ( 1.030 0.000 -2.943) 3.118 9.809 ( 0.567 -0.000 -5.345) 5.375 10.012 ( -6.054 0.000 -3.010) 6.761 10.529 ( -9.503 -0.000 -0.859) 9.542 10.659 ( 0.881 -0.000 1.599) 1.825 10.851 ( -6.658 0.000 -3.844) 7.688 10.930 ( 0.372 0.000 2.508) 2.535 11.516 ( -1.833 -0.000 8.769) 8.959 11.972 ( -6.862 -0.000 5.502) 8.795 12.023 ( 4.286 0.000 -3.557) 5.570 12.301 ( 0.419 0.000 4.064) 4.085 12.820 ( -0.524 0.000 -20.999) 21.006 13.600 ( -3.410 0.000 -3.534) 4.911 13.786 ( -5.291 0.000 1.807) 5.591 14.172 ( 1.069 -0.000 -3.021) 3.205 14.890 ( 11.712 0.000 -2.909) 12.067 15.058 ( 19.788 -0.000 -11.300) 22.787 15.910 ( -6.686 -0.000 3.435) 7.517 15.984 ( 3.984 0.000 7.279) 8.298 16.394 ( -0.989 0.000 -6.831) 6.902 17.236 ( -6.448 0.000 7.916) 10.209 17.691 ( 4.055 0.000 8.786) 9.676 19.214 ( -9.519 0.000 -8.002) 12.436 19.328 ( 4.746 -0.000 7.139) 8.573 ======================= Grid point 52 (29/260) ======================= q-point: ( 0.40 -0.50 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 252 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.929 ( -1.442 0.000 2.567) 2.944 2.444 ( 8.314 0.000 12.335) 14.875 2.585 ( 5.674 0.000 4.720) 7.380 2.966 ( -1.747 -0.000 -1.484) 2.292 4.164 ( 0.055 0.000 -1.200) 1.201 4.309 ( 1.464 0.000 1.545) 2.128 4.816 ( 9.108 0.000 2.964) 9.578 5.087 ( 2.997 -0.000 4.071) 5.055 5.328 ( -12.788 0.000 -2.630) 13.056 5.886 ( 1.726 0.000 -5.201) 5.480 6.074 ( -1.826 0.000 2.152) 2.822 6.324 ( 7.733 -0.000 2.016) 7.991 6.981 ( 7.935 -0.000 -0.183) 7.937 7.005 ( 1.424 0.000 10.858) 10.951 7.169 ( 1.458 -0.000 -11.356) 11.449 7.359 ( 4.486 0.000 -3.996) 6.008 8.043 ( 2.581 0.000 4.304) 5.019 8.181 ( 4.186 0.000 6.241) 7.515 8.462 ( -10.987 0.000 -1.712) 11.120 8.563 ( -8.288 -0.000 2.042) 8.536 8.566 ( 3.574 0.000 1.328) 3.813 9.070 ( -11.335 0.000 2.469) 11.601 9.162 ( -1.212 -0.000 4.060) 4.237 9.174 ( -2.244 0.000 -0.856) 2.401 9.660 ( 0.945 0.000 -4.814) 4.906 9.770 ( -1.174 -0.000 -3.765) 3.944 9.926 ( -2.482 0.000 1.565) 2.934 10.376 ( -5.457 -0.000 -0.681) 5.499 10.653 ( -1.500 -0.000 1.698) 2.265 10.730 ( -3.384 0.000 -2.976) 4.506 10.948 ( -0.053 0.000 0.910) 0.912 11.569 ( 3.336 -0.000 1.791) 3.786 11.899 ( -5.400 0.000 7.997) 9.650 12.074 ( 2.575 0.000 -1.792) 3.138 12.332 ( 0.415 0.000 2.753) 2.784 12.701 ( 0.430 0.000 -15.506) 15.512 13.507 ( -3.704 0.000 -2.033) 4.225 13.723 ( -2.250 0.000 0.844) 2.403 14.174 ( 0.586 -0.000 -1.665) 1.765 15.064 ( 7.604 0.000 -2.558) 8.023 15.305 ( 11.325 -0.000 -6.987) 13.307 15.815 ( -4.818 0.000 2.783) 5.564 16.077 ( 1.664 -0.000 4.800) 5.081 16.354 ( -0.063 0.000 -3.506) 3.507 17.171 ( -4.249 0.000 5.180) 6.700 17.786 ( 1.694 0.000 4.498) 4.807 19.038 ( -4.626 0.000 -4.467) 6.431 19.432 ( 2.278 0.000 4.170) 4.751 ======================= Grid point 54 (30/260) ======================= q-point: (-0.50 -0.50 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 130 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.922 ( 0.000 0.000 -0.000) 0.000 2.593 ( 0.000 0.000 0.000) 0.000 2.656 ( 0.000 0.000 0.000) 0.000 2.915 ( 0.000 0.000 -0.000) 0.000 4.159 ( 0.000 0.000 0.000) 0.000 4.326 ( 0.000 0.000 0.000) 0.000 5.052 ( -0.000 0.000 -0.000) 0.000 5.061 ( 0.000 0.000 0.000) 0.000 5.129 ( 0.000 -0.000 -0.000) 0.000 5.892 ( 0.000 0.000 0.000) 0.000 6.060 ( 0.000 0.000 0.000) 0.000 6.400 ( 0.000 0.000 -0.000) 0.000 7.071 ( 0.000 -0.000 0.000) 0.000 7.084 ( -0.000 0.000 -0.000) 0.000 7.124 ( 0.000 0.000 -0.000) 0.000 7.394 ( -0.000 0.000 0.000) 0.000 8.081 ( 0.000 -0.000 -0.000) 0.000 8.284 ( -0.000 -0.000 -0.000) 0.000 8.320 ( 0.000 0.000 0.000) 0.000 8.446 ( 0.000 0.000 0.000) 0.000 8.632 ( 0.000 0.000 0.000) 0.000 8.948 ( 0.000 0.000 -0.000) 0.000 9.150 ( 0.000 0.000 0.000) 0.000 9.165 ( 0.000 -0.000 0.000) 0.000 9.649 ( 0.000 0.000 -0.000) 0.000 9.742 ( 0.000 -0.000 0.000) 0.000 9.912 ( 0.000 0.000 0.000) 0.000 10.320 ( 0.000 0.000 0.000) 0.000 10.642 ( 0.000 0.000 0.000) 0.000 10.688 ( 0.000 -0.000 0.000) 0.000 10.947 ( 0.000 0.000 0.000) 0.000 11.619 ( 0.000 0.000 0.000) 0.000 11.866 ( 0.000 0.000 -0.000) 0.000 12.094 ( 0.000 -0.000 0.000) 0.000 12.345 ( 0.000 0.000 -0.000) 0.000 12.656 ( 0.000 0.000 0.000) 0.000 13.460 ( 0.000 0.000 -0.000) 0.000 13.704 ( 0.000 0.000 0.000) 0.000 14.174 ( 0.000 0.000 0.000) 0.000 15.133 ( 0.000 0.000 0.000) 0.000 15.394 ( 0.000 -0.000 0.000) 0.000 15.774 ( 0.000 0.000 -0.000) 0.000 16.108 ( 0.000 0.000 0.000) 0.000 16.343 ( 0.000 0.000 0.000) 0.000 17.145 ( 0.000 0.000 0.000) 0.000 17.816 ( 0.000 0.000 0.000) 0.000 18.980 ( 0.000 0.000 0.000) 0.000 19.467 ( 0.000 0.000 0.000) 0.000 ======================= Grid point 99 (31/260) ======================= q-point: ( 0.00 0.00 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 250 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.481 ( -16.773 0.000 23.811) 29.126 0.547 ( 13.790 0.000 26.919) 30.245 1.082 ( -6.568 0.000 52.825) 53.232 2.848 ( 1.408 0.000 4.060) 4.298 4.194 ( -0.420 0.000 -6.021) 6.035 4.354 ( 31.766 0.000 3.883) 32.003 4.399 ( 1.556 0.000 3.660) 3.977 4.926 ( 3.308 0.000 -5.852) 6.722 5.667 ( 4.787 0.000 2.389) 5.350 5.956 ( -1.192 0.000 -0.306) 1.230 6.045 ( -0.125 0.000 5.341) 5.343 6.222 ( -7.045 0.000 2.108) 7.353 6.297 ( -8.127 0.000 3.471) 8.837 6.983 ( -0.171 0.000 -3.490) 3.494 7.227 ( -1.182 0.000 0.412) 1.252 7.484 ( -3.788 0.000 -3.883) 5.424 7.624 ( 16.750 0.000 -4.397) 17.318 7.754 ( 4.680 0.000 1.957) 5.073 7.864 ( 6.552 0.000 -2.499) 7.013 8.294 ( -3.100 0.000 4.297) 5.298 8.346 ( 5.603 0.000 1.829) 5.894 8.897 ( 5.081 0.000 -2.266) 5.563 9.101 ( -1.687 0.000 1.681) 2.381 9.804 ( -3.189 0.000 -0.591) 3.243 10.119 ( 1.120 0.000 -3.231) 3.419 10.261 ( 2.761 0.000 -5.896) 6.510 10.495 ( -4.060 0.000 -3.195) 5.166 10.760 ( -2.841 0.000 -4.287) 5.143 11.142 ( -2.604 0.000 -6.885) 7.361 11.174 ( -2.011 0.000 2.929) 3.553 11.503 ( -13.757 0.000 8.690) 16.272 11.825 ( 6.359 0.000 -4.995) 8.086 11.947 ( -2.258 0.000 3.817) 4.435 12.273 ( -1.364 0.000 -0.180) 1.376 12.330 ( 18.190 0.000 -6.469) 19.306 12.768 ( -2.254 0.000 4.455) 4.993 13.447 ( -7.939 0.000 -1.688) 8.116 13.463 ( -0.087 0.000 -11.254) 11.254 13.844 ( -38.628 0.000 10.109) 39.929 15.056 ( -1.929 0.000 -2.937) 3.514 15.493 ( 2.030 0.000 2.237) 3.021 15.600 ( -9.732 0.000 -0.603) 9.750 15.941 ( -35.299 0.000 -2.537) 35.390 16.148 ( -3.017 0.000 0.598) 3.076 17.366 ( 4.120 0.000 3.918) 5.686 18.247 ( -3.287 0.000 6.237) 7.050 18.799 ( -0.169 0.000 -2.559) 2.565 19.291 ( 47.448 0.000 -0.852) 47.456 ======================= Grid point 100 (32/260) ======================= q-point: ( 0.10 0.00 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 250 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.588 ( 12.958 0.000 15.205) 19.977 1.037 ( 12.693 0.000 27.910) 30.661 1.535 ( 22.441 0.000 34.889) 41.483 2.914 ( 2.227 0.000 4.852) 5.338 4.122 ( -2.804 0.000 -6.440) 7.024 4.437 ( -0.723 0.000 5.010) 5.061 4.820 ( 14.715 0.000 4.859) 15.496 4.992 ( 6.732 0.000 -4.697) 8.209 5.699 ( -4.992 0.000 9.208) 10.474 5.948 ( 0.435 0.000 0.136) 0.456 6.097 ( 2.108 0.000 5.078) 5.498 6.147 ( -1.169 0.000 6.953) 7.050 6.241 ( 0.505 0.000 -1.737) 1.809 6.947 ( -1.066 0.000 -4.256) 4.387 7.178 ( -3.482 0.000 0.014) 3.482 7.336 ( -7.681 0.000 -4.359) 8.832 7.792 ( 4.130 0.000 -9.792) 10.627 7.890 ( 7.089 0.000 1.421) 7.230 8.049 ( 11.833 0.000 -5.003) 12.848 8.241 ( -4.162 0.000 3.001) 5.131 8.518 ( 9.032 0.000 6.902) 11.368 9.002 ( 5.666 0.000 0.734) 5.714 9.079 ( -1.330 0.000 1.448) 1.966 9.690 ( -10.638 0.000 1.529) 10.747 10.045 ( -4.830 0.000 -1.703) 5.122 10.238 ( -2.750 0.000 -7.373) 7.869 10.262 ( -36.499 0.000 26.361) 45.023 10.455 ( 2.574 0.000 -4.642) 5.308 10.858 ( -13.542 0.000 6.084) 14.846 11.077 ( -8.592 0.000 1.478) 8.719 11.239 ( -8.493 0.000 -2.580) 8.876 11.810 ( -6.363 0.000 1.289) 6.492 11.913 ( 4.440 0.000 -0.533) 4.472 12.198 ( -5.281 0.000 -2.409) 5.805 12.733 ( 16.945 0.000 -7.523) 18.540 12.877 ( 10.267 0.000 3.471) 10.838 13.341 ( -4.644 0.000 -12.030) 12.895 13.556 ( -1.563 0.000 3.827) 4.133 13.828 ( 28.120 0.000 -5.207) 28.598 14.997 ( -1.895 0.000 -6.125) 6.412 15.142 ( -19.767 0.000 -2.039) 19.872 15.564 ( 3.586 0.000 4.742) 5.945 15.949 ( 7.489 0.000 5.393) 9.228 16.109 ( -0.696 0.000 -1.997) 2.115 17.453 ( 0.745 0.000 8.340) 8.373 18.209 ( -4.049 0.000 4.264) 5.880 18.777 ( -0.116 0.000 -4.066) 4.067 19.562 ( -1.490 0.000 1.134) 1.873 ======================= Grid point 101 (33/260) ======================= q-point: ( 0.20 0.00 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 250 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.011 ( 20.795 0.000 8.671) 22.530 1.394 ( 7.476 0.000 26.741) 27.767 2.193 ( 25.990 0.000 17.277) 31.209 2.975 ( 0.701 0.000 4.233) 4.291 4.020 ( -3.682 0.000 -5.145) 6.327 4.427 ( -3.229 0.000 4.253) 5.340 5.081 ( 7.915 0.000 12.017) 14.389 5.116 ( 8.699 0.000 -3.961) 9.558 5.611 ( -10.079 0.000 11.509) 15.298 5.973 ( 1.638 0.000 1.162) 2.008 6.188 ( 4.593 0.000 3.613) 5.843 6.222 ( 5.690 0.000 0.873) 5.757 6.280 ( 3.619 0.000 -0.387) 3.639 6.886 ( -2.697 0.000 -4.694) 5.413 7.106 ( -4.104 0.000 1.096) 4.248 7.155 ( -7.976 0.000 -3.432) 8.683 7.748 ( -3.223 0.000 -4.588) 5.607 8.032 ( 7.409 0.000 -0.668) 7.439 8.157 ( 0.569 0.000 -1.202) 1.330 8.209 ( 2.318 0.000 -2.436) 3.363 8.750 ( 8.941 0.000 8.499) 12.336 9.072 ( 0.051 0.000 -0.029) 0.059 9.089 ( 1.905 0.000 1.446) 2.392 9.431 ( -18.161 0.000 13.039) 22.358 9.965 ( -2.850 0.000 1.764) 3.352 9.991 ( -9.726 0.000 13.400) 16.558 10.115 ( -3.170 0.000 -9.554) 10.066 10.470 ( 0.857 0.000 -4.096) 4.185 10.684 ( -8.147 0.000 2.479) 8.516 10.909 ( -8.266 0.000 0.994) 8.326 10.982 ( -12.997 0.000 -9.322) 15.994 11.756 ( -1.982 0.000 2.332) 3.061 11.966 ( -3.587 0.000 8.483) 9.210 12.074 ( -1.131 0.000 -11.280) 11.337 12.957 ( 8.843 0.000 1.907) 9.046 13.109 ( 3.303 0.000 -10.312) 10.828 13.209 ( 6.260 0.000 3.630) 7.236 13.524 ( -2.808 0.000 3.389) 4.401 14.321 ( 25.428 0.000 -11.708) 27.994 14.856 ( -7.660 0.000 -4.261) 8.766 14.886 ( -5.136 0.000 -8.610) 10.026 15.696 ( 6.094 0.000 6.761) 9.102 16.096 ( 3.867 0.000 4.741) 6.118 16.097 ( 1.651 0.000 -4.576) 4.864 17.487 ( -3.885 0.000 11.360) 12.006 18.152 ( -3.320 0.000 1.356) 3.586 18.747 ( 0.485 0.000 -6.218) 6.237 19.515 ( -4.223 0.000 5.235) 6.726 ======================= Grid point 102 (34/260) ======================= q-point: ( 0.30 0.00 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 250 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.445 ( 18.420 0.000 7.099) 19.741 1.657 ( 3.969 0.000 21.965) 22.321 2.689 ( 16.897 0.000 7.119) 18.335 2.979 ( -2.706 0.000 2.729) 3.843 3.926 ( -3.216 0.000 -3.094) 4.463 4.372 ( -4.380 0.000 2.220) 4.911 5.264 ( 3.613 0.000 9.019) 9.716 5.266 ( 9.147 0.000 -4.166) 10.051 5.481 ( -10.034 0.000 10.543) 14.554 6.023 ( 2.244 0.000 3.127) 3.849 6.310 ( 6.181 0.000 0.407) 6.195 6.340 ( 6.422 0.000 -4.208) 7.678 6.382 ( 6.342 0.000 3.832) 7.410 6.763 ( -7.014 0.000 -5.476) 8.899 7.016 ( -4.434 0.000 -1.448) 4.665 7.046 ( -3.460 0.000 4.253) 5.483 7.635 ( -5.682 0.000 -2.518) 6.215 8.139 ( -1.479 0.000 1.775) 2.310 8.168 ( 7.742 0.000 -2.698) 8.198 8.241 ( 2.854 0.000 -6.479) 7.080 8.881 ( -1.763 0.000 2.769) 3.283 9.075 ( 0.502 0.000 -0.894) 1.025 9.125 ( 2.749 0.000 2.235) 3.543 9.194 ( -14.411 0.000 11.484) 18.427 9.926 ( -5.630 0.000 8.692) 10.356 9.927 ( -2.564 0.000 -1.248) 2.851 10.049 ( 0.985 0.000 -3.390) 3.530 10.448 ( -0.055 0.000 -1.614) 1.615 10.567 ( -5.502 0.000 2.226) 5.935 10.693 ( -9.337 0.000 -8.891) 12.893 10.810 ( -2.608 0.000 1.386) 2.953 11.727 ( -2.648 0.000 2.242) 3.469 11.832 ( -9.195 0.000 -2.775) 9.604 12.055 ( 0.380 0.000 -1.539) 1.585 12.977 ( -2.921 0.000 -9.363) 9.808 13.102 ( 4.136 0.000 4.571) 6.164 13.496 ( -1.936 0.000 2.302) 3.008 13.534 ( 16.278 0.000 7.094) 17.757 14.561 ( 2.769 0.000 -2.728) 3.887 14.697 ( -8.373 0.000 -9.312) 12.523 14.883 ( 16.170 0.000 -9.389) 18.698 15.851 ( 4.672 0.000 5.918) 7.540 16.127 ( 5.180 0.000 -4.922) 7.145 16.149 ( -1.519 0.000 5.072) 5.294 17.437 ( -8.419 0.000 10.566) 13.510 18.109 ( -1.335 0.000 -0.050) 1.336 18.721 ( 1.654 0.000 -9.006) 9.157 19.469 ( -3.600 0.000 3.602) 5.093 ======================= Grid point 103 (35/260) ======================= q-point: ( 0.40 0.00 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 250 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.778 ( 10.822 0.000 6.794) 12.778 1.814 ( -0.830 0.000 18.341) 18.360 2.915 ( -4.416 0.000 0.829) 4.493 2.924 ( 5.591 0.000 -0.485) 5.612 3.868 ( -1.321 0.000 -0.780) 1.534 4.298 ( -3.689 0.000 -0.080) 3.690 5.311 ( -1.794 0.000 -2.708) 3.248 5.365 ( -7.987 0.000 10.803) 13.435 5.402 ( 7.247 0.000 -4.575) 8.570 6.090 ( 1.455 0.000 3.833) 4.100 6.403 ( 3.934 0.000 -4.426) 5.922 6.438 ( 5.624 0.000 -0.984) 5.709 6.511 ( 3.999 0.000 1.206) 4.177 6.591 ( -5.586 0.000 -3.769) 6.738 6.959 ( -1.632 0.000 0.607) 1.741 7.033 ( -2.117 0.000 8.339) 8.604 7.522 ( -3.673 0.000 -2.245) 4.304 8.120 ( -1.630 0.000 0.756) 1.797 8.234 ( 1.229 0.000 -8.474) 8.562 8.297 ( 7.934 0.000 -4.632) 9.188 8.760 ( -8.677 0.000 -1.292) 8.773 9.022 ( -9.051 0.000 7.152) 11.535 9.080 ( 0.603 0.000 -0.692) 0.918 9.170 ( 0.472 0.000 -5.251) 5.272 9.850 ( -6.725 0.000 5.705) 8.819 9.879 ( -1.787 0.000 0.458) 1.845 10.062 ( 1.894 0.000 -1.143) 2.212 10.480 ( 1.904 0.000 3.944) 4.379 10.493 ( -3.598 0.000 1.829) 4.037 10.584 ( 1.372 0.000 1.097) 1.756 10.806 ( 0.632 0.000 1.019) 1.199 11.634 ( -6.356 0.000 -9.729) 11.621 11.688 ( -2.449 0.000 1.674) 2.967 12.052 ( -0.812 0.000 4.847) 4.914 12.917 ( 1.078 0.000 -5.062) 5.176 13.172 ( 0.136 0.000 4.461) 4.463 13.481 ( -1.149 0.000 2.862) 3.084 13.852 ( 10.563 0.000 4.532) 11.494 14.489 ( -5.939 0.000 -6.043) 8.473 14.554 ( -0.368 0.000 -0.897) 0.970 15.186 ( 18.002 0.000 -7.093) 19.349 15.912 ( 0.037 0.000 -0.496) 0.497 16.110 ( -5.765 0.000 6.240) 8.495 16.247 ( 7.824 0.000 0.834) 7.869 17.304 ( -10.111 0.000 5.729) 11.621 18.102 ( 0.202 0.000 0.863) 0.886 18.697 ( 2.545 0.000 -12.046) 12.312 19.414 ( -3.591 0.000 0.522) 3.629 ======================= Grid point 104 (36/260) ======================= q-point: (-0.50 0.00 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 250 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.847 ( -7.007 0.000 15.961) 17.432 1.918 ( -1.170 0.000 7.064) 7.160 2.849 ( -1.805 0.000 -1.025) 2.076 2.914 ( -3.857 0.000 -6.566) 7.615 3.872 ( 1.590 0.000 1.265) 2.032 4.240 ( -1.404 0.000 -2.030) 2.468 5.162 ( -7.560 0.000 -10.908) 13.271 5.310 ( -4.984 0.000 7.492) 8.998 5.464 ( 1.497 0.000 -4.848) 5.074 6.067 ( -4.614 0.000 -0.914) 4.704 6.435 ( 3.601 0.000 -4.275) 5.590 6.496 ( -2.348 0.000 -1.998) 3.083 6.552 ( 1.937 0.000 -0.010) 1.937 6.561 ( 3.448 0.000 1.807) 3.893 6.952 ( 0.186 0.000 1.652) 1.662 7.042 ( -3.586 0.000 10.228) 10.839 7.490 ( 1.867 0.000 -1.694) 2.521 8.082 ( -2.060 0.000 -1.341) 2.458 8.187 ( 0.206 0.000 -10.201) 10.204 8.396 ( 3.997 0.000 -5.711) 6.971 8.594 ( -4.796 0.000 -4.302) 6.442 8.950 ( -2.366 0.000 5.620) 6.098 9.068 ( -4.211 0.000 -12.684) 13.365 9.091 ( 0.661 0.000 0.035) 0.661 9.781 ( -2.302 0.000 3.508) 4.196 9.845 ( -1.653 0.000 -1.284) 2.093 10.129 ( 3.716 0.000 2.947) 4.743 10.464 ( -0.594 0.000 1.929) 2.018 10.534 ( 0.581 0.000 5.968) 5.996 10.724 ( 7.685 0.000 11.881) 14.150 10.810 ( -1.457 0.000 0.589) 1.572 11.508 ( 0.607 0.000 -10.867) 10.884 11.662 ( -0.976 0.000 0.952) 1.364 12.113 ( 3.006 0.000 8.016) 8.561 12.937 ( 3.183 0.000 -2.931) 4.327 13.158 ( -3.955 0.000 2.689) 4.782 13.493 ( 0.198 0.000 4.192) 4.197 13.872 ( -7.732 0.000 -4.897) 9.152 14.521 ( 9.226 0.000 5.059) 10.522 14.548 ( 0.279 0.000 -0.784) 0.832 15.455 ( 12.789 0.000 -2.733) 13.078 15.866 ( -2.906 0.000 -4.466) 5.328 16.023 ( -7.064 0.000 7.342) 10.188 16.395 ( 4.535 0.000 5.810) 7.370 17.143 ( -7.442 0.000 -0.832) 7.488 18.123 ( 0.898 0.000 2.323) 2.490 18.666 ( 2.897 0.000 -14.931) 15.209 19.334 ( -4.019 0.000 -2.928) 4.972 ======================= Grid point 105 (37/260) ======================= q-point: (-0.40 0.00 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 250 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.734 ( -14.393 0.000 13.888) 20.001 1.826 ( -12.704 0.000 8.369) 15.213 2.707 ( -12.448 0.000 -9.497) 15.657 2.835 ( 0.992 0.000 -2.488) 2.679 3.939 ( 3.965 0.000 2.092) 4.483 4.222 ( 1.163 0.000 -3.188) 3.394 4.904 ( -10.199 0.000 -16.205) 19.147 5.266 ( -2.961 0.000 3.988) 4.967 5.382 ( -5.879 0.000 -6.609) 8.845 5.989 ( -1.600 0.000 -0.766) 1.774 6.363 ( -7.844 0.000 -3.609) 8.635 6.412 ( -4.436 0.000 -1.592) 4.713 6.627 ( 0.476 0.000 3.223) 3.258 6.673 ( 9.165 0.000 0.510) 9.179 6.988 ( 2.708 0.000 1.299) 3.003 7.039 ( -1.843 0.000 9.320) 9.501 7.557 ( 4.975 0.000 -0.786) 5.036 8.029 ( -1.764 0.000 -4.385) 4.727 8.137 ( 1.483 0.000 -8.979) 9.101 8.310 ( -7.271 0.000 -4.192) 8.393 8.570 ( 3.355 0.000 -11.486) 11.966 8.908 ( -2.320 0.000 -12.363) 12.579 8.992 ( 2.181 0.000 6.911) 7.247 9.110 ( 1.073 0.000 1.908) 2.189 9.802 ( -0.918 0.000 -4.078) 4.180 9.815 ( 2.846 0.000 4.043) 4.944 10.203 ( 2.085 0.000 2.386) 3.169 10.491 ( 2.129 0.000 1.732) 2.745 10.600 ( 1.964 0.000 7.952) 8.191 10.771 ( -1.627 0.000 0.110) 1.630 10.985 ( 9.275 0.000 16.703) 19.105 11.513 ( 5.298 0.000 -8.631) 10.128 11.662 ( 0.600 0.000 0.208) 0.635 12.235 ( 3.704 0.000 6.434) 7.424 13.005 ( 6.022 0.000 -2.661) 6.583 13.053 ( -7.708 0.000 0.156) 7.710 13.538 ( 1.208 0.000 5.246) 5.383 13.631 ( -12.182 0.000 -3.938) 12.803 14.557 ( 1.443 0.000 -1.119) 1.825 14.777 ( 11.234 0.000 7.475) 13.494 15.643 ( 5.884 0.000 6.601) 8.843 15.751 ( -5.582 0.000 -5.949) 8.158 15.946 ( -5.081 0.000 5.582) 7.548 16.466 ( -2.602 0.000 9.409) 9.763 17.039 ( -0.249 0.000 -6.711) 6.716 18.161 ( 1.060 0.000 3.572) 3.726 18.622 ( 3.049 0.000 -17.935) 18.192 19.221 ( -4.684 0.000 -6.295) 7.847 ======================= Grid point 106 (38/260) ======================= q-point: (-0.30 0.00 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 250 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.472 ( -20.917 0.000 12.671) 24.455 1.564 ( -20.141 0.000 11.088) 22.992 2.306 ( -23.967 0.000 -7.317) 25.059 2.836 ( 0.583 0.000 -2.915) 2.973 4.037 ( 4.706 0.000 1.090) 4.831 4.241 ( 2.762 0.000 -3.109) 4.159 4.586 ( -11.030 0.000 -18.467) 21.510 5.201 ( -7.110 0.000 -7.710) 10.488 5.263 ( 1.755 0.000 0.282) 1.778 5.987 ( 0.448 0.000 1.578) 1.641 6.206 ( -5.586 0.000 -1.603) 5.812 6.276 ( -8.150 0.000 -0.354) 8.158 6.607 ( -4.687 0.000 4.905) 6.785 6.849 ( 7.636 0.000 0.463) 7.650 7.082 ( 6.748 0.000 0.873) 6.804 7.104 ( 2.736 0.000 6.919) 7.441 7.642 ( 4.341 0.000 -1.985) 4.773 7.946 ( -2.090 0.000 -10.855) 11.054 8.132 ( -8.048 0.000 -4.789) 9.366 8.152 ( 3.696 0.000 -2.408) 4.411 8.479 ( -3.269 0.000 -14.008) 14.384 8.864 ( 3.409 0.000 -10.028) 10.592 9.071 ( 1.547 0.000 2.671) 3.087 9.203 ( 5.261 0.000 13.159) 14.171 9.779 ( 2.179 0.000 -4.577) 5.070 9.909 ( 2.771 0.000 6.018) 6.625 10.253 ( 2.610 0.000 -0.049) 2.610 10.567 ( 4.889 0.000 1.165) 5.026 10.663 ( -1.113 0.000 5.841) 5.946 10.808 ( 5.218 0.000 2.816) 5.929 11.254 ( 7.330 0.000 15.122) 16.805 11.575 ( 5.849 0.000 -7.033) 9.147 11.688 ( 1.929 0.000 1.037) 2.190 12.300 ( 0.439 0.000 1.618) 1.677 12.872 ( -10.008 0.000 -2.700) 10.366 13.125 ( 6.451 0.000 -3.150) 7.179 13.400 ( -9.329 0.000 0.913) 9.374 13.590 ( 0.258 0.000 5.802) 5.807 14.600 ( 4.396 0.000 -2.301) 4.962 15.012 ( 8.034 0.000 6.836) 10.549 15.590 ( -6.674 0.000 -6.128) 9.060 15.805 ( 4.841 0.000 13.658) 14.491 15.886 ( -5.645 0.000 10.597) 12.007 16.418 ( -7.439 0.000 8.635) 11.397 17.053 ( 5.608 0.000 -7.286) 9.194 18.204 ( 0.624 0.000 4.729) 4.770 18.554 ( 2.754 0.000 -23.399) 23.560 19.076 ( -5.570 0.000 -8.502) 10.164 ======================= Grid point 107 (39/260) ======================= q-point: (-0.20 0.00 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 250 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.108 ( -24.656 0.000 12.386) 27.592 1.206 ( -24.870 0.000 14.643) 28.860 1.711 ( -35.255 0.000 4.424) 35.531 2.822 ( -0.387 0.000 -1.362) 1.416 4.102 ( 1.086 0.000 -4.657) 4.782 4.284 ( -7.575 0.000 -14.355) 16.231 4.285 ( 3.216 0.000 -1.580) 3.583 5.038 ( -4.511 0.000 -7.633) 8.866 5.348 ( 7.547 0.000 -2.053) 7.821 6.005 ( -0.327 0.000 2.506) 2.527 6.124 ( -7.089 0.000 0.780) 7.132 6.150 ( -0.637 0.000 3.496) 3.553 6.530 ( -6.336 0.000 5.734) 8.545 6.954 ( 3.532 0.000 -0.504) 3.568 7.196 ( 2.504 0.000 4.024) 4.739 7.256 ( 9.849 0.000 1.326) 9.938 7.697 ( 2.945 0.000 -3.888) 4.878 7.808 ( -3.524 0.000 -15.200) 15.603 7.945 ( -7.942 0.000 -5.070) 9.422 8.229 ( 3.595 0.000 2.229) 4.230 8.341 ( -2.375 0.000 -9.709) 9.995 8.857 ( 2.030 0.000 -9.408) 9.624 9.099 ( 0.659 0.000 1.068) 1.255 9.482 ( 11.624 0.000 25.569) 28.088 9.852 ( 7.921 0.000 -3.703) 8.744 9.974 ( -0.767 0.000 10.160) 10.189 10.293 ( 2.127 0.000 -3.266) 3.897 10.651 ( -2.748 0.000 3.184) 4.206 10.701 ( 8.382 0.000 1.271) 8.478 10.961 ( 7.559 0.000 3.789) 8.456 11.397 ( 0.055 0.000 4.827) 4.827 11.648 ( 5.892 0.000 -5.683) 8.186 11.785 ( 5.677 0.000 8.583) 10.291 12.292 ( -0.507 0.000 -1.855) 1.923 12.644 ( -10.854 0.000 -5.367) 12.108 13.074 ( -10.210 0.000 2.539) 10.521 13.389 ( 6.569 0.000 -3.135) 7.278 13.609 ( -2.022 0.000 5.392) 5.758 14.691 ( 6.990 0.000 -6.755) 9.721 15.146 ( 1.327 0.000 4.595) 4.782 15.454 ( -2.722 0.000 -4.422) 5.192 15.748 ( -4.727 0.000 -10.673) 11.673 16.184 ( 11.633 0.000 54.950) 56.168 16.315 ( -7.334 0.000 5.678) 9.275 17.141 ( 6.928 0.000 -4.347) 8.179 18.240 ( -0.434 0.000 5.845) 5.861 18.387 ( -3.053 0.000 -37.188) 37.314 18.918 ( -5.204 0.000 -5.962) 7.914 ======================= Grid point 108 (40/260) ======================= q-point: (-0.10 0.00 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 250 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.659 ( -28.046 0.000 7.932) 29.146 0.806 ( -26.760 0.000 18.821) 32.716 1.154 ( -30.483 0.000 37.319) 48.186 2.817 ( 0.008 0.000 1.621) 1.621 3.980 ( -1.818 0.000 -1.250) 2.206 4.213 ( 1.387 0.000 -4.100) 4.328 4.342 ( 2.744 0.000 1.003) 2.921 4.941 ( -0.760 0.000 -6.961) 7.003 5.511 ( 9.950 0.000 -1.877) 10.125 5.993 ( -2.041 0.000 0.102) 2.043 6.039 ( -2.839 0.000 4.309) 5.160 6.216 ( 3.474 0.000 4.590) 5.756 6.441 ( -6.856 0.000 5.693) 8.912 6.991 ( 1.302 0.000 -2.048) 2.426 7.232 ( -0.146 0.000 0.293) 0.327 7.444 ( 7.852 0.000 1.007) 7.916 7.571 ( -7.530 0.000 -7.034) 10.304 7.778 ( -5.874 0.000 -3.521) 6.848 7.782 ( 5.354 0.000 -5.912) 7.976 8.286 ( 1.317 0.000 -4.019) 4.230 8.293 ( 0.534 0.000 4.225) 4.259 8.848 ( 2.721 0.000 -6.336) 6.896 9.112 ( -0.240 0.000 1.203) 1.227 9.826 ( 2.805 0.000 4.959) 5.697 10.011 ( 9.690 0.000 -3.115) 10.179 10.254 ( 27.870 0.000 38.818) 47.787 10.285 ( 0.198 0.000 -6.147) 6.150 10.594 ( -4.511 0.000 0.723) 4.569 10.907 ( 12.195 0.000 4.226) 12.907 11.116 ( 5.310 0.000 3.419) 6.316 11.356 ( -3.235 0.000 0.516) 3.276 11.733 ( 6.380 0.000 -5.295) 8.291 11.956 ( 2.871 0.000 10.565) 10.948 12.278 ( 0.504 0.000 -1.919) 1.984 12.405 ( -9.375 0.000 -5.479) 10.859 12.881 ( -10.975 0.000 5.177) 12.135 13.476 ( 4.895 0.000 -8.038) 9.411 13.577 ( -3.961 0.000 2.292) 4.576 14.650 ( -9.320 0.000 -25.044) 26.722 15.121 ( -3.610 0.000 -0.049) 3.611 15.446 ( 2.043 0.000 -0.103) 2.045 15.604 ( -2.492 0.000 -4.151) 4.842 16.218 ( -5.381 0.000 3.039) 6.180 16.906 ( 9.427 0.000 10.949) 14.448 17.255 ( 6.176 0.000 -0.479) 6.195 18.035 ( 8.444 0.000 5.452) 10.051 18.257 ( -1.870 0.000 6.582) 6.843 18.828 ( -1.736 0.000 -2.190) 2.795 ======================= Grid point 109 (41/260) ======================= q-point: ( 0.00 0.12 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 400 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.740 ( 19.952 23.056 13.664) 33.412 0.833 ( -3.427 18.523 22.547) 29.381 1.359 ( -12.433 26.207 36.632) 46.726 2.782 ( 1.892 -6.805 4.669) 8.467 4.182 ( 4.921 -2.636 -3.496) 6.587 4.230 ( 11.348 -1.316 9.013) 14.552 4.435 ( 1.286 3.023 4.175) 5.312 4.882 ( 2.726 -3.857 -2.732) 5.456 5.638 ( 4.599 -2.721 1.450) 5.537 5.970 ( -0.142 0.690 2.632) 2.725 6.061 ( -1.282 -0.030 2.119) 2.477 6.297 ( -1.911 2.375 -0.433) 3.079 6.324 ( -4.509 3.531 2.562) 6.274 7.056 ( -2.870 -1.046 -7.458) 8.060 7.243 ( -3.324 -1.982 -3.623) 5.301 7.482 ( 7.079 -12.259 1.911) 14.285 7.638 ( -5.631 10.845 -5.876) 13.560 7.790 ( 13.845 11.662 -14.382) 23.121 8.108 ( 9.484 12.561 0.343) 15.743 8.170 ( -1.589 -1.827 4.031) 4.703 8.561 ( 1.430 12.451 1.372) 12.608 8.898 ( 5.149 0.732 -2.382) 5.721 9.101 ( -0.729 -0.074 0.749) 1.048 9.771 ( -2.803 -2.308 -0.119) 3.633 10.111 ( 1.755 -1.087 -2.686) 3.388 10.154 ( -1.150 -8.476 5.326) 10.076 10.371 ( -6.961 -4.734 1.233) 8.508 10.742 ( -2.019 -3.538 -7.473) 8.511 11.035 ( -0.021 -6.245 1.884) 6.523 11.174 ( -4.290 -2.086 4.414) 6.500 11.353 ( 0.300 -2.520 5.785) 6.317 11.938 ( -4.799 -0.261 2.688) 5.507 12.110 ( 8.539 8.967 -14.254) 18.881 12.136 ( 4.593 -9.330 -3.276) 10.903 12.382 ( 1.467 1.506 0.120) 2.106 12.934 ( 7.943 14.380 -1.545) 16.501 13.197 ( -13.305 -10.872 -3.916) 17.622 13.574 ( -1.543 4.332 -1.014) 4.710 13.863 ( -21.212 2.853 12.005) 24.540 14.965 ( -1.846 -8.599 -2.642) 9.183 15.097 ( -10.972 -17.868 11.423) 23.877 15.643 ( 3.696 1.169 2.299) 4.507 16.058 ( 0.683 1.452 -7.526) 7.695 16.372 ( -22.218 14.654 -11.008) 28.802 17.365 ( 5.407 -0.345 4.793) 7.234 17.729 ( 13.200 -22.781 31.049) 40.710 18.837 ( 2.471 2.445 -1.215) 3.682 19.574 ( 11.579 11.174 -13.929) 21.283 ======================= Grid point 110 (42/260) ======================= q-point: ( 0.10 0.12 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 400 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.950 ( 7.900 25.856 8.791) 28.429 1.211 ( 10.341 15.690 22.597) 29.390 1.657 ( 19.694 13.462 31.575) 39.574 2.859 ( 2.459 -5.785 5.391) 8.281 4.127 ( -2.019 0.272 -7.334) 7.612 4.462 ( -0.887 1.824 5.424) 5.791 4.633 ( 14.653 -9.581 14.097) 22.477 4.954 ( 6.134 -3.443 -1.850) 7.273 5.670 ( -4.237 -2.202 6.563) 8.116 6.005 ( 2.166 -0.289 2.312) 3.181 6.069 ( 1.341 -2.536 1.840) 3.408 6.242 ( -3.104 6.177 -1.375) 7.048 6.290 ( 1.113 6.015 1.787) 6.373 6.965 ( -2.142 -0.619 -5.412) 5.853 7.142 ( -4.077 -3.505 -3.633) 6.489 7.471 ( -6.149 7.931 -6.304) 11.852 7.637 ( 4.852 -9.586 1.797) 10.894 7.963 ( 12.018 11.494 -13.179) 21.219 8.141 ( -2.598 0.914 4.327) 5.129 8.280 ( 4.957 6.619 2.536) 8.650 8.621 ( 3.790 8.519 5.370) 10.760 8.992 ( 4.154 -0.895 0.959) 4.356 9.098 ( 0.792 1.366 -0.086) 1.581 9.655 ( -11.188 -0.860 2.705) 11.542 9.991 ( -8.726 -3.135 7.258) 11.775 10.193 ( -7.849 -2.909 7.722) 11.388 10.212 ( -2.979 -2.642 -7.923) 8.867 10.544 ( -7.798 0.691 -7.212) 10.644 10.886 ( -11.917 1.639 5.884) 13.391 11.067 ( -7.848 -1.000 1.057) 7.982 11.306 ( -8.555 5.383 1.231) 10.182 11.789 ( -6.271 -1.722 1.193) 6.611 11.971 ( -0.498 5.490 -2.882) 6.220 12.194 ( -6.626 -0.251 -1.221) 6.743 12.535 ( 14.527 -13.014 -3.425) 19.802 13.033 ( 2.538 5.106 4.008) 6.969 13.277 ( 9.662 -0.961 -19.144) 21.466 13.575 ( -0.378 2.216 4.552) 5.077 13.884 ( 18.789 5.011 0.937) 19.468 14.881 ( -10.158 -12.436 -0.277) 16.059 14.942 ( -2.686 -9.895 -2.506) 10.555 15.726 ( 2.395 6.801 1.841) 7.442 16.049 ( 4.046 7.158 -4.718) 9.480 16.120 ( -4.815 3.269 0.937) 5.895 17.459 ( 0.558 0.520 8.314) 8.349 17.999 ( 2.281 -14.935 13.660) 20.368 18.863 ( 1.042 6.126 -4.005) 7.393 19.559 ( -3.646 -0.174 -2.608) 4.486 ======================= Grid point 111 (43/260) ======================= q-point: ( 0.20 0.12 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 400 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.233 ( 15.997 18.937 5.402) 25.371 1.501 ( 5.597 10.098 24.339) 26.939 2.264 ( 23.900 7.443 16.909) 30.208 2.928 ( 0.926 -4.799 4.996) 6.989 4.036 ( -2.889 1.330 -5.985) 6.777 4.449 ( -3.510 1.790 4.604) 6.060 4.940 ( 8.448 -10.008 11.688) 17.554 5.098 ( 8.984 -2.523 1.371) 9.432 5.582 ( -8.928 -0.752 9.316) 12.925 6.066 ( 2.631 0.656 -2.105) 3.432 6.134 ( 3.512 -2.723 2.936) 5.326 6.210 ( 1.248 0.214 1.089) 1.670 6.353 ( 4.077 6.644 -0.045) 7.795 6.894 ( -2.452 0.375 -4.648) 5.268 7.052 ( -2.892 -1.698 -2.690) 4.299 7.325 ( -5.268 10.012 -3.862) 11.954 7.683 ( -0.582 -5.375 -0.693) 5.451 8.068 ( 3.610 8.061 -1.102) 8.901 8.145 ( 3.275 -0.703 -3.780) 5.051 8.327 ( -0.407 7.587 1.750) 7.797 8.780 ( 6.797 2.886 8.227) 11.055 9.034 ( 0.367 -2.429 0.072) 2.457 9.138 ( 1.811 2.449 0.763) 3.140 9.415 ( -15.667 1.430 10.161) 18.728 9.925 ( -3.733 -2.397 7.188) 8.447 10.044 ( -7.253 1.668 0.896) 7.496 10.105 ( -4.186 -1.191 -5.728) 7.194 10.422 ( -2.807 -3.900 -6.747) 8.283 10.731 ( -7.978 2.528 3.048) 8.906 10.910 ( -7.144 0.185 0.110) 7.148 11.075 ( -11.743 8.685 -4.588) 15.309 11.754 ( -1.678 -0.103 2.778) 3.247 11.952 ( -3.941 -0.837 6.862) 7.958 12.062 ( -2.530 -1.106 -10.314) 10.677 12.752 ( 8.454 -14.216 -1.186) 16.582 13.133 ( 3.705 -7.209 1.411) 8.227 13.255 ( 2.625 8.922 -7.594) 12.007 13.587 ( 0.050 5.414 3.686) 6.550 14.339 ( 25.615 1.876 -9.360) 27.336 14.684 ( -7.551 -11.489 -1.816) 13.868 14.883 ( -1.265 -3.629 -7.270) 8.223 15.795 ( 3.397 7.752 4.800) 9.730 16.078 ( -0.080 -1.128 -1.939) 2.245 16.131 ( 4.024 2.776 0.773) 4.950 17.486 ( -4.240 -0.097 11.144) 11.924 18.059 ( -0.944 -7.704 5.412) 9.462 18.825 ( -0.657 6.757 -7.451) 10.080 19.493 ( -3.302 -1.996 3.718) 5.359 ======================= Grid point 112 (44/260) ======================= q-point: ( 0.30 0.12 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 400 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.581 ( 15.852 12.360 2.972) 20.320 1.728 ( 3.312 6.709 21.450) 22.718 2.715 ( 13.804 2.499 7.457) 15.887 2.950 ( -1.072 -2.666 3.848) 4.802 3.951 ( -2.532 2.306 -3.867) 5.165 4.391 ( -4.605 1.683 2.689) 5.591 5.123 ( 6.024 -10.040 4.953) 12.713 5.278 ( 6.336 -1.667 4.033) 7.693 5.470 ( -8.206 -0.299 8.741) 11.993 6.063 ( 0.690 1.717 -4.826) 5.168 6.224 ( 3.395 -3.839 2.943) 5.910 6.311 ( 6.377 -6.262 1.661) 9.091 6.430 ( 3.456 4.996 0.378) 6.086 6.808 ( -2.427 4.299 -5.737) 7.569 7.005 ( -1.056 3.429 -0.637) 3.644 7.236 ( -2.465 10.996 0.086) 11.269 7.619 ( -4.812 -0.642 -0.661) 4.899 8.115 ( 0.679 1.333 3.353) 3.672 8.199 ( 5.525 1.753 -7.255) 9.286 8.319 ( -0.317 6.093 -0.809) 6.154 8.871 ( -3.521 -0.778 2.787) 4.557 9.067 ( 3.297 -1.104 1.450) 3.767 9.144 ( -1.092 1.221 0.783) 1.816 9.212 ( -10.904 3.140 7.555) 13.632 9.884 ( -5.559 -3.641 6.472) 9.276 9.931 ( -4.385 -0.064 -1.645) 4.684 10.048 ( 0.884 -0.528 -1.886) 2.149 10.316 ( -3.697 -6.857 -4.466) 8.979 10.587 ( -7.748 -0.693 0.858) 7.826 10.837 ( -1.078 3.073 0.475) 3.291 10.880 ( -4.772 13.490 -2.493) 14.524 11.699 ( -5.352 -1.768 1.629) 5.867 11.867 ( -6.003 2.674 -3.398) 7.398 12.001 ( -0.510 -4.857 -0.363) 4.897 12.835 ( 2.611 -10.338 -3.412) 11.195 13.158 ( 1.780 -1.210 -2.652) 3.416 13.344 ( 3.644 -5.003 4.259) 7.514 13.658 ( 5.356 5.525 4.673) 9.002 14.509 ( -3.219 -5.908 -3.742) 7.699 14.697 ( 4.057 1.866 -5.966) 7.453 14.888 ( 14.200 -0.297 -9.147) 16.894 15.893 ( 1.986 3.521 4.946) 6.388 16.098 ( 3.697 -1.559 -0.818) 4.095 16.182 ( 0.552 2.177 1.407) 2.651 17.428 ( -8.574 -0.788 10.138) 13.301 18.060 ( -0.805 -4.460 1.563) 4.794 18.769 ( 0.501 4.464 -9.157) 10.199 19.462 ( -2.576 -0.651 3.040) 4.038 ======================= Grid point 113 (45/260) ======================= q-point: ( 0.40 0.12 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 400 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.792 ( 2.190 3.671 6.751) 7.990 1.938 ( 6.914 9.282 13.691) 17.927 2.834 ( -2.260 -4.061 0.849) 4.724 2.986 ( 2.206 2.226 0.508) 3.175 3.901 ( -0.747 3.157 -1.302) 3.495 4.316 ( -3.864 1.690 0.529) 4.251 5.223 ( 1.192 -7.122 0.085) 7.221 5.361 ( -4.052 0.181 8.861) 9.745 5.384 ( 0.360 -3.622 -2.819) 4.604 6.077 ( 3.545 -2.819 -2.030) 4.963 6.267 ( -1.129 -4.181 0.147) 4.333 6.407 ( 2.038 -5.670 0.259) 6.031 6.487 ( 2.964 1.091 0.207) 3.165 6.775 ( 2.623 10.725 -4.784) 12.033 6.990 ( -0.484 5.764 -0.343) 5.794 7.226 ( -1.291 13.520 6.329) 14.984 7.527 ( -3.168 0.914 -1.273) 3.535 8.126 ( -1.112 0.485 1.181) 1.693 8.238 ( 1.989 1.366 -8.204) 8.552 8.332 ( 3.753 3.112 -2.405) 5.436 8.743 ( -8.382 -1.387 -0.472) 8.509 9.043 ( -7.322 1.468 3.663) 8.317 9.101 ( 0.177 1.554 -1.438) 2.124 9.163 ( -0.101 -0.124 -4.143) 4.146 9.792 ( -7.352 -4.448 5.392) 10.145 9.877 ( -0.574 -0.855 0.716) 1.254 10.064 ( 1.278 -0.297 -0.659) 1.468 10.273 ( 0.461 -8.802 2.210) 9.087 10.476 ( -4.010 -1.783 0.970) 4.494 10.837 ( 0.157 4.966 -0.455) 4.989 10.869 ( 2.302 13.832 4.156) 14.625 11.594 ( -4.535 -2.401 -2.753) 5.823 11.718 ( -4.337 1.389 -8.668) 9.791 12.019 ( -0.217 -2.398 8.698) 9.025 12.855 ( 2.284 -5.930 -3.784) 7.396 13.180 ( 0.674 -0.953 0.730) 1.377 13.394 ( -0.394 -6.986 3.761) 7.944 13.815 ( 5.174 -2.557 4.636) 7.403 14.425 ( -1.812 -4.490 -2.983) 5.687 14.662 ( -0.614 7.979 -2.802) 8.479 15.193 ( 18.287 0.504 -6.967) 19.576 15.902 ( -1.879 -1.001 -0.678) 2.234 16.135 ( -4.347 2.111 6.183) 7.847 16.247 ( 7.125 0.314 1.371) 7.263 17.292 ( -9.988 -1.083 5.260) 11.340 18.055 ( -0.295 -4.220 0.427) 4.252 18.735 ( 2.242 3.560 -10.279) 11.106 19.419 ( -2.972 0.552 0.060) 3.023 ======================= Grid point 114 (46/260) ======================= q-point: (-0.50 0.12 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 400 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.794 ( -6.247 -0.222 7.675) 9.898 2.084 ( -0.759 10.684 10.642) 15.098 2.766 ( -3.015 -5.309 -2.760) 6.701 2.953 ( -4.073 1.433 -5.004) 6.610 3.911 ( 1.901 3.669 0.782) 4.205 4.259 ( -1.554 1.821 -1.305) 2.727 5.128 ( -7.004 -3.369 -10.395) 12.980 5.275 ( -6.964 -2.648 5.870) 9.485 5.435 ( 2.838 -3.476 -1.242) 4.656 6.129 ( -1.251 5.131 -2.007) 5.650 6.233 ( 3.097 -11.416 0.195) 11.830 6.413 ( -1.582 -4.374 0.188) 4.655 6.521 ( -0.648 -0.255 -0.674) 0.970 6.814 ( 3.752 11.312 -3.159) 12.329 6.983 ( 0.405 5.278 -0.681) 5.337 7.230 ( -4.033 14.786 9.537) 18.051 7.512 ( 2.537 1.964 -1.134) 3.403 8.093 ( -2.005 0.144 -1.003) 2.246 8.185 ( -0.943 1.437 -9.692) 9.843 8.399 ( 3.152 0.593 -3.625) 4.841 8.599 ( -3.537 0.389 -3.948) 5.315 8.973 ( -1.701 1.681 3.074) 3.894 9.048 ( -3.821 -1.563 -11.328) 12.056 9.120 ( 0.430 2.468 -0.843) 2.643 9.717 ( -2.303 -4.081 2.964) 5.544 9.878 ( -0.745 1.249 1.259) 1.923 10.111 ( 3.130 -1.808 2.004) 4.133 10.350 ( 3.843 -9.639 7.695) 12.918 10.443 ( -0.537 -2.071 1.941) 2.889 10.821 ( -1.481 3.157 -0.280) 3.498 10.966 ( 3.008 12.805 7.735) 15.259 11.522 ( 1.517 1.319 -8.734) 8.962 11.625 ( -1.604 -3.308 -2.595) 4.500 12.106 ( 2.753 -0.328 10.556) 10.914 12.871 ( 1.380 -6.273 -3.665) 7.395 13.186 ( -0.497 1.739 1.133) 2.134 13.398 ( -1.398 -8.202 4.078) 9.266 13.831 ( -4.525 -2.951 -0.284) 5.410 14.447 ( 3.467 -4.657 1.554) 6.010 14.681 ( 3.789 9.300 0.916) 10.084 15.466 ( 12.989 0.737 -3.107) 13.376 15.829 ( -4.359 -2.995 -2.884) 6.024 16.062 ( -6.361 2.963 5.552) 8.948 16.391 ( 4.202 -0.311 6.365) 7.633 17.133 ( -7.048 -0.853 -1.240) 7.207 18.049 ( -0.435 -6.288 -0.574) 6.329 18.727 ( 3.733 5.262 -10.557) 12.373 19.345 ( -3.696 1.073 -3.453) 5.170 ======================= Grid point 115 (47/260) ======================= q-point: (-0.40 0.12 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 400 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.653 ( -12.994 -1.337 7.168) 14.900 2.018 ( -12.542 11.543 9.206) 19.372 2.662 ( -6.942 -4.421 -8.114) 11.557 2.822 ( -3.880 -0.621 -3.983) 5.596 3.976 ( 3.913 3.449 1.185) 5.349 4.243 ( 1.016 2.014 -2.350) 3.258 4.869 ( -10.611 -3.776 -15.502) 19.162 5.172 ( -6.116 -4.242 1.430) 7.579 5.442 ( -1.526 1.153 -0.944) 2.133 6.070 ( -0.693 7.444 -2.558) 7.902 6.295 ( -3.899 -6.454 -1.341) 7.659 6.370 ( 0.156 -4.146 -0.419) 4.170 6.460 ( -3.617 -4.630 3.399) 6.788 6.888 ( 4.956 9.999 -1.027) 11.207 7.011 ( 3.120 3.381 -0.349) 4.614 7.203 ( -3.180 13.724 7.110) 15.780 7.585 ( 4.431 2.252 0.567) 5.003 8.048 ( -1.883 -0.503 -1.575) 2.506 8.091 ( -2.075 -0.127 -11.198) 11.389 8.362 ( -2.721 4.178 -3.788) 6.262 8.582 ( 3.288 1.099 -10.197) 10.770 8.895 ( -2.312 -1.123 -11.852) 12.127 9.004 ( 1.749 0.845 4.260) 4.682 9.149 ( 2.185 3.789 2.481) 5.029 9.738 ( 2.413 -3.553 1.259) 4.476 9.870 ( 0.073 2.557 -0.169) 2.564 10.179 ( 2.287 -2.386 2.198) 3.969 10.470 ( 3.096 -2.071 1.140) 3.896 10.503 ( 4.836 -7.050 10.482) 13.526 10.792 ( -0.904 2.132 0.015) 2.316 11.083 ( 4.052 7.205 9.486) 12.582 11.533 ( 4.288 0.121 -9.412) 10.344 11.622 ( 1.714 -2.311 1.737) 3.361 12.226 ( 2.697 -0.844 7.582) 8.092 12.849 ( -1.574 -9.629 -3.785) 10.465 13.192 ( 1.203 7.628 0.431) 7.735 13.384 ( -3.300 -9.893 4.073) 11.196 13.719 ( -5.268 3.856 0.685) 6.564 14.505 ( 1.896 -5.113 -0.060) 5.453 14.822 ( 7.639 4.667 5.609) 10.564 15.636 ( 0.240 -1.700 8.007) 8.189 15.718 ( -0.491 -1.758 -7.561) 7.778 15.975 ( -5.720 2.225 4.563) 7.648 16.462 ( -2.202 -0.282 9.410) 9.669 17.037 ( 0.206 -0.123 -6.693) 6.698 18.022 ( -1.577 -10.387 -2.996) 10.925 18.753 ( 5.590 9.820 -9.426) 14.715 19.234 ( -4.460 1.199 -6.856) 8.267 ======================= Grid point 116 (48/260) ======================= q-point: (-0.30 0.12 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 400 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.398 ( -18.093 0.077 8.985) 20.202 1.724 ( -21.928 8.037 3.640) 23.637 2.370 ( -18.280 6.139 -3.414) 19.583 2.776 ( -0.111 -5.469 -3.124) 6.299 4.063 ( 4.539 2.488 -0.373) 5.190 4.265 ( 2.565 2.215 -2.153) 4.015 4.553 ( -11.222 -3.094 -16.615) 20.287 5.061 ( -4.929 -5.612 -2.305) 7.817 5.393 ( -1.323 4.752 -2.070) 5.349 6.076 ( 1.584 6.332 -1.162) 6.630 6.161 ( -5.847 -2.831 -0.699) 6.534 6.289 ( -6.474 1.738 0.129) 6.704 6.486 ( -0.410 -8.166 5.321) 9.755 6.976 ( 4.084 7.586 0.939) 8.666 7.095 ( 4.293 0.316 2.367) 4.913 7.229 ( 3.625 12.282 1.699) 12.918 7.672 ( 4.099 1.844 0.633) 4.539 7.959 ( -4.579 -4.033 -10.440) 12.093 7.996 ( -1.825 1.034 -4.322) 4.804 8.302 ( -0.741 7.441 -5.589) 9.336 8.521 ( -1.064 4.040 -10.955) 11.725 8.852 ( 3.142 -0.848 -9.357) 9.907 9.057 ( 1.190 -0.984 2.270) 2.746 9.259 ( 5.602 5.282 10.290) 12.852 9.805 ( 5.078 0.404 -1.737) 5.382 9.897 ( 1.322 0.208 3.684) 3.920 10.235 ( 2.829 -1.878 0.151) 3.399 10.555 ( 5.330 -0.855 0.814) 5.459 10.647 ( 2.330 -2.268 8.284) 8.899 10.813 ( 3.775 0.779 1.143) 4.021 11.241 ( 5.733 -0.510 9.212) 10.862 11.543 ( 2.527 -4.323 -8.373) 9.756 11.703 ( 4.552 1.945 3.490) 6.057 12.277 ( -0.232 -2.352 1.766) 2.951 12.756 ( -5.920 -8.938 -3.210) 11.191 13.225 ( -1.190 5.782 0.801) 5.958 13.337 ( -0.439 -2.200 2.215) 3.153 13.667 ( -2.196 5.166 3.970) 6.875 14.542 ( 3.239 -5.921 -2.538) 7.211 14.991 ( 4.698 -1.050 7.149) 8.619 15.506 ( -11.037 -7.180 3.225) 13.556 15.815 ( 6.018 0.554 3.429) 6.948 15.895 ( -6.087 0.524 7.286) 9.508 16.442 ( -4.690 2.226 9.564) 10.883 17.057 ( 5.733 0.536 -6.905) 8.991 17.935 ( -4.764 -16.008 -7.468) 18.295 18.834 ( 8.435 16.995 -7.348) 20.347 19.091 ( -5.006 1.466 -9.561) 10.892 ======================= Grid point 117 (49/260) ======================= q-point: (-0.20 0.12 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 400 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.097 ( -19.890 3.648 14.551) 24.913 1.233 ( -28.404 3.126 -2.932) 28.725 1.959 ( -25.265 19.430 9.543) 33.270 2.755 ( -0.532 -6.595 -1.502) 6.785 4.124 ( 1.681 2.196 -5.403) 6.069 4.247 ( -6.359 -2.011 -10.283) 12.256 4.327 ( 1.771 3.009 -1.625) 3.851 4.959 ( -3.533 -5.548 -4.035) 7.717 5.403 ( 4.234 3.528 -2.509) 6.055 6.039 ( -3.616 -1.650 -0.019) 3.975 6.137 ( -1.131 -1.121 1.542) 2.217 6.192 ( -0.945 9.283 1.673) 9.480 6.470 ( -4.299 -4.224 5.161) 7.934 7.052 ( 3.173 3.713 0.848) 4.958 7.184 ( 2.871 -0.937 3.003) 4.260 7.357 ( 9.003 9.174 -2.576) 13.109 7.753 ( 3.740 2.834 0.918) 4.781 7.784 ( -6.270 -2.639 -11.188) 13.094 7.929 ( -0.966 2.783 -7.611) 8.161 8.239 ( -1.789 4.742 -6.062) 7.902 8.484 ( 2.183 9.797 -3.877) 10.760 8.846 ( 1.796 -0.356 -8.227) 8.429 9.085 ( 0.860 -1.212 1.050) 1.820 9.491 ( 9.800 2.102 15.764) 18.680 9.933 ( 1.926 1.785 1.596) 3.073 9.948 ( 7.301 1.075 6.327) 9.721 10.283 ( 2.682 -1.028 -2.473) 3.790 10.676 ( -0.229 1.989 1.797) 2.690 10.692 ( 6.621 -0.989 2.369) 7.101 10.951 ( 7.667 -1.165 3.518) 8.515 11.370 ( 1.138 -2.492 4.022) 4.867 11.558 ( 5.936 -6.745 -6.304) 10.976 11.834 ( 5.788 3.043 6.235) 9.035 12.266 ( -0.450 -2.649 -1.137) 2.918 12.583 ( -9.355 -5.686 -4.179) 11.718 13.120 ( -8.968 4.073 4.469) 10.816 13.417 ( 6.064 3.029 -3.974) 7.858 13.649 ( -2.926 3.679 4.659) 6.619 14.591 ( 3.632 -9.812 -7.485) 12.864 15.068 ( -1.201 -5.919 6.376) 8.783 15.306 ( -12.964 -11.827 8.700) 19.587 15.768 ( -4.701 0.820 -7.252) 8.681 16.006 ( 2.706 -7.329 17.513) 19.176 16.491 ( 4.405 8.660 19.932) 22.173 17.146 ( 6.410 0.508 -4.601) 7.906 17.707 ( -13.196 -20.665 -14.246) 28.357 18.933 ( -4.987 1.370 -6.264) 8.123 18.999 ( 13.849 27.108 -9.710) 31.952 ======================= Grid point 118 (50/260) ======================= q-point: (-0.10 0.12 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 400 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.673 ( -22.430 8.401 2.436) 24.075 0.873 ( -14.967 11.687 22.641) 29.550 1.562 ( -24.893 28.736 22.789) 44.325 2.745 ( -0.227 -7.081 1.768) 7.302 4.020 ( -1.395 4.032 -1.606) 4.559 4.207 ( 2.268 -0.376 -4.760) 5.286 4.380 ( 2.460 3.272 1.826) 4.483 4.887 ( -1.007 -4.669 -3.824) 6.119 5.512 ( 7.573 0.167 -1.678) 7.759 5.983 ( -2.588 -1.159 1.787) 3.352 6.086 ( -2.881 1.267 2.005) 3.732 6.271 ( 4.726 5.045 0.326) 6.920 6.401 ( -6.061 -1.952 5.802) 8.615 7.107 ( 2.330 -0.466 -3.230) 4.010 7.240 ( 2.521 -0.557 0.701) 2.675 7.462 ( -0.039 -3.594 -4.123) 5.469 7.647 ( 5.216 12.234 -13.687) 19.084 7.772 ( -3.924 1.218 -0.721) 4.172 7.936 ( 7.856 10.330 -4.710) 13.806 8.186 ( -1.285 2.653 -0.839) 3.065 8.523 ( 2.464 12.014 -0.551) 12.277 8.843 ( 2.960 0.531 -5.623) 6.377 9.102 ( 0.182 -0.819 0.934) 1.256 9.754 ( 6.065 -4.075 5.122) 8.923 9.974 ( 3.395 -2.745 6.576) 7.893 10.171 ( 4.014 -2.593 5.876) 7.574 10.351 ( 7.195 0.955 3.909) 8.244 10.673 ( 3.489 3.589 -1.040) 5.112 10.875 ( 9.590 -2.664 3.335) 10.497 11.111 ( 5.780 -1.137 3.989) 7.115 11.339 ( -2.551 -1.662 -0.492) 3.084 11.720 ( 13.829 -2.435 -3.845) 14.559 11.978 ( 3.439 1.776 5.885) 7.044 12.256 ( -0.057 -1.996 -1.518) 2.508 12.379 ( -7.438 -2.527 -2.763) 8.328 12.975 ( -7.968 8.534 3.543) 12.201 13.444 ( -1.159 -2.745 -8.639) 9.138 13.612 ( -2.471 3.667 1.277) 4.602 14.425 ( -20.730 -17.266 -11.176) 29.202 15.033 ( -3.969 -8.079 0.271) 9.006 15.166 ( -9.229 -16.118 19.942) 27.252 15.641 ( -3.589 0.960 -3.196) 4.901 16.078 ( -0.116 -6.156 0.775) 6.206 16.914 ( 9.819 0.724 11.852) 15.408 17.104 ( -9.519 -11.054 -0.366) 14.593 17.374 ( -2.138 -5.349 8.037) 9.888 18.832 ( -1.185 2.097 -4.080) 4.738 19.281 ( 21.489 30.950 -10.603) 39.142 ======================= Grid point 119 (51/260) ======================= q-point: ( 0.00 0.25 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 400 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.123 ( 8.712 18.219 23.933) 31.314 1.332 ( 8.741 27.338 4.779) 29.096 1.944 ( -8.746 28.597 15.529) 33.696 2.585 ( 2.170 -12.612 6.291) 14.260 4.149 ( 2.452 -1.139 -7.375) 7.855 4.284 ( 6.754 5.549 9.163) 12.664 4.484 ( -0.154 0.846 5.829) 5.892 4.804 ( 1.362 -3.185 3.103) 4.651 5.554 ( 3.482 -5.611 0.371) 6.614 5.991 ( 0.100 1.049 3.963) 4.101 6.044 ( -2.791 -0.965 -1.711) 3.413 6.343 ( -2.797 2.573 4.031) 5.540 6.390 ( 0.881 2.941 0.227) 3.078 6.981 ( -3.417 -5.484 -5.012) 8.177 7.161 ( -2.537 -4.682 -5.249) 7.477 7.245 ( 2.501 -10.611 -0.457) 10.911 7.756 ( -0.591 2.385 1.470) 2.863 8.009 ( 6.208 5.419 -4.185) 9.242 8.156 ( 7.071 5.217 -4.106) 9.699 8.454 ( 0.945 18.838 -0.686) 18.874 8.737 ( 3.353 3.519 0.851) 4.934 8.978 ( 0.826 7.440 -2.165) 7.792 9.112 ( 1.305 2.765 -0.918) 3.192 9.750 ( -0.948 0.201 0.048) 0.971 10.019 ( 3.696 -5.203 4.533) 7.828 10.073 ( -3.709 -3.645 -0.775) 5.258 10.308 ( -5.430 -2.470 -3.006) 6.680 10.632 ( -3.097 -6.529 -6.242) 9.549 10.938 ( 0.487 -3.279 4.908) 5.923 11.123 ( -1.567 -2.659 3.157) 4.415 11.332 ( 2.193 -1.233 4.608) 5.250 11.909 ( 0.888 -9.870 -3.377) 10.469 11.932 ( 5.389 -2.938 1.078) 6.232 12.176 ( 1.271 0.105 -7.442) 7.550 12.376 ( 0.265 -2.111 2.461) 3.253 13.052 ( -6.009 0.138 -6.843) 9.108 13.312 ( 4.433 17.654 -6.486) 19.324 13.671 ( -3.492 5.455 0.822) 6.529 13.947 ( -9.756 4.952 9.090) 14.224 14.743 ( -1.190 -12.759 -2.052) 12.977 14.810 ( -10.452 -12.835 6.272) 17.701 15.659 ( 4.327 0.474 2.474) 5.007 16.070 ( 3.199 0.288 -5.712) 6.553 16.581 ( -15.637 7.091 -11.301) 20.555 17.336 ( 10.688 -2.621 12.956) 16.999 17.490 ( 5.416 -4.057 18.229) 19.444 18.893 ( 3.728 3.008 -0.176) 4.794 19.707 ( 0.073 3.914 -10.664) 11.360 ======================= Grid point 120 (52/260) ======================= q-point: ( 0.10 0.25 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 400 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.403 ( 7.715 19.419 14.242) 25.287 1.582 ( 6.413 19.867 14.599) 25.475 2.064 ( 12.305 24.581 16.479) 32.050 2.688 ( 3.407 -10.969 7.629) 13.789 4.117 ( 0.016 -1.399 -8.489) 8.603 4.499 ( -1.572 1.296 6.335) 6.654 4.537 ( 8.493 -1.354 15.228) 17.489 4.886 ( 5.082 -2.579 3.744) 6.819 5.618 ( 1.205 -2.949 3.502) 4.734 5.966 ( -3.045 -3.046 -0.730) 4.368 6.016 ( 0.327 -2.026 2.454) 3.199 6.306 ( -2.672 1.947 0.177) 3.311 6.434 ( 3.293 6.053 0.348) 6.900 6.903 ( -0.880 -5.290 -4.519) 7.013 7.071 ( -2.191 -2.849 -4.873) 6.055 7.319 ( 4.454 -11.526 -4.067) 13.009 7.740 ( -1.916 8.107 2.834) 8.799 8.087 ( 3.025 0.586 -0.536) 3.128 8.261 ( 6.654 8.835 -5.404) 12.310 8.483 ( 0.861 15.000 2.660) 15.258 8.793 ( 0.780 7.702 4.189) 8.802 8.976 ( 0.269 -0.246 0.637) 0.734 9.134 ( 1.588 3.373 -0.733) 3.799 9.697 ( -5.567 3.548 -0.033) 6.601 9.943 ( -8.366 -2.442 7.168) 11.284 10.102 ( 0.385 -6.938 -2.155) 7.275 10.167 ( -4.599 -1.448 -5.898) 7.618 10.491 ( -5.766 -3.718 -6.582) 9.508 10.888 ( -6.968 -0.791 3.462) 7.821 11.043 ( -7.549 -1.282 1.810) 7.868 11.371 ( -3.848 0.132 4.724) 6.094 11.753 ( -5.625 -1.672 0.996) 5.952 12.055 ( 1.248 -1.391 -2.255) 2.928 12.210 ( -10.457 3.192 0.926) 10.972 12.287 ( 8.800 -9.621 -4.881) 13.922 12.962 ( -0.157 -6.449 -4.558) 7.899 13.441 ( 7.379 11.959 -14.139) 19.934 13.657 ( 1.698 6.356 4.620) 8.039 14.000 ( 12.192 6.153 4.394) 14.346 14.624 ( -9.949 -12.710 0.104) 16.141 14.741 ( 2.550 -10.617 -3.927) 11.604 15.795 ( 6.160 1.385 4.674) 7.856 16.082 ( 1.343 -0.250 -4.804) 4.995 16.296 ( -8.113 9.207 -5.104) 13.291 17.474 ( 0.153 1.029 8.563) 8.626 17.751 ( 5.748 -9.346 18.266) 21.308 18.982 ( 4.175 5.591 -0.871) 7.032 19.558 ( -6.881 0.029 -7.752) 10.365 ======================= Grid point 121 (53/260) ======================= q-point: ( 0.20 0.25 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 400 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.638 ( 11.215 19.992 4.597) 23.379 1.754 ( 1.758 13.970 19.000) 23.649 2.479 ( 16.835 12.639 12.801) 24.638 2.794 ( 2.612 -7.986 7.349) 11.163 4.059 ( -0.796 0.705 -7.061) 7.140 4.481 ( -3.719 0.535 5.485) 6.648 4.756 ( 4.663 -7.372 13.317) 15.919 5.048 ( 8.281 -2.072 4.245) 9.534 5.604 ( -6.005 2.911 6.260) 9.150 5.972 ( 4.137 -6.240 -1.532) 7.642 6.047 ( 2.763 -6.255 0.313) 6.845 6.247 ( -3.059 1.370 -0.207) 3.358 6.501 ( 3.378 7.024 -0.772) 7.832 6.888 ( 0.841 -1.408 -2.390) 2.899 7.040 ( 2.086 0.327 -3.135) 3.780 7.335 ( 1.523 -7.599 -8.806) 11.730 7.734 ( -1.641 9.744 5.955) 11.537 8.121 ( 0.448 -0.361 1.784) 1.874 8.333 ( 4.722 13.104 -8.000) 16.062 8.478 ( -3.711 9.217 4.497) 10.906 8.855 ( 1.924 4.624 7.303) 8.856 8.987 ( 0.309 -1.826 0.231) 1.867 9.165 ( 0.951 1.467 1.578) 2.355 9.520 ( -11.942 6.238 1.187) 13.525 9.870 ( -4.919 -3.058 7.560) 9.524 10.007 ( -2.515 -5.631 -10.659) 12.314 10.077 ( -5.474 -1.116 1.925) 5.909 10.364 ( -3.904 -0.404 -5.867) 7.059 10.745 ( -9.400 -0.656 0.572) 9.440 10.917 ( -4.319 0.466 0.973) 4.452 11.232 ( -9.404 4.170 0.614) 10.306 11.746 ( -0.360 -1.061 5.267) 5.384 11.977 ( -9.767 4.134 3.426) 11.145 12.028 ( -2.354 -2.420 -7.825) 8.522 12.470 ( 9.930 -12.577 -2.756) 16.260 12.944 ( 0.664 -11.024 -3.156) 11.486 13.422 ( 0.010 7.543 -6.860) 10.196 13.711 ( 0.881 6.716 3.228) 7.504 14.393 ( 24.304 3.266 -3.699) 24.800 14.457 ( -6.215 -10.837 -2.399) 12.721 14.778 ( 3.953 -5.909 -5.393) 8.923 15.926 ( 3.732 4.465 5.384) 7.928 16.052 ( -1.383 -1.375 -2.501) 3.171 16.211 ( 0.619 5.133 -1.962) 5.530 17.486 ( -5.112 0.213 10.812) 11.961 17.905 ( 1.650 -6.899 10.090) 12.334 18.980 ( -1.751 8.248 -7.888) 11.546 19.444 ( -1.910 -2.836 0.882) 3.531 ======================= Grid point 122 (54/260) ======================= q-point: ( 0.30 0.25 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 400 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.865 ( 4.359 12.777 5.386) 14.535 1.908 ( 8.251 12.593 11.490) 18.939 2.753 ( 3.504 -0.694 6.751) 7.638 2.905 ( 5.491 -0.247 6.087) 8.201 4.007 ( -0.636 3.018 -4.768) 5.678 4.427 ( -4.662 1.448 3.591) 6.061 4.918 ( 5.214 -9.372 10.361) 14.912 5.204 ( 5.488 -4.842 0.804) 7.363 5.497 ( -8.788 2.445 7.243) 11.647 5.998 ( 0.307 -6.673 -5.718) 8.793 6.179 ( 8.765 -5.372 0.400) 10.288 6.214 ( 0.483 0.678 2.029) 2.192 6.544 ( 0.884 6.761 0.373) 6.828 6.896 ( 2.757 3.400 -4.695) 6.420 7.100 ( 3.042 4.771 1.938) 5.981 7.307 ( 3.329 -4.308 -10.181) 11.545 7.728 ( -3.799 12.072 7.226) 14.573 8.135 ( -0.120 -0.006 1.450) 1.455 8.335 ( 0.588 11.208 -5.833) 12.649 8.441 ( -1.989 6.097 2.806) 7.001 8.852 ( -5.782 -1.196 1.378) 6.063 9.046 ( 3.974 -0.363 2.952) 4.964 9.158 ( -3.049 0.932 1.053) 3.358 9.309 ( -8.852 4.262 -0.990) 9.874 9.793 ( -7.058 -5.248 5.369) 10.304 9.910 ( -3.039 -2.524 -5.063) 6.422 10.023 ( -0.436 -1.508 1.464) 2.146 10.252 ( -4.057 1.655 -3.464) 5.585 10.562 ( -8.598 -1.656 -0.151) 8.757 10.894 ( 0.225 2.689 1.036) 2.890 11.099 ( -3.684 5.438 -0.328) 6.576 11.681 ( -7.665 -0.477 1.565) 7.838 11.903 ( -4.145 -1.413 -8.025) 9.142 11.927 ( -0.442 1.848 5.388) 5.713 12.616 ( 6.494 -10.907 -1.578) 12.792 12.955 ( 2.420 -14.882 -2.478) 15.280 13.384 ( -1.216 4.923 -1.636) 5.328 13.746 ( 0.432 3.633 4.622) 5.895 14.357 ( -2.560 -8.388 -2.827) 9.214 14.769 ( 9.597 4.458 -4.128) 11.359 14.867 ( 16.332 -1.409 -7.234) 17.918 15.945 ( -3.225 0.654 0.784) 3.383 16.092 ( 4.818 1.338 3.857) 6.315 16.230 ( 0.945 2.782 0.140) 2.941 17.412 ( -8.950 -0.708 9.178) 12.839 17.960 ( -0.287 -4.963 4.470) 6.685 18.877 ( -1.756 5.895 -9.437) 11.265 19.447 ( -0.241 -0.813 2.112) 2.276 ======================= Grid point 123 (55/260) ======================= q-point: ( 0.40 0.25 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 400 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.909 ( -2.910 6.829 7.339) 10.439 2.140 ( 9.134 10.572 3.309) 14.358 2.769 ( -3.277 -2.485 3.115) 5.159 3.001 ( 0.974 -0.722 0.520) 1.319 3.983 ( 0.545 4.744 -2.115) 5.223 4.356 ( -4.037 2.015 1.705) 4.823 5.076 ( 4.744 -6.984 5.624) 10.145 5.269 ( 2.456 -6.220 -2.844) 7.267 5.356 ( -9.887 -1.547 5.762) 11.548 5.969 ( 0.808 -5.690 -2.424) 6.238 6.221 ( -0.258 -3.679 2.469) 4.438 6.364 ( 8.166 0.872 -3.441) 8.904 6.536 ( -1.554 5.904 0.486) 6.124 6.942 ( 4.643 5.680 -5.545) 9.196 7.127 ( -0.565 5.991 0.050) 6.018 7.381 ( 7.948 -0.185 -3.532) 8.699 7.673 ( -6.024 15.441 6.970) 17.980 8.125 ( -1.380 -0.457 -0.653) 1.593 8.320 ( 0.567 5.843 -3.264) 6.717 8.422 ( -0.825 6.562 -0.112) 6.615 8.710 ( -7.491 -2.062 -1.012) 7.835 9.062 ( -4.620 -0.549 -2.809) 5.435 9.094 ( -0.570 -0.726 -1.968) 2.174 9.195 ( -2.418 1.952 -2.464) 3.966 9.697 ( -6.250 -4.666 6.651) 10.250 9.852 ( -0.127 -1.524 -0.833) 1.741 10.036 ( 0.309 -2.532 0.534) 2.606 10.198 ( -0.539 2.131 1.457) 2.637 10.436 ( -4.399 -2.132 0.510) 4.915 10.908 ( -0.128 3.220 0.875) 3.340 11.080 ( 0.849 3.453 1.307) 3.788 11.567 ( -3.266 -0.336 -0.774) 3.373 11.734 ( -5.279 1.642 -12.121) 13.322 12.004 ( 1.459 1.445 11.575) 11.756 12.696 ( 2.854 -9.626 -2.227) 10.285 13.007 ( 4.196 -14.960 -1.263) 15.588 13.352 ( -2.194 2.462 1.974) 3.843 13.781 ( -0.423 -0.647 5.365) 5.421 14.320 ( 0.136 -5.928 -1.615) 6.145 14.827 ( 3.027 8.002 -2.695) 8.970 15.199 ( 18.269 0.105 -6.041) 19.242 15.870 ( -4.069 -2.237 -1.859) 5.002 16.176 ( -2.294 1.707 6.748) 7.329 16.272 ( 4.670 2.272 2.242) 5.656 17.269 ( -9.621 -1.065 4.081) 10.505 17.959 ( -1.312 -4.811 0.723) 5.039 18.821 ( 1.513 4.588 -7.653) 9.050 19.434 ( -1.630 0.866 -0.881) 2.045 ======================= Grid point 124 (56/260) ======================= q-point: (-0.50 0.25 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 400 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.851 ( -6.694 5.108 4.143) 9.384 2.268 ( 1.762 6.780 2.109) 7.316 2.683 ( -5.796 -2.635 -2.129) 6.714 2.957 ( -3.754 -0.631 -3.681) 5.295 4.003 ( 2.321 5.202 -0.391) 5.710 4.304 ( -1.821 2.319 0.235) 2.958 5.047 ( -8.632 -3.982 -7.321) 11.999 5.216 ( -4.838 -3.465 2.054) 6.296 5.340 ( 3.528 -5.404 3.906) 7.544 6.026 ( 4.611 -6.408 3.224) 8.528 6.205 ( -2.149 -3.040 -0.433) 3.747 6.429 ( 1.332 6.277 -4.356) 7.756 6.508 ( -2.242 1.286 0.316) 2.604 6.973 ( 2.434 4.733 -6.383) 8.311 7.114 ( -0.129 6.158 -0.728) 6.202 7.508 ( 4.332 4.441 1.737) 6.442 7.607 ( -4.137 14.808 5.406) 16.298 8.080 ( -1.934 -0.459 -2.614) 3.284 8.267 ( -3.264 5.334 -5.392) 8.257 8.438 ( 2.782 3.507 -1.680) 4.781 8.603 ( -1.878 0.002 -2.597) 3.205 8.985 ( -0.764 -2.020 -5.345) 5.765 9.017 ( -3.353 -0.049 -6.417) 7.241 9.169 ( 1.141 1.694 -0.763) 2.180 9.653 ( -1.907 -1.956 5.141) 5.822 9.880 ( 1.149 -0.775 2.507) 2.865 10.052 ( 1.630 -4.294 0.599) 4.632 10.245 ( 3.024 0.109 5.488) 6.267 10.398 ( -0.231 -2.230 1.346) 2.615 10.882 ( -2.245 2.711 -0.584) 3.568 11.128 ( 2.095 0.889 3.233) 3.953 11.549 ( 2.014 1.065 -11.720) 11.939 11.583 ( -3.253 1.173 0.620) 3.513 12.115 ( 2.195 1.318 11.496) 11.777 12.695 ( -0.546 -11.285 -4.850) 12.295 13.100 ( 4.883 -10.654 2.281) 11.940 13.328 ( -1.961 2.726 3.949) 5.184 13.785 ( -2.187 -1.488 4.187) 4.952 14.340 ( 1.827 -5.805 0.795) 6.138 14.878 ( 3.117 9.850 0.160) 10.333 15.469 ( 12.302 -0.768 -2.932) 12.670 15.765 ( -5.033 -3.143 -3.337) 6.808 16.120 ( -6.250 2.686 5.118) 8.513 16.389 ( 3.165 0.216 6.853) 7.551 17.117 ( -5.990 -0.581 -2.161) 6.394 17.919 ( -2.343 -6.065 -2.617) 7.009 18.840 ( 4.626 5.493 -5.130) 8.826 19.372 ( -3.052 1.474 -4.568) 5.689 ======================= Grid point 125 (57/260) ======================= q-point: (-0.40 0.25 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 400 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.707 ( -9.969 6.089 2.097) 11.868 2.192 ( -11.661 4.803 0.462) 12.620 2.551 ( -3.246 -5.806 -8.007) 10.409 2.837 ( -6.095 2.249 -3.421) 7.343 4.060 ( 3.550 4.566 -0.551) 5.810 4.292 ( 0.622 2.498 -0.407) 2.606 4.776 ( -12.125 -4.128 -9.634) 16.027 5.121 ( -5.392 -2.278 -2.163) 6.241 5.421 ( 1.792 -1.848 3.398) 4.262 6.147 ( 1.879 -5.122 3.922) 6.719 6.154 ( 0.174 -2.878 -1.382) 3.197 6.363 ( -6.812 -0.109 0.260) 6.817 6.451 ( -1.558 7.403 -1.622) 7.737 6.999 ( 4.240 1.078 -3.858) 5.833 7.112 ( -0.145 6.128 0.275) 6.136 7.511 ( -3.484 13.612 1.410) 14.121 7.627 ( 1.800 3.293 4.329) 5.730 8.012 ( -3.038 -0.675 -4.959) 5.855 8.172 ( -2.177 5.703 -6.947) 9.248 8.465 ( 1.731 5.627 -3.700) 6.953 8.603 ( 3.741 0.702 -7.201) 8.145 8.876 ( -1.633 -0.053 -10.137) 10.268 9.020 ( 2.269 0.802 0.298) 2.425 9.231 ( 4.854 3.184 2.466) 6.307 9.679 ( 1.582 -1.876 2.940) 3.829 9.906 ( 1.013 1.122 0.294) 1.540 10.107 ( 2.773 -4.985 2.343) 6.166 10.381 ( 6.598 -2.934 7.807) 10.634 10.439 ( 3.305 -1.662 1.817) 4.121 10.843 ( -0.925 2.692 -0.651) 2.920 11.185 ( 1.690 0.598 3.010) 3.503 11.457 ( 0.237 -4.186 -12.329) 13.022 11.642 ( 3.493 2.519 4.174) 5.998 12.203 ( 0.209 -1.460 7.220) 7.369 12.635 ( -1.830 -11.767 -5.177) 12.986 13.198 ( 0.927 -7.177 8.376) 11.069 13.345 ( 2.309 6.764 2.183) 7.473 13.763 ( -2.058 0.921 3.208) 3.921 14.378 ( 1.174 -6.816 0.956) 6.982 14.944 ( 2.255 6.822 3.480) 7.984 15.561 ( -8.075 -4.896 6.413) 11.416 15.706 ( 6.840 -0.127 -7.943) 10.484 16.016 ( -7.208 1.760 3.905) 8.384 16.460 ( -0.861 0.137 8.949) 8.992 17.039 ( 1.107 0.443 -6.413) 6.523 17.832 ( -3.970 -7.885 -6.083) 10.721 18.937 ( 7.816 7.971 -2.172) 11.373 19.263 ( -4.047 1.553 -7.960) 9.063 ======================= Grid point 126 (58/260) ======================= q-point: (-0.30 0.25 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 400 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.506 ( -11.710 9.641 1.795) 15.274 1.840 ( -21.524 4.666 -5.871) 22.793 2.457 ( -3.633 -2.107 -4.847) 6.413 2.692 ( -6.828 0.474 -1.377) 6.981 4.121 ( 3.554 2.864 -2.492) 5.201 4.318 ( 1.994 2.682 -0.065) 3.342 4.495 ( -10.284 -1.398 -9.794) 14.271 4.988 ( -6.439 -3.079 -2.313) 7.502 5.447 ( 0.379 1.890 -0.442) 1.978 6.089 ( -5.661 -1.765 0.459) 5.948 6.142 ( -2.629 -1.981 -1.340) 3.554 6.334 ( 0.452 -6.552 8.659) 10.868 6.423 ( -0.208 10.504 -2.482) 10.795 7.074 ( 3.806 -1.481 0.926) 4.188 7.104 ( -1.306 4.271 1.533) 4.722 7.460 ( -0.362 6.775 -4.456) 8.117 7.686 ( 0.397 1.632 7.359) 7.548 7.914 ( -2.130 0.579 -7.976) 8.275 8.090 ( -0.857 6.163 -9.996) 11.774 8.468 ( 1.662 8.995 -6.924) 11.473 8.612 ( 2.588 4.306 -7.018) 8.630 8.854 ( 3.752 1.872 -6.373) 7.629 9.054 ( 1.060 1.251 0.004) 1.640 9.380 ( 7.195 5.475 6.088) 10.900 9.752 ( 4.532 -4.132 2.626) 6.672 9.937 ( 2.314 2.382 0.034) 3.321 10.181 ( 3.636 -3.355 1.326) 5.122 10.537 ( 5.112 -1.226 2.913) 6.010 10.574 ( 7.735 -3.645 6.916) 10.998 10.840 ( 1.101 1.680 -1.020) 2.253 11.236 ( 2.294 -1.389 2.388) 3.591 11.415 ( 2.353 -7.203 -10.769) 13.168 11.750 ( 5.170 2.651 3.996) 7.052 12.210 ( -1.712 -4.142 1.872) 4.857 12.561 ( -3.697 -10.272 -2.946) 11.308 13.229 ( -3.701 -1.433 11.139) 11.824 13.436 ( 5.765 7.877 -0.901) 9.803 13.752 ( -1.397 3.134 3.492) 4.896 14.393 ( 0.629 -7.707 -1.221) 7.829 14.985 ( -1.475 -0.150 5.319) 5.522 15.363 ( -15.812 -5.733 9.737) 19.434 15.817 ( 7.136 -0.366 -4.171) 8.273 15.895 ( -7.119 -0.638 1.584) 7.321 16.496 ( -0.327 2.969 10.431) 10.850 17.075 ( 5.940 1.142 -5.895) 8.447 17.681 ( -6.992 -9.304 -9.452) 14.993 19.090 ( 1.054 6.105 -0.408) 6.209 19.149 ( 5.868 6.547 -9.354) 12.837 ======================= Grid point 127 (59/260) ======================= q-point: (-0.20 0.25 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 400 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.281 ( -13.930 11.916 -4.196) 18.805 1.383 ( -18.442 13.609 1.061) 22.945 2.313 ( -11.025 12.007 3.414) 16.655 2.583 ( -3.615 -8.774 -0.620) 9.510 4.164 ( 3.270 0.504 -4.651) 5.708 4.254 ( -6.573 4.411 -8.776) 11.818 4.381 ( 1.791 1.803 2.716) 3.719 4.864 ( -5.210 -3.996 -0.260) 6.571 5.454 ( 1.961 1.600 -3.083) 3.989 5.992 ( -3.916 -1.807 2.422) 4.947 6.106 ( -1.633 -1.906 0.736) 2.615 6.373 ( -0.601 1.519 3.552) 3.909 6.411 ( -1.040 4.528 1.496) 4.881 7.084 ( -1.651 0.796 1.681) 2.487 7.136 ( 1.359 -3.780 1.956) 4.468 7.427 ( -0.962 -3.629 -5.503) 6.662 7.717 ( -1.048 0.230 4.576) 4.700 7.874 ( 3.325 4.628 -6.711) 8.804 8.030 ( 2.304 6.729 -11.629) 13.632 8.451 ( 1.483 14.822 -6.402) 16.213 8.636 ( 3.335 4.219 -4.953) 7.311 8.898 ( 3.834 6.354 -3.948) 8.406 9.072 ( 1.043 0.915 -0.155) 1.396 9.564 ( 8.200 4.040 4.504) 10.191 9.858 ( 1.397 -4.916 7.637) 9.189 10.017 ( 6.698 1.003 -0.533) 6.794 10.261 ( 4.571 -0.630 -0.482) 4.639 10.655 ( 2.689 -2.942 5.543) 6.827 10.705 ( 3.829 0.772 0.134) 3.908 10.909 ( 6.910 -2.914 1.192) 7.593 11.298 ( 1.094 -5.122 1.291) 5.394 11.427 ( 7.565 -5.636 -8.691) 12.827 11.891 ( 6.909 3.103 2.885) 8.105 12.191 ( -0.493 -4.478 0.562) 4.540 12.444 ( -6.698 -7.538 -2.080) 10.296 13.202 ( -4.994 3.598 8.059) 10.141 13.514 ( 2.751 6.300 -4.285) 8.101 13.739 ( -2.354 4.967 3.650) 6.598 14.379 ( -1.638 -9.166 -4.004) 10.135 14.939 ( -5.973 -8.217 2.883) 10.559 15.105 ( -18.806 -6.219 18.726) 27.258 15.757 ( -5.981 -1.678 -3.856) 7.312 15.932 ( 6.405 -1.275 -2.155) 6.876 16.624 ( 5.973 5.001 16.407) 18.163 17.164 ( 5.280 1.391 -4.574) 7.123 17.439 ( -10.953 -8.182 -10.653) 17.332 18.967 ( -4.486 1.849 -6.996) 8.514 19.384 ( 15.098 12.734 -2.150) 19.868 ======================= Grid point 128 (60/260) ======================= q-point: (-0.10 0.25 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 400 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.980 ( -7.767 19.242 4.390) 21.210 1.243 ( -3.297 23.556 7.896) 25.062 2.102 ( -14.236 23.004 10.506) 29.021 2.544 ( -0.902 -12.668 2.554) 12.954 4.136 ( -0.585 7.096 -3.712) 8.030 4.196 ( 2.845 -0.284 -3.376) 4.424 4.438 ( 1.466 1.696 4.358) 4.901 4.796 ( -2.150 -3.721 1.731) 4.633 5.491 ( 3.516 -2.696 -2.378) 5.028 5.970 ( -0.778 0.180 3.661) 3.747 6.083 ( -1.157 -0.901 -0.020) 1.467 6.372 ( -1.561 2.271 2.384) 3.644 6.389 ( -1.915 3.082 2.499) 4.406 7.058 ( -2.041 -3.072 -0.757) 3.765 7.157 ( 1.533 -6.202 -1.414) 6.544 7.328 ( -5.846 -7.529 -3.438) 10.133 7.737 ( 1.474 -0.624 0.651) 1.728 7.925 ( 5.048 6.924 -4.776) 9.810 8.056 ( 6.455 6.148 -7.699) 11.779 8.449 ( 1.231 19.111 -3.514) 19.471 8.674 ( 3.462 1.955 -2.936) 4.943 8.950 ( 3.605 10.282 -3.195) 11.355 9.093 ( 1.138 0.984 -0.196) 1.518 9.721 ( 5.215 0.139 -0.024) 5.217 9.911 ( 1.359 -3.529 7.377) 8.290 10.114 ( 1.300 -4.118 -0.082) 4.319 10.351 ( 2.927 -0.320 0.301) 2.960 10.667 ( 0.208 -3.562 -1.156) 3.751 10.828 ( 6.344 -1.691 3.397) 7.392 11.059 ( 5.733 -3.916 2.485) 7.375 11.292 ( -0.249 -3.011 0.816) 3.129 11.626 ( 16.011 -6.328 -4.826) 17.880 11.999 ( 0.744 0.086 0.826) 1.115 12.214 ( 2.572 -1.968 -2.053) 3.834 12.313 ( -3.662 -3.673 0.906) 5.265 13.149 ( -3.750 6.790 2.578) 8.174 13.445 ( -6.319 4.995 -7.559) 11.046 13.715 ( -1.449 6.235 0.380) 6.412 14.203 ( -15.947 -4.681 1.619) 16.699 14.816 ( -6.169 -12.844 1.009) 14.284 14.935 ( -10.993 -8.831 16.783) 21.921 15.642 ( -2.664 -0.528 -2.588) 3.752 16.024 ( 5.104 -0.690 -4.681) 6.959 16.933 ( 10.056 1.066 13.178) 16.610 17.003 ( -12.381 -1.359 -5.795) 13.737 17.348 ( 3.573 0.123 4.423) 5.687 18.876 ( -0.923 2.290 -3.755) 4.494 19.637 ( 12.028 9.588 -6.117) 16.554 ======================= Grid point 129 (61/260) ======================= q-point: ( 0.00 0.38 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 400 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.510 ( 5.420 20.228 19.366) 28.524 1.814 ( 5.605 19.260 4.608) 20.581 2.292 ( 2.741 -16.397 8.546) 18.693 2.395 ( 1.651 15.107 -0.793) 15.218 4.137 ( -0.753 0.841 -7.200) 7.288 4.381 ( -0.604 -0.592 11.568) 11.599 4.492 ( 3.318 4.355 8.126) 9.798 4.758 ( 0.951 -2.268 5.610) 6.126 5.434 ( 3.358 -5.553 1.174) 6.595 5.984 ( -1.711 -1.177 -2.260) 3.069 6.057 ( -1.593 1.732 0.913) 2.524 6.388 ( -3.200 1.574 7.792) 8.570 6.446 ( 1.200 2.695 -2.124) 3.635 6.853 ( -4.011 -6.619 -7.466) 10.754 7.081 ( 3.049 -4.034 -2.161) 5.499 7.095 ( -3.408 -3.364 -2.407) 5.360 7.758 ( 2.216 -1.241 4.708) 5.349 8.085 ( 2.374 3.358 2.170) 4.650 8.258 ( 6.756 3.623 -4.678) 8.981 8.727 ( 2.830 0.526 -0.227) 2.888 8.866 ( 3.699 16.647 -3.883) 17.490 9.052 ( -1.261 1.463 0.155) 1.938 9.308 ( 1.943 14.151 -5.377) 15.262 9.753 ( 0.118 -0.750 -0.011) 0.760 9.902 ( 2.854 -6.989 1.577) 7.712 9.951 ( -4.046 -8.315 1.190) 9.324 10.268 ( -3.862 -1.425 -7.558) 8.607 10.519 ( -3.486 -4.122 -1.425) 5.584 10.919 ( 1.223 1.644 5.945) 6.288 11.070 ( 0.546 -2.865 3.464) 4.528 11.284 ( 0.932 -3.400 6.703) 7.574 11.700 ( 8.577 -8.136 -3.413) 12.305 11.907 ( -4.160 -1.083 -2.911) 5.192 12.184 ( 1.708 1.236 -4.023) 4.542 12.313 ( 1.359 -3.716 2.362) 4.608 13.096 ( -9.074 3.177 -6.302) 11.495 13.648 ( 8.181 14.653 -8.799) 18.949 13.775 ( -3.624 4.469 1.248) 5.888 14.045 ( -4.797 4.649 3.294) 7.448 14.498 ( -0.442 -10.702 -1.437) 10.807 14.561 ( -12.778 -11.760 7.096) 18.759 15.664 ( 4.450 0.028 2.480) 5.094 16.074 ( 2.985 0.122 -4.942) 5.775 16.679 ( -12.067 3.074 -9.543) 15.689 17.290 ( 11.362 -1.560 18.156) 21.475 17.464 ( 2.182 -0.035 8.968) 9.230 18.946 ( 4.509 2.009 0.587) 4.971 19.760 ( -3.036 1.724 -9.367) 9.997 ======================= Grid point 130 (62/260) ======================= q-point: ( 0.10 0.38 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 400 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.763 ( 7.684 17.298 17.453) 25.746 1.938 ( 1.389 14.260 11.082) 18.113 2.407 ( 4.159 -8.774 8.994) 13.235 2.532 ( 10.315 11.730 3.540) 16.016 4.091 ( 0.377 -0.465 -6.562) 6.590 4.402 ( -3.575 -7.399 11.709) 14.305 4.631 ( 3.055 6.947 9.499) 12.158 4.854 ( 5.139 -1.361 7.525) 9.213 5.559 ( 7.646 -2.719 3.872) 8.992 5.901 ( -3.402 -2.886 -6.081) 7.542 6.002 ( -5.027 0.386 1.833) 5.364 6.333 ( -5.202 0.789 3.569) 6.357 6.522 ( 5.819 3.150 -0.957) 6.686 6.769 ( 1.108 -7.415 -6.967) 10.235 7.039 ( 0.600 -0.472 -4.681) 4.743 7.149 ( 3.875 -5.206 -0.748) 6.533 7.835 ( 2.090 1.668 6.297) 6.842 8.126 ( 0.375 3.168 2.371) 3.975 8.364 ( 6.028 2.623 -1.688) 6.788 8.758 ( 0.260 6.708 0.374) 6.723 8.943 ( 4.726 8.417 -0.391) 9.661 9.000 ( -3.963 4.541 1.197) 6.145 9.283 ( -1.061 11.509 -3.908) 12.200 9.720 ( -4.228 -2.821 -1.601) 5.329 9.865 ( -5.096 -4.959 4.170) 8.243 9.922 ( -1.880 -10.274 -1.941) 10.623 10.149 ( -2.419 -0.736 -9.295) 9.632 10.457 ( -1.367 0.534 -0.706) 1.628 10.892 ( -6.266 1.607 1.743) 6.699 11.029 ( -6.526 0.589 4.319) 7.848 11.310 ( -4.163 -5.974 6.658) 9.866 11.726 ( -2.401 -1.126 1.889) 3.256 11.906 ( 4.590 -8.559 -2.941) 10.148 12.198 ( 0.855 -1.390 -5.289) 5.535 12.290 ( -3.896 2.906 3.476) 5.975 12.879 ( -6.635 -1.743 -10.491) 12.535 13.623 ( -2.336 5.563 -7.488) 9.616 13.846 ( 4.220 12.176 -1.279) 12.950 14.113 ( 12.151 4.849 3.161) 13.459 14.371 ( -8.919 -12.538 0.369) 15.391 14.541 ( 6.138 -8.810 -3.461) 11.281 15.807 ( 7.062 0.166 5.566) 8.993 16.076 ( 0.078 -0.255 -3.974) 3.983 16.435 ( -7.743 4.653 -6.384) 11.062 17.498 ( -0.488 1.316 9.577) 9.680 17.618 ( 6.181 -4.397 17.452) 19.029 19.076 ( 6.897 3.574 2.505) 8.162 19.558 ( -9.514 -0.036 -11.520) 14.941 ======================= Grid point 131 (63/260) ======================= q-point: ( 0.20 0.38 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 400 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.003 ( 8.756 16.287 8.773) 20.467 2.007 ( -1.881 10.460 14.082) 17.642 2.553 ( 4.095 -9.028 9.609) 13.806 2.770 ( 10.301 7.972 4.270) 13.708 4.069 ( 1.230 0.769 -5.410) 5.601 4.411 ( -2.329 -6.824 9.625) 12.027 4.710 ( 0.045 2.226 9.732) 9.984 5.014 ( 5.498 -1.547 5.868) 8.189 5.687 ( -3.216 4.942 3.749) 6.987 5.864 ( 5.854 -4.276 -1.526) 7.408 5.918 ( -0.129 -5.833 -2.866) 6.500 6.256 ( -4.717 -0.097 3.635) 5.956 6.610 ( 5.306 4.012 -5.105) 8.385 6.820 ( 5.707 -5.224 -1.463) 7.874 7.060 ( 4.693 1.302 -4.638) 6.725 7.200 ( 1.991 -4.207 -2.010) 5.070 7.913 ( 1.732 6.216 6.964) 9.494 8.136 ( -0.281 2.373 1.813) 3.000 8.461 ( 4.414 1.680 0.041) 4.723 8.711 ( -5.851 10.088 -1.174) 11.721 8.912 ( -4.189 -1.362 1.934) 4.811 9.045 ( 2.963 9.959 3.196) 10.871 9.243 ( -0.880 6.832 -1.929) 7.154 9.547 ( -10.609 -3.895 -4.129) 12.032 9.806 ( -7.424 -5.598 2.935) 9.750 9.845 ( -0.014 -7.518 -3.568) 8.322 10.060 ( -2.998 -0.676 -2.864) 4.201 10.449 ( -0.155 8.231 -1.485) 8.365 10.727 ( -10.326 -0.767 -0.559) 10.369 10.932 ( -3.767 1.516 1.811) 4.446 11.199 ( -8.710 -6.890 2.434) 11.369 11.723 ( -2.498 -0.571 6.917) 7.376 11.943 ( 0.910 -4.962 -3.061) 5.901 12.091 ( -7.667 4.090 2.158) 8.954 12.321 ( 6.060 -1.060 -3.898) 7.283 12.726 ( -3.009 -10.016 -9.093) 13.858 13.541 ( -1.831 4.115 -6.220) 7.679 13.854 ( -2.292 7.647 2.517) 8.370 14.240 ( -3.750 -10.259 -1.541) 11.031 14.474 ( 22.101 4.081 -3.391) 22.729 14.671 ( 9.305 -4.616 -4.366) 11.267 15.976 ( 5.587 1.187 6.594) 8.724 16.028 ( -2.408 -0.980 -2.432) 3.560 16.310 ( -2.085 4.025 -3.580) 5.776 17.493 ( -6.100 0.414 10.813) 12.422 17.800 ( 2.824 -3.592 11.807) 12.661 19.140 ( -2.784 7.537 -7.467) 10.969 19.377 ( -0.574 -3.999 -1.067) 4.178 ======================= Grid point 132 (64/260) ======================= q-point: ( 0.30 0.38 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 400 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.038 ( -3.800 6.126 12.757) 14.653 2.211 ( 9.416 14.852 1.284) 17.632 2.668 ( 2.113 -6.590 7.671) 10.331 2.935 ( 4.200 1.531 2.128) 4.951 4.068 ( 1.459 3.151 -3.700) 5.074 4.415 ( -2.697 -3.098 5.568) 6.919 4.800 ( 3.349 -1.774 11.325) 11.942 5.114 ( 3.145 -3.897 0.407) 5.024 5.539 ( -11.190 1.615 2.144) 11.507 5.861 ( 0.975 -6.179 -3.407) 7.123 6.131 ( 11.313 0.324 2.562) 11.604 6.209 ( -1.042 -0.965 2.876) 3.208 6.679 ( 4.817 6.156 -4.372) 8.957 6.914 ( 5.268 -2.044 -3.795) 6.807 7.167 ( 7.801 0.465 -0.808) 7.856 7.205 ( 0.848 -2.203 -3.670) 4.364 7.985 ( 0.889 10.920 7.201) 13.111 8.141 ( -0.300 1.560 0.541) 1.678 8.527 ( 0.712 3.778 -3.528) 5.218 8.554 ( -6.488 6.693 3.076) 9.816 8.816 ( -7.854 -2.743 0.910) 8.369 9.094 ( 0.220 5.565 1.432) 5.750 9.206 ( -3.086 4.542 -1.532) 5.701 9.319 ( -8.425 -2.977 -4.918) 10.200 9.676 ( -5.631 -6.844 0.584) 8.882 9.826 ( -1.085 -4.908 -1.607) 5.278 10.008 ( -2.189 -0.131 2.184) 3.095 10.405 ( -2.860 12.767 -1.432) 13.161 10.529 ( -8.978 -1.315 -0.414) 9.083 10.927 ( 1.738 -0.455 -0.259) 1.815 11.061 ( -5.833 -7.321 1.143) 9.430 11.648 ( -7.022 -1.945 2.144) 7.595 11.963 ( -1.542 4.627 4.620) 6.718 11.980 ( -1.227 4.277 -4.427) 6.277 12.431 ( 5.942 -6.910 -0.707) 9.140 12.653 ( 0.509 -14.128 -5.227) 15.072 13.471 ( -2.019 3.256 -4.586) 5.976 13.817 ( -3.620 3.587 5.213) 7.290 14.198 ( 0.210 -7.049 -2.321) 7.424 14.824 ( 9.386 -0.012 -4.474) 10.398 14.869 ( 20.495 2.493 -4.651) 21.163 15.931 ( -4.717 -1.222 -1.989) 5.263 16.124 ( 3.817 1.144 7.145) 8.181 16.290 ( 0.756 2.834 -0.582) 2.990 17.402 ( -9.317 -0.227 8.367) 12.525 17.879 ( -0.184 -2.872 6.436) 7.050 18.983 ( -4.053 4.224 -9.929) 11.526 19.430 ( 2.279 -0.740 1.850) 3.028 ======================= Grid point 133 (65/260) ======================= q-point: ( 0.40 0.38 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 400 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.017 ( -5.370 3.524 9.422) 11.403 2.358 ( 6.310 11.071 -5.694) 13.957 2.717 ( -1.141 -3.455 3.288) 4.904 2.967 ( -0.734 -2.150 0.716) 2.383 4.078 ( 1.474 4.451 -2.103) 5.138 4.378 ( -3.272 -0.149 2.555) 4.154 4.973 ( 6.763 -2.778 9.353) 11.872 5.157 ( 2.212 -5.107 -2.290) 6.018 5.312 ( -12.890 -1.998 0.994) 13.082 5.886 ( 2.327 -2.749 0.565) 3.646 6.160 ( -2.743 -1.759 3.980) 5.144 6.361 ( 7.616 -0.797 -0.997) 7.722 6.713 ( 1.943 9.782 -7.328) 12.375 6.996 ( 5.795 -0.283 -4.470) 7.324 7.202 ( 0.606 2.061 -0.885) 2.324 7.333 ( 8.906 -3.069 0.301) 9.425 8.016 ( -2.583 16.599 5.874) 17.796 8.121 ( -1.322 0.464 -1.317) 1.923 8.414 ( -3.096 3.184 -1.227) 4.608 8.569 ( -3.772 5.364 0.738) 6.599 8.646 ( -5.181 -4.284 0.208) 6.726 9.025 ( -5.835 -1.080 -6.663) 8.923 9.116 ( -2.813 1.980 -2.060) 4.009 9.199 ( -2.641 -1.356 -3.187) 4.356 9.625 ( -1.742 -2.050 5.222) 5.874 9.805 ( 0.755 -3.605 -1.039) 3.826 9.984 ( -2.179 -1.872 2.006) 3.504 10.349 ( -2.063 9.281 -0.866) 9.546 10.404 ( -3.872 1.808 1.551) 4.546 10.940 ( -0.420 -3.772 -2.122) 4.349 11.005 ( -1.546 -5.676 3.244) 6.718 11.564 ( -0.596 0.273 -1.797) 1.913 11.825 ( -6.627 6.238 -7.309) 11.673 12.058 ( 2.747 3.113 7.112) 8.235 12.487 ( 0.010 -10.733 -1.394) 10.823 12.719 ( 7.368 -11.573 2.223) 13.899 13.413 ( -1.567 2.695 -2.007) 3.708 13.787 ( -3.127 1.066 6.271) 7.088 14.206 ( 1.362 -4.949 -0.921) 5.215 14.961 ( 7.075 4.977 -2.761) 9.080 15.198 ( 16.228 -0.139 -4.449) 16.828 15.822 ( -4.773 -2.124 -3.152) 6.101 16.199 ( -1.398 0.642 7.424) 7.582 16.324 ( 2.302 2.393 2.611) 4.224 17.254 ( -9.148 -0.405 2.947) 9.620 17.881 ( -2.087 -2.792 1.746) 3.898 18.901 ( 0.766 3.098 -6.202) 6.974 19.450 ( -0.439 0.601 -1.582) 1.748 ======================= Grid point 134 (66/260) ======================= q-point: (-0.50 0.38 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 400 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.953 ( -6.002 4.129 5.431) 9.087 2.358 ( -1.166 3.205 -10.246) 10.799 2.645 ( -6.220 -1.939 -3.127) 7.227 2.949 ( -1.279 0.061 -0.502) 1.376 4.103 ( 2.117 4.329 -0.936) 4.909 4.337 ( -1.935 0.810 1.278) 2.456 5.001 ( -9.994 -0.095 -3.992) 10.762 5.136 ( -3.185 -4.377 -0.905) 5.488 5.236 ( 6.065 -4.468 7.153) 10.388 5.953 ( 3.166 -1.684 3.993) 5.367 6.133 ( -2.403 -2.491 3.285) 4.772 6.424 ( -0.639 -2.485 -0.707) 2.661 6.684 ( 1.454 9.709 -10.101) 14.086 7.023 ( -0.045 0.902 -6.284) 6.348 7.220 ( 1.045 5.353 1.133) 5.571 7.485 ( 5.068 -4.330 2.701) 7.192 7.965 ( -5.381 17.282 2.994) 18.346 8.086 ( -1.345 1.046 -1.861) 2.523 8.354 ( -3.402 3.161 -4.351) 6.364 8.473 ( 1.845 -2.634 -2.393) 4.009 8.628 ( -2.967 3.066 1.051) 4.394 8.913 ( 1.361 -3.824 -6.921) 8.023 9.044 ( -1.993 2.212 -5.635) 6.373 9.171 ( 1.296 -1.325 -1.024) 2.117 9.650 ( 0.114 1.943 6.169) 6.469 9.855 ( 3.429 -2.316 2.376) 4.772 9.949 ( -1.438 -4.998 -0.169) 5.204 10.331 ( 1.058 2.213 -0.032) 2.453 10.389 ( 0.306 6.804 2.549) 7.272 10.906 ( -1.360 -2.641 -1.301) 3.243 11.017 ( 0.624 -7.626 2.752) 8.132 11.596 ( 4.866 3.233 -9.631) 11.264 11.643 ( -7.325 3.505 -1.222) 8.212 12.143 ( 0.762 0.942 7.568) 7.664 12.447 ( -1.366 -12.070 -4.737) 13.038 12.912 ( 7.338 -6.697 10.586) 14.518 13.399 ( 1.103 3.264 0.252) 3.454 13.772 ( -2.380 0.085 5.902) 6.364 14.233 ( 1.340 -4.405 0.836) 4.679 15.054 ( 3.115 7.376 0.132) 8.008 15.429 ( 9.081 -3.020 -1.524) 9.690 15.715 ( -2.932 -1.625 -5.556) 6.489 16.163 ( -6.388 1.480 6.207) 9.029 16.398 ( 1.963 0.517 6.011) 6.344 17.112 ( -4.892 0.040 -2.867) 5.670 17.825 ( -3.472 -3.197 -2.427) 5.307 18.931 ( 4.936 3.312 -2.305) 6.375 19.398 ( -2.566 0.980 -5.476) 6.126 ======================= Grid point 135 (67/260) ======================= q-point: (-0.40 0.38 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 400 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.854 ( -6.362 7.546 0.922) 9.913 2.202 ( -8.327 -3.096 -9.234) 12.814 2.469 ( -7.185 -1.852 -8.249) 11.095 2.886 ( -4.000 1.849 -5.015) 6.676 4.143 ( 2.268 3.388 -0.681) 4.134 4.325 ( -0.300 0.557 1.683) 1.798 4.755 ( -11.296 2.572 -3.187) 12.015 5.039 ( -5.318 -6.059 -4.926) 9.448 5.398 ( 5.892 -0.466 4.209) 7.256 6.052 ( 3.831 -3.302 4.068) 6.491 6.113 ( -2.230 -1.039 5.503) 6.028 6.320 ( -9.291 -2.506 0.163) 9.624 6.654 ( 1.399 9.024 -8.549) 12.509 6.982 ( 0.675 -1.772 -3.572) 4.044 7.236 ( -0.915 6.805 2.134) 7.191 7.540 ( -2.204 -4.755 4.635) 6.996 7.852 ( -5.120 12.174 -1.863) 13.338 8.017 ( -3.647 0.542 -4.804) 6.056 8.297 ( -0.774 6.694 -6.813) 9.583 8.527 ( 3.275 -0.479 -5.001) 5.997 8.595 ( 5.013 -1.532 -3.967) 6.574 8.936 ( 1.997 5.991 -6.386) 8.980 9.036 ( 4.641 0.657 -1.847) 5.038 9.241 ( 6.073 -1.929 2.410) 6.812 9.679 ( -0.660 1.983 3.167) 3.794 9.914 ( 1.713 -0.735 0.077) 1.866 9.985 ( 4.382 -6.360 4.194) 8.789 10.397 ( 5.568 0.662 0.705) 5.651 10.437 ( 2.987 5.317 2.534) 6.604 10.885 ( -0.229 0.816 -0.619) 1.050 11.059 ( 2.050 -10.398 1.953) 10.776 11.444 ( -4.784 0.954 -12.175) 13.116 11.705 ( 5.045 4.003 1.573) 6.630 12.165 ( -2.358 -2.199 4.353) 5.417 12.398 ( -0.653 -10.939 -3.913) 11.636 13.100 ( 3.103 -2.696 16.029) 16.548 13.463 ( 4.925 4.648 0.721) 6.810 13.771 ( -1.033 0.172 4.586) 4.704 14.261 ( 0.563 -4.512 1.668) 4.843 15.066 ( -3.173 4.786 2.706) 6.348 15.472 ( -6.313 -3.517 5.019) 8.799 15.701 ( 6.583 -0.349 -8.290) 10.592 16.041 ( -8.993 0.734 3.369) 9.631 16.467 ( 0.887 0.474 8.034) 8.097 17.052 ( 1.674 0.657 -5.914) 6.181 17.717 ( -5.020 -3.720 -6.055) 8.701 19.060 ( 8.790 4.249 1.098) 9.824 19.290 ( -3.890 0.958 -8.668) 9.549 ======================= Grid point 136 (68/260) ======================= q-point: (-0.30 0.38 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 400 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.723 ( -6.080 10.929 -4.446) 13.273 1.937 ( -13.531 4.321 -5.443) 15.211 2.311 ( -3.219 -8.701 -8.607) 12.655 2.738 ( -6.747 0.995 -7.468) 10.114 4.172 ( 1.131 2.412 -0.815) 2.786 4.344 ( 0.324 -0.376 4.104) 4.134 4.548 ( -7.326 6.800 -5.466) 11.392 4.892 ( -6.481 -6.979 -3.360) 10.100 5.495 ( 2.686 2.677 -1.282) 4.003 6.072 ( -5.786 -0.232 2.864) 6.460 6.088 ( -3.022 -2.416 -1.628) 4.198 6.225 ( 0.254 -4.141 12.584) 13.250 6.623 ( -0.127 8.196 -6.226) 10.293 7.009 ( 1.837 -3.804 1.703) 4.555 7.202 ( -3.978 5.511 2.100) 7.113 7.453 ( -7.232 -4.760 0.565) 8.677 7.782 ( -3.194 5.351 1.107) 6.329 7.930 ( 0.277 0.634 -7.935) 7.965 8.213 ( -0.631 5.223 -11.829) 12.946 8.564 ( 4.462 -0.091 -6.708) 8.057 8.719 ( 7.805 6.015 -3.667) 10.514 8.946 ( 3.310 6.839 -4.522) 8.842 9.117 ( 4.604 4.556 -2.580) 6.973 9.425 ( 8.977 -1.156 5.575) 10.630 9.684 ( 1.181 -2.392 0.364) 2.692 9.952 ( 1.277 -1.530 1.779) 2.672 10.122 ( 6.780 -1.867 3.836) 8.011 10.523 ( 3.538 1.954 3.252) 5.188 10.545 ( 8.991 -0.297 0.470) 9.008 10.873 ( -0.872 1.517 -1.628) 2.390 11.111 ( 1.948 -10.194 2.268) 10.623 11.325 ( 0.951 -2.020 -11.796) 12.006 11.824 ( 6.778 4.834 0.699) 8.354 12.128 ( -2.713 -3.623 1.810) 4.875 12.362 ( -1.853 -9.070 -1.334) 9.353 13.219 ( -1.096 0.152 15.703) 15.742 13.573 ( 5.346 5.263 0.002) 7.502 13.793 ( 0.689 1.169 3.551) 3.801 14.270 ( -0.410 -4.320 0.870) 4.425 14.961 ( -9.143 -1.977 2.621) 9.714 15.308 ( -15.513 -0.211 12.146) 19.703 15.804 ( 8.136 -0.731 -6.742) 10.592 15.876 ( -7.983 -0.993 -2.296) 8.366 16.548 ( 2.223 2.012 10.243) 10.673 17.098 ( 6.098 0.998 -4.824) 7.839 17.552 ( -7.376 -3.992 -8.941) 12.259 19.142 ( -4.795 1.308 -8.681) 10.004 19.284 ( 12.502 4.851 1.796) 13.530 ======================= Grid point 137 (69/260) ======================= q-point: (-0.20 0.38 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 400 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.537 ( -9.029 14.160 -8.565) 18.851 1.716 ( -5.904 16.535 2.418) 17.723 2.234 ( -0.871 -13.798 -4.374) 14.501 2.564 ( -6.306 1.277 -5.838) 8.688 4.184 ( 0.738 2.636 0.449) 2.774 4.381 ( -1.096 -0.723 5.620) 5.771 4.399 ( -3.068 7.717 -7.035) 10.883 4.776 ( -4.494 -5.415 1.235) 7.145 5.477 ( -1.964 0.943 -4.411) 4.920 5.981 ( -2.426 0.506 3.306) 4.132 6.065 ( -0.904 -2.073 0.727) 2.376 6.326 ( 1.046 -2.228 11.029) 11.301 6.565 ( -2.610 6.617 -4.122) 8.221 7.035 ( -1.381 -4.547 2.634) 5.433 7.121 ( -4.662 1.977 0.753) 5.120 7.320 ( -5.669 -5.556 -2.066) 8.202 7.717 ( -3.012 -0.640 0.569) 3.132 7.947 ( 4.395 3.112 -4.344) 6.919 8.157 ( 2.732 4.814 -11.840) 13.070 8.610 ( 4.531 -0.259 -6.291) 7.757 8.810 ( 4.356 13.298 -4.909) 14.830 9.000 ( 3.554 3.469 -1.318) 5.138 9.192 ( 5.400 10.035 -3.672) 11.972 9.602 ( 6.843 -0.602 0.933) 6.932 9.753 ( 3.753 -5.665 4.604) 8.208 9.979 ( 0.346 -4.007 1.896) 4.447 10.278 ( 7.181 1.948 0.593) 7.464 10.588 ( -0.234 -2.711 5.338) 5.992 10.717 ( 7.092 0.715 -0.190) 7.131 10.851 ( 2.290 -2.582 -1.904) 3.941 11.168 ( 2.334 -6.973 2.249) 7.689 11.347 ( 8.353 -2.560 -9.900) 13.204 11.965 ( 6.715 4.131 -0.912) 7.936 12.105 ( -0.039 -3.774 1.892) 4.222 12.305 ( -3.459 -6.003 -0.349) 6.937 13.259 ( -2.851 2.122 10.466) 11.053 13.633 ( 1.058 4.814 -2.092) 5.355 13.833 ( 1.039 4.009 2.313) 4.744 14.253 ( -1.493 -3.913 -1.343) 4.399 14.769 ( -11.438 -7.031 1.571) 13.518 15.044 ( -20.868 -1.282 18.519) 27.930 15.722 ( -5.214 -1.492 -5.347) 7.616 15.921 ( 7.827 -0.204 -5.900) 9.804 16.698 ( 5.906 2.448 13.855) 15.259 17.198 ( 4.771 1.877 -3.448) 6.179 17.327 ( -8.513 -3.796 -8.781) 12.806 18.999 ( -4.007 1.243 -7.694) 8.763 19.553 ( 13.182 5.039 1.294) 14.171 ======================= Grid point 138 (70/260) ======================= q-point: (-0.10 0.38 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 400 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.391 ( -2.864 21.364 6.045) 22.386 1.707 ( 2.444 20.361 2.244) 20.630 2.222 ( 0.656 -15.766 2.049) 15.912 2.438 ( -3.859 6.451 -2.684) 7.982 4.196 ( -0.174 2.463 -4.125) 4.807 4.312 ( 0.047 8.041 1.459) 8.173 4.428 ( -0.417 -2.347 8.110) 8.453 4.735 ( -1.612 -3.030 4.015) 5.282 5.417 ( -1.063 -3.855 -2.114) 4.523 5.991 ( 0.496 1.633 1.873) 2.534 6.062 ( 0.216 -1.156 0.140) 1.184 6.382 ( -1.724 0.372 8.853) 9.028 6.485 ( -2.801 4.451 -2.564) 5.851 6.974 ( -4.672 -5.345 -2.216) 7.438 7.063 ( -0.675 -2.228 -1.343) 2.688 7.202 ( -5.452 -4.671 -2.082) 7.475 7.703 ( 0.813 -2.076 2.004) 2.997 8.016 ( 3.899 3.507 -0.219) 5.249 8.176 ( 5.687 4.315 -8.600) 11.177 8.664 ( 4.299 -1.223 -3.316) 5.565 8.840 ( 2.619 17.470 -5.358) 18.460 9.047 ( 1.546 1.376 -0.061) 2.071 9.271 ( 5.040 13.619 -4.970) 15.349 9.713 ( 5.307 -2.160 -3.101) 6.515 9.837 ( 0.942 -3.601 7.247) 8.147 9.988 ( -0.558 -8.177 0.750) 8.230 10.351 ( 0.478 0.330 -4.309) 4.348 10.578 ( -2.650 -4.228 2.236) 5.467 10.814 ( 4.480 0.544 3.715) 5.845 10.971 ( 7.208 -4.454 1.310) 8.574 11.224 ( 1.670 -3.411 4.020) 5.530 11.509 ( 12.963 -4.522 -7.440) 15.615 11.995 ( -2.576 -0.099 -0.241) 2.589 12.178 ( 4.676 -1.557 -3.514) 6.053 12.250 ( -0.617 -2.403 2.291) 3.377 13.239 ( -4.228 3.267 2.884) 6.072 13.605 ( -0.188 8.206 -4.346) 9.288 13.838 ( -1.365 5.552 -0.777) 5.770 14.171 ( -6.600 -0.160 -1.010) 6.679 14.579 ( -7.979 -9.484 1.323) 12.464 14.776 ( -17.501 -6.922 16.092) 24.762 15.630 ( -1.048 -0.538 -2.669) 2.917 16.020 ( 5.877 0.063 -5.401) 7.982 16.952 ( 9.535 0.783 13.619) 16.643 16.997 ( -12.041 0.160 -7.411) 14.140 17.355 ( 4.988 0.351 3.642) 6.186 18.916 ( -0.449 1.523 -3.764) 4.085 19.757 ( 7.405 3.468 -3.483) 8.888 ======================= Grid point 139 (71/260) ======================= q-point: ( 0.00 -0.50 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 250 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.894 ( 2.479 -0.000 15.271) 15.471 1.907 ( 4.171 0.000 14.248) 14.846 2.067 ( 2.573 -0.000 4.360) 5.062 2.536 ( 9.481 0.000 -10.631) 14.245 4.173 ( -2.996 -0.000 -5.834) 6.558 4.320 ( -5.860 0.000 13.684) 14.886 4.596 ( 7.884 0.000 10.195) 12.887 4.707 ( -0.378 0.000 5.148) 5.162 5.371 ( 3.485 0.000 1.739) 3.895 5.970 ( -2.723 -0.000 -3.979) 4.821 6.079 ( -0.607 0.000 1.230) 1.372 6.402 ( -3.371 0.000 8.996) 9.606 6.481 ( 0.297 0.000 -2.263) 2.282 6.772 ( -3.825 0.000 -10.256) 10.946 7.037 ( 1.676 -0.000 1.005) 1.955 7.067 ( -2.049 -0.000 -4.026) 4.518 7.741 ( 2.736 0.000 5.708) 6.330 8.123 ( 2.449 -0.000 1.911) 3.106 8.294 ( 5.851 -0.000 -3.118) 6.630 8.720 ( 3.903 0.000 0.885) 4.002 9.020 ( 0.405 0.000 -1.605) 1.656 9.128 ( 2.588 0.000 -6.479) 6.977 9.521 ( 3.962 0.000 -8.455) 9.337 9.720 ( 3.413 -0.000 -3.325) 4.765 9.765 ( -7.388 0.000 2.378) 7.761 9.855 ( -1.518 -0.000 8.150) 8.290 10.253 ( -2.830 0.000 -10.578) 10.950 10.478 ( -2.961 0.000 0.990) 3.122 10.982 ( 3.823 -0.000 11.327) 11.955 11.004 ( 0.269 0.000 0.262) 0.376 11.237 ( -0.744 0.000 6.739) 6.780 11.618 ( 7.841 0.000 -3.558) 8.611 11.895 ( -4.567 0.000 -5.139) 6.875 12.214 ( 2.065 -0.000 -4.608) 5.050 12.256 ( 1.607 0.000 3.934) 4.250 13.135 ( -9.749 -0.000 -5.518) 11.203 13.804 ( -2.512 0.000 -7.624) 8.027 13.841 ( 9.888 0.000 0.544) 9.903 14.106 ( -0.445 -0.000 -6.525) 6.540 14.381 ( -0.903 0.000 -1.244) 1.538 14.406 ( -17.886 -0.000 14.341) 22.926 15.663 ( 4.477 0.000 2.484) 5.120 16.075 ( 2.824 0.000 -4.687) 5.472 16.709 ( -11.017 -0.000 -8.897) 14.161 17.275 ( 10.799 -0.000 18.491) 21.414 17.465 ( 1.933 0.000 7.419) 7.667 18.966 ( 4.804 0.000 0.886) 4.885 19.778 ( -3.786 0.000 -9.131) 9.885 ======================= Grid point 141 (72/260) ======================= q-point: ( 0.10 -0.50 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 250 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.052 ( 1.759 -0.000 15.276) 15.377 2.082 ( 3.961 0.000 15.440) 15.940 2.175 ( 5.228 0.000 9.114) 10.507 2.691 ( 10.952 0.000 -4.758) 11.941 4.100 ( -0.947 0.000 -4.259) 4.363 4.301 ( -4.406 -0.000 12.965) 13.693 4.731 ( -0.863 -0.000 6.067) 6.128 4.821 ( 7.570 0.000 11.110) 13.443 5.527 ( 10.412 0.000 4.620) 11.391 5.870 ( -3.222 -0.000 -7.491) 8.155 6.011 ( -7.180 0.000 0.323) 7.187 6.340 ( -6.678 -0.000 5.894) 8.907 6.566 ( 7.723 0.000 0.644) 7.750 6.668 ( 1.035 0.000 -12.146) 12.190 7.039 ( 2.099 0.000 -5.384) 5.779 7.100 ( 3.128 -0.000 2.369) 3.923 7.844 ( 3.560 0.000 7.586) 8.379 8.167 ( 0.415 0.000 2.867) 2.897 8.388 ( 4.877 -0.000 -0.719) 4.930 8.797 ( 2.292 0.000 3.433) 4.127 8.986 ( -3.008 -0.000 -2.292) 3.782 9.155 ( 3.326 -0.000 -2.295) 4.041 9.478 ( -3.870 0.000 -7.074) 8.063 9.641 ( -4.380 0.000 -3.343) 5.511 9.718 ( -2.215 -0.000 -2.895) 3.645 9.846 ( -4.662 -0.000 9.265) 10.372 10.138 ( -1.746 0.000 -11.518) 11.650 10.472 ( 2.186 -0.000 1.556) 2.684 10.919 ( -8.265 0.000 -0.271) 8.269 11.072 ( -1.635 0.000 8.988) 9.136 11.199 ( -8.495 0.000 5.569) 10.158 11.712 ( 1.798 0.000 3.901) 4.295 11.817 ( 1.811 0.000 -6.408) 6.659 12.186 ( -1.807 -0.000 -4.380) 4.738 12.316 ( 1.277 0.000 4.747) 4.916 12.868 ( -10.979 0.000 -12.462) 16.609 13.676 ( -4.233 0.000 -5.041) 6.582 14.076 ( 1.666 0.000 -6.570) 6.778 14.115 ( 9.428 -0.000 -6.353) 11.369 14.203 ( -3.284 0.000 11.575) 12.032 14.436 ( 7.471 0.000 -2.792) 7.975 15.808 ( 7.212 0.000 5.781) 9.243 16.073 ( -0.307 -0.000 -3.758) 3.770 16.481 ( -7.402 0.000 -6.401) 9.786 17.518 ( -2.342 -0.000 10.339) 10.601 17.570 ( 7.729 0.000 16.502) 18.222 19.113 ( 8.127 0.000 4.090) 9.098 19.557 ( -10.702 -0.000 -13.130) 16.939 ======================= Grid point 143 (73/260) ======================= q-point: ( 0.20 -0.50 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 250 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.118 ( -3.044 0.000 12.026) 12.405 2.251 ( 5.066 -0.000 11.838) 12.876 2.368 ( 7.008 0.000 10.722) 12.809 2.863 ( 7.882 -0.000 -1.663) 8.055 4.087 ( 1.808 0.000 -3.394) 3.846 4.318 ( -1.777 -0.000 11.598) 11.733 4.750 ( -1.215 -0.000 7.289) 7.390 4.993 ( 3.940 0.000 7.097) 8.117 5.778 ( -0.431 -0.000 6.036) 6.052 5.787 ( -0.168 0.000 -6.587) 6.589 5.855 ( 4.160 -0.000 -2.043) 4.635 6.254 ( -5.583 -0.000 5.433) 7.790 6.667 ( 5.520 0.000 -9.396) 10.898 6.735 ( 8.927 0.000 -1.245) 9.013 7.075 ( 5.069 0.000 -5.934) 7.805 7.166 ( 1.552 0.000 3.409) 3.746 7.966 ( 3.968 0.000 7.524) 8.507 8.180 ( -0.503 0.000 2.952) 2.995 8.467 ( 3.393 -0.000 0.404) 3.417 8.833 ( -1.621 0.000 4.362) 4.653 8.865 ( -7.925 -0.000 -3.125) 8.519 9.216 ( 2.185 -0.000 2.136) 3.056 9.326 ( -6.522 0.000 -4.596) 7.979 9.523 ( -6.189 -0.000 -5.639) 8.373 9.618 ( -3.652 0.000 -6.673) 7.607 9.808 ( -4.343 -0.000 7.425) 8.602 10.052 ( -1.886 0.000 -4.452) 4.835 10.567 ( 6.133 -0.000 -0.365) 6.144 10.720 ( -11.099 -0.000 -1.055) 11.149 11.004 ( -11.863 0.000 0.685) 11.883 11.040 ( -5.048 -0.000 4.873) 7.016 11.723 ( -4.875 0.000 7.515) 8.958 11.880 ( 6.263 0.000 -2.183) 6.633 12.119 ( -2.694 0.000 -0.159) 2.699 12.356 ( -0.008 -0.000 4.275) 4.275 12.601 ( -6.146 0.000 -17.024) 18.099 13.582 ( -2.352 0.000 -5.886) 6.339 13.983 ( -9.349 0.000 5.016) 10.610 14.085 ( 2.709 -0.000 -4.890) 5.590 14.534 ( 20.926 -0.000 -2.963) 21.135 14.609 ( 11.908 0.000 -4.036) 12.573 15.987 ( 6.645 -0.000 7.167) 9.773 16.017 ( -3.406 0.000 -2.640) 4.310 16.352 ( -2.655 0.000 -3.808) 4.642 17.498 ( -6.606 -0.000 10.950) 12.788 17.764 ( 3.227 0.000 12.052) 12.477 19.258 ( -10.455 0.000 -13.331) 16.942 19.296 ( 7.192 -0.000 4.410) 8.436 ======================= Grid point 145 (74/260) ======================= q-point: ( 0.30 -0.50 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 250 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.102 ( -5.592 0.000 10.865) 12.220 2.421 ( 6.461 -0.000 5.483) 8.474 2.545 ( 5.395 0.000 6.302) 8.296 2.947 ( 1.817 -0.000 -1.675) 2.471 4.111 ( 2.296 0.000 -2.813) 3.631 4.360 ( -0.896 0.000 7.953) 8.004 4.801 ( 1.945 0.000 9.738) 9.930 5.067 ( 1.801 0.000 0.936) 2.030 5.559 ( -13.161 -0.000 -1.290) 13.224 5.790 ( 2.932 0.000 -1.799) 3.440 6.148 ( 13.994 0.000 2.942) 14.300 6.193 ( -4.253 -0.000 4.970) 6.541 6.765 ( 9.578 -0.000 -4.666) 10.654 6.854 ( 5.580 0.000 -8.387) 10.073 7.149 ( 6.395 0.000 -6.774) 9.316 7.213 ( 0.647 0.000 7.112) 7.142 8.074 ( 2.612 0.000 5.035) 5.672 8.203 ( 1.132 0.000 3.472) 3.652 8.526 ( 2.180 -0.000 -0.281) 2.198 8.660 ( -10.482 0.000 -0.798) 10.512 8.760 ( -8.337 -0.000 1.696) 8.508 9.196 ( -4.225 0.000 -4.548) 6.208 9.228 ( -2.226 -0.000 0.584) 2.302 9.323 ( -11.111 -0.000 -3.108) 11.537 9.558 ( 2.209 0.000 -5.450) 5.880 9.771 ( -3.016 0.000 3.302) 4.472 10.008 ( -2.223 -0.000 1.782) 2.849 10.509 ( -9.360 0.000 -1.087) 9.423 10.648 ( 1.973 -0.000 -2.302) 3.032 10.810 ( -7.458 0.000 -0.118) 7.459 10.991 ( -1.709 0.000 3.158) 3.590 11.630 ( -6.320 -0.000 2.154) 6.677 11.995 ( 5.452 -0.000 1.335) 5.613 12.065 ( -5.346 0.000 1.550) 5.566 12.369 ( -0.831 -0.000 2.280) 2.427 12.474 ( 3.524 0.000 -10.688) 11.254 13.504 ( -2.110 0.000 -5.479) 5.871 13.865 ( -6.394 0.000 5.936) 8.725 14.114 ( 2.686 -0.000 -2.789) 3.872 14.820 ( 12.219 0.000 -4.328) 12.963 14.901 ( 18.937 -0.000 -4.107) 19.377 15.916 ( -5.099 -0.000 -2.447) 5.655 16.134 ( 3.457 -0.000 7.638) 8.384 16.322 ( 0.519 0.000 -0.592) 0.787 17.401 ( -9.468 -0.000 8.087) 12.452 17.850 ( -0.175 0.000 7.049) 7.051 19.028 ( -5.247 0.000 -10.311) 11.569 19.422 ( 3.569 -0.000 2.013) 4.097 ======================= Grid point 147 (75/260) ======================= q-point: ( 0.40 -0.50 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 250 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.050 ( -5.911 0.000 9.003) 10.769 2.519 ( 2.260 0.000 -6.707) 7.077 2.640 ( 1.772 -0.000 1.039) 2.054 2.942 ( -0.910 0.000 1.745) 1.968 4.132 ( 1.478 0.000 -1.916) 2.420 4.366 ( -1.950 0.000 3.287) 3.822 4.958 ( 7.157 0.000 10.713) 12.884 5.091 ( 1.149 -0.000 -2.731) 2.963 5.294 ( -13.538 -0.000 -0.464) 13.546 5.857 ( 3.664 0.000 1.341) 3.902 6.146 ( -3.667 0.000 4.509) 5.812 6.351 ( 5.811 -0.000 0.422) 5.826 6.846 ( 1.823 -0.000 -14.178) 14.295 6.961 ( 10.320 0.000 -1.593) 10.442 7.229 ( 6.965 0.000 -8.063) 10.655 7.291 ( 1.349 0.000 10.872) 10.955 8.112 ( -0.501 0.000 0.965) 1.087 8.266 ( 2.845 0.000 2.682) 3.910 8.416 ( -8.236 0.000 -0.870) 8.282 8.551 ( -11.575 -0.000 -3.399) 12.064 8.638 ( 3.099 -0.000 5.453) 6.273 9.026 ( -10.580 -0.000 -7.527) 12.984 9.160 ( -2.828 0.000 -4.563) 5.369 9.160 ( -2.712 -0.000 -0.847) 2.841 9.616 ( 4.348 0.000 1.128) 4.492 9.745 ( -0.784 0.000 1.898) 2.053 9.969 ( -3.443 -0.000 2.091) 4.029 10.365 ( -4.823 -0.000 -0.360) 4.836 10.625 ( -1.217 -0.000 -4.058) 4.237 10.728 ( -2.114 0.000 2.821) 3.525 10.993 ( -1.279 0.000 3.255) 3.497 11.572 ( 1.377 -0.000 -2.513) 2.866 11.907 ( -8.656 0.000 -6.260) 10.682 12.094 ( 2.944 -0.000 3.802) 4.808 12.350 ( -1.487 0.000 -0.954) 1.767 12.600 ( 9.495 0.000 5.308) 10.878 13.441 ( -1.078 0.000 -3.504) 3.666 13.803 ( -4.307 0.000 6.706) 7.970 14.150 ( 2.135 -0.000 -0.740) 2.260 15.012 ( 9.786 0.000 -2.953) 10.222 15.197 ( 13.955 -0.000 -3.556) 14.401 15.799 ( -4.867 0.000 -3.705) 6.117 16.205 ( -1.238 -0.000 7.702) 7.800 16.350 ( 1.475 0.000 2.652) 3.035 17.251 ( -8.922 0.000 2.516) 9.270 17.853 ( -2.342 0.000 2.230) 3.234 18.933 ( 0.443 0.000 -5.795) 5.812 19.456 ( 0.029 0.000 -1.807) 1.807 ======================= Grid point 149 (76/260) ======================= q-point: (-0.50 -0.50 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 250 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.994 ( -4.811 -0.000 6.659) 8.215 2.400 ( -6.414 0.000 -15.257) 16.550 2.615 ( -3.597 0.000 -3.829) 5.254 2.952 ( 0.113 0.000 0.336) 0.355 4.152 ( 1.507 0.000 -0.632) 1.634 4.341 ( -1.757 0.000 1.430) 2.266 5.034 ( -12.110 0.000 1.006) 12.152 5.060 ( -1.988 0.000 -6.369) 6.673 5.187 ( 8.335 0.000 9.209) 12.421 5.938 ( 3.113 0.000 3.374) 4.591 6.112 ( -2.794 0.000 5.237) 5.935 6.394 ( -1.204 0.000 -0.331) 1.249 6.788 ( 1.958 0.000 -14.302) 14.435 7.029 ( -0.869 0.000 -5.503) 5.572 7.329 ( 6.401 -0.000 -5.130) 8.203 7.382 ( 0.272 0.000 11.923) 11.926 8.087 ( -2.592 0.000 0.185) 2.599 8.227 ( -9.397 -0.000 -5.264) 10.771 8.345 ( 1.802 0.000 1.690) 2.471 8.414 ( 3.217 0.000 -2.878) 4.316 8.665 ( -7.611 0.000 0.393) 7.621 8.870 ( 4.626 0.000 -4.444) 6.415 9.081 ( -1.173 0.000 -7.212) 7.307 9.144 ( 0.918 -0.000 -0.146) 0.930 9.714 ( 3.048 0.000 4.963) 5.824 9.777 ( 2.367 -0.000 3.119) 3.916 9.906 ( -2.645 0.000 -0.735) 2.745 10.325 ( 0.607 -0.000 0.511) 0.794 10.579 ( 0.045 0.000 -5.700) 5.700 10.750 ( 1.194 -0.000 5.903) 6.022 10.975 ( -2.021 0.000 2.357) 3.105 11.639 ( 7.076 0.000 -8.794) 11.287 11.684 ( -9.605 0.000 -3.815) 10.335 12.149 ( -0.347 0.000 4.946) 4.958 12.306 ( -1.370 0.000 -3.499) 3.757 12.847 ( 8.588 0.000 14.518) 16.868 13.435 ( 2.241 0.000 -1.244) 2.563 13.776 ( -2.873 0.000 6.442) 7.054 14.185 ( 1.370 0.000 1.002) 1.698 15.139 ( 3.424 0.000 0.360) 3.443 15.385 ( 6.800 0.000 -1.003) 6.873 15.700 ( -1.312 0.000 -6.555) 6.685 16.177 ( -6.435 -0.000 6.935) 9.461 16.404 ( 1.447 0.000 5.296) 5.490 17.114 ( -4.456 0.000 -3.079) 5.416 17.793 ( -3.816 0.000 -2.111) 4.361 18.965 ( 4.985 0.000 -1.500) 5.206 19.408 ( -2.401 0.000 -5.797) 6.275 ======================= Grid point 151 (77/260) ======================= q-point: (-0.40 -0.50 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 250 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.952 ( -3.057 -0.000 4.427) 5.380 2.142 ( -8.854 0.000 -16.198) 18.460 2.459 ( -8.613 0.000 -7.396) 11.353 2.902 ( -3.429 0.000 -7.931) 8.641 4.180 ( 1.319 0.000 0.450) 1.394 4.325 ( -1.119 0.000 2.580) 2.812 4.833 ( -9.754 -0.000 4.209) 10.623 4.929 ( -5.728 0.000 -10.991) 12.394 5.395 ( 8.172 -0.000 4.141) 9.162 6.019 ( 2.904 0.000 3.089) 4.240 6.108 ( -2.070 -0.000 9.458) 9.682 6.290 ( -9.168 0.000 -0.845) 9.207 6.749 ( 2.298 0.000 -12.050) 12.267 6.959 ( -1.485 -0.000 -2.448) 2.864 7.371 ( 0.458 -0.000 -2.468) 2.510 7.424 ( -4.622 0.000 12.022) 12.879 7.994 ( -6.878 -0.000 -0.337) 6.886 8.015 ( -5.238 0.000 -10.158) 11.429 8.396 ( -2.826 0.000 -8.097) 8.576 8.487 ( 5.478 0.000 -5.157) 7.523 8.571 ( 7.564 0.000 -0.573) 7.585 9.030 ( 9.389 0.000 -0.097) 9.389 9.038 ( 1.720 0.000 -7.673) 7.863 9.201 ( 4.904 -0.000 3.415) 5.976 9.729 ( -3.471 0.000 0.647) 3.530 9.856 ( 2.794 -0.000 4.199) 5.044 9.936 ( 5.700 0.000 2.727) 6.318 10.392 ( 5.689 0.000 0.938) 5.766 10.566 ( 2.457 0.000 -6.244) 6.710 10.835 ( 3.248 -0.000 7.072) 7.783 10.951 ( -1.680 0.000 0.712) 1.825 11.452 ( -6.805 0.000 -11.900) 13.708 11.764 ( 6.968 0.000 -1.446) 7.117 12.136 ( -3.011 0.000 2.276) 3.775 12.271 ( -0.656 -0.000 -1.273) 1.432 13.077 ( 3.917 0.000 19.004) 19.404 13.512 ( 5.874 0.000 -0.229) 5.878 13.773 ( -1.077 -0.000 5.078) 5.191 14.213 ( 0.478 0.000 2.122) 2.175 15.116 ( -6.857 0.000 2.586) 7.329 15.435 ( -3.036 0.000 4.504) 5.432 15.697 ( 5.858 0.000 -8.408) 10.247 16.048 ( -9.834 -0.000 3.145) 10.325 16.473 ( 1.669 0.000 7.553) 7.736 17.059 ( 1.811 0.000 -5.677) 5.958 17.681 ( -5.315 0.000 -5.787) 7.857 19.103 ( 9.122 0.000 1.926) 9.323 19.299 ( -3.948 0.000 -8.839) 9.681 ======================= Grid point 153 (78/260) ======================= q-point: (-0.30 -0.50 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 250 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.898 ( -5.952 -0.000 -13.854) 15.078 1.933 ( -1.532 0.000 3.310) 3.647 2.217 ( -10.514 0.000 -8.448) 13.488 2.734 ( -6.061 -0.000 -13.462) 14.764 4.206 ( 0.738 -0.000 1.647) 1.805 4.330 ( -1.247 0.000 5.900) 6.030 4.718 ( -5.237 -0.000 4.893) 7.167 4.726 ( -6.733 0.000 -13.518) 15.102 5.527 ( 3.901 -0.000 -2.067) 4.415 6.052 ( 0.023 0.000 -0.870) 0.871 6.083 ( -10.310 0.000 1.913) 10.486 6.179 ( 1.094 0.000 15.349) 15.388 6.712 ( 0.259 0.000 -8.969) 8.973 6.962 ( 0.787 -0.000 3.007) 3.108 7.329 ( -4.552 -5.528 0.019) 7.160 7.329 ( -9.358 5.528 5.954) 12.392 7.838 ( -7.956 -0.000 -1.393) 8.077 7.939 ( 3.056 0.000 -8.789) 9.305 8.269 ( -1.374 0.000 -12.097) 12.175 8.550 ( 5.061 -0.000 -7.046) 8.676 8.780 ( 10.604 0.000 -0.286) 10.607 9.049 ( 3.917 0.000 -7.223) 8.216 9.170 ( 7.459 -0.000 -3.456) 8.221 9.395 ( 9.899 -0.000 8.037) 12.751 9.659 ( -2.192 0.000 -2.464) 3.298 9.917 ( 0.350 0.000 4.792) 4.805 10.106 ( 8.752 -0.000 4.736) 9.951 10.542 ( 8.987 0.000 0.446) 8.998 10.582 ( 2.263 0.000 -5.213) 5.683 10.902 ( -3.709 -0.000 -0.536) 3.747 10.955 ( 4.676 0.000 6.247) 7.803 11.305 ( 0.147 -0.000 -11.958) 11.959 11.895 ( 7.756 0.000 -1.705) 7.942 12.085 ( -2.776 0.000 0.788) 2.886 12.254 ( -1.263 -0.000 1.122) 1.690 13.222 ( -0.577 -0.000 17.519) 17.528 13.628 ( 5.227 0.000 -0.017) 5.227 13.804 ( 1.756 -0.000 3.465) 3.885 14.226 ( -0.578 0.000 2.083) 2.162 14.937 ( -12.242 0.000 1.705) 12.360 15.313 ( -15.119 0.000 12.710) 19.752 15.795 ( 8.687 0.000 -7.454) 11.447 15.865 ( -8.247 -0.000 -3.634) 9.012 16.569 ( 2.972 0.000 9.987) 10.420 17.109 ( 6.178 0.000 -4.362) 7.563 17.514 ( -7.479 0.000 -8.674) 11.453 19.155 ( -4.726 0.000 -9.827) 10.904 19.332 ( 12.515 0.000 3.675) 13.044 ======================= Grid point 155 (79/260) ======================= q-point: (-0.20 -0.50 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 250 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.764 ( -0.897 0.000 -7.243) 7.299 1.908 ( -5.391 -0.000 3.852) 6.626 2.012 ( -3.365 -0.000 -5.008) 6.034 2.550 ( -2.891 -0.000 -14.216) 14.507 4.238 ( 1.320 -0.000 2.770) 3.069 4.343 ( -2.580 0.000 9.739) 10.075 4.528 ( -5.061 0.000 -11.454) 12.523 4.681 ( -1.909 -0.000 4.289) 4.694 5.489 ( -4.650 -0.000 -5.010) 6.835 5.995 ( -0.829 0.000 4.303) 4.382 6.036 ( -0.981 0.000 -0.282) 1.021 6.302 ( 1.707 0.000 13.328) 13.437 6.638 ( -3.243 0.000 -5.482) 6.370 6.981 ( -1.818 -0.000 2.583) 3.158 7.158 ( -9.021 0.000 2.706) 9.418 7.246 ( -3.997 0.000 -2.106) 4.518 7.707 ( -4.253 -0.000 -0.573) 4.292 7.983 ( 5.004 -0.000 -4.663) 6.840 8.205 ( 2.179 -0.000 -10.928) 11.143 8.598 ( 4.337 0.000 -6.313) 7.660 8.931 ( 5.568 0.000 -1.111) 5.678 9.088 ( 4.315 0.000 -6.864) 8.107 9.311 ( 9.523 -0.000 -4.623) 10.586 9.625 ( 7.868 -0.000 8.421) 11.525 9.631 ( 1.422 0.000 -3.850) 4.104 9.924 ( -2.715 0.000 5.015) 5.703 10.301 ( 8.096 -0.000 1.523) 8.238 10.567 ( -2.183 0.000 0.361) 2.213 10.729 ( 10.026 0.000 -0.176) 10.027 10.821 ( -2.608 0.000 -1.961) 3.263 11.083 ( 4.612 -0.000 5.044) 6.834 11.322 ( 8.340 -0.000 -10.439) 13.362 12.038 ( 8.187 0.000 -2.489) 8.557 12.044 ( -2.321 0.000 1.234) 2.628 12.235 ( -1.448 -0.000 1.467) 2.061 13.282 ( -2.175 -0.000 11.489) 11.693 13.684 ( 0.898 0.000 -0.850) 1.237 13.878 ( 3.489 -0.000 1.149) 3.673 14.212 ( -1.701 0.000 0.173) 1.710 14.697 ( -12.673 0.000 0.568) 12.686 15.032 ( -23.016 -0.000 18.132) 29.300 15.706 ( -4.694 -0.000 -6.179) 7.760 15.919 ( 8.207 0.000 -6.280) 10.335 16.722 ( 5.796 0.000 13.009) 14.242 17.226 ( 7.180 -0.000 -0.819) 7.227 17.283 ( -10.278 0.000 -10.438) 14.649 19.012 ( -3.813 0.000 -7.974) 8.838 19.601 ( 12.420 -0.000 2.258) 12.624 ======================= Grid point 157 (80/260) ======================= q-point: (-0.10 -0.50 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 250 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.775 ( 2.771 0.000 4.330) 5.141 1.827 ( -3.596 -0.000 7.862) 8.645 2.008 ( 1.692 -0.000 1.166) 2.055 2.476 ( 4.158 -0.000 -13.330) 13.964 4.258 ( -1.032 -0.000 -3.820) 3.957 4.343 ( -4.779 0.000 12.708) 13.576 4.444 ( 1.909 0.000 1.769) 2.602 4.686 ( -0.580 -0.000 4.396) 4.434 5.373 ( -3.346 -0.000 -1.859) 3.828 6.016 ( -0.912 -0.000 -0.892) 1.276 6.044 ( 2.378 0.000 2.195) 3.236 6.387 ( -0.943 0.000 10.030) 10.075 6.537 ( -3.784 0.000 -2.585) 4.582 6.907 ( -4.683 -0.000 -4.505) 6.498 7.045 ( -3.279 0.000 0.336) 3.296 7.154 ( -4.345 0.000 -1.939) 4.757 7.679 ( 0.572 0.000 2.460) 2.526 8.056 ( 4.097 -0.000 -0.852) 4.185 8.218 ( 4.867 -0.000 -7.123) 8.627 8.648 ( 4.116 0.000 -3.073) 5.137 8.999 ( 2.669 0.000 -1.363) 2.997 9.118 ( 3.256 0.000 -7.270) 7.966 9.451 ( 7.887 0.000 -6.469) 10.200 9.663 ( 4.246 -0.000 -4.349) 6.078 9.785 ( 3.147 -0.000 8.284) 8.861 9.875 ( -5.374 -0.000 4.220) 6.833 10.357 ( -0.713 0.000 -7.590) 7.623 10.531 ( -3.081 0.000 3.486) 4.653 10.836 ( 3.693 -0.000 5.870) 6.935 10.910 ( 8.220 0.000 -0.016) 8.220 11.184 ( 2.356 -0.000 5.268) 5.771 11.463 ( 11.240 -0.000 -8.020) 13.808 11.996 ( -3.423 0.000 -0.659) 3.486 12.161 ( 6.048 0.000 -3.694) 7.087 12.224 ( -0.447 0.000 2.259) 2.303 13.277 ( -4.111 -0.000 3.460) 5.373 13.695 ( 3.215 0.000 -2.290) 3.947 13.905 ( -1.117 -0.000 -2.333) 2.587 14.164 ( -1.989 -0.000 -3.514) 4.038 14.484 ( -8.785 0.000 -0.255) 8.788 14.695 ( -22.809 -0.000 18.643) 29.459 15.624 ( -0.474 -0.000 -2.699) 2.740 16.021 ( 5.948 0.000 -5.374) 8.016 16.960 ( 9.189 0.000 13.709) 16.504 16.999 ( -11.782 0.000 -7.703) 14.077 17.358 ( 5.417 0.000 3.415) 6.403 18.932 ( -0.253 0.000 -3.779) 3.788 19.791 ( 6.219 0.000 -2.806) 6.823 ======================= Grid point 189 (81/260) ======================= q-point: ( 0.00 0.00 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 260 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.939 ( -14.047 0.000 22.139) 26.220 1.058 ( 10.907 0.000 24.304) 26.639 2.058 ( -6.440 0.000 44.108) 44.576 2.938 ( 1.517 0.000 4.158) 4.426 4.032 ( 0.283 0.000 -9.608) 9.613 4.485 ( 21.951 0.000 9.505) 23.920 4.500 ( 2.229 0.000 6.258) 6.643 4.782 ( 5.085 0.000 -8.005) 9.483 5.718 ( 9.953 0.000 2.444) 10.249 5.947 ( -0.951 0.000 -0.574) 1.111 6.185 ( -0.821 0.000 8.352) 8.392 6.228 ( -2.894 0.000 -1.214) 3.138 6.442 ( -10.792 0.000 10.341) 14.947 6.885 ( -0.450 0.000 -6.247) 6.263 7.240 ( -1.374 0.000 0.886) 1.635 7.385 ( -4.439 0.000 -5.706) 7.229 7.487 ( 6.570 0.000 -8.399) 10.664 7.787 ( 5.343 0.000 0.729) 5.393 7.851 ( 8.237 0.000 1.178) 8.321 8.387 ( -3.772 0.000 4.880) 6.168 8.393 ( 10.694 0.000 2.550) 10.994 8.841 ( 8.661 0.000 -2.876) 9.126 9.147 ( -2.633 0.000 2.828) 3.864 9.792 ( -4.729 0.000 -0.496) 4.755 10.006 ( 0.640 0.000 -8.677) 8.701 10.131 ( 6.360 0.000 -6.255) 8.920 10.417 ( -6.228 0.000 -4.228) 7.528 10.641 ( -4.972 0.000 -7.169) 8.725 11.050 ( 2.919 0.000 -2.631) 3.930 11.226 ( -2.398 0.000 1.771) 2.982 11.647 ( -3.958 0.000 5.756) 6.985 11.706 ( 6.331 0.000 -6.444) 9.033 12.048 ( -4.442 0.000 5.886) 7.374 12.152 ( -3.851 0.000 -10.480) 11.165 12.267 ( 0.750 0.000 -0.269) 0.797 12.851 ( -4.047 0.000 1.009) 4.170 13.209 ( 0.534 0.000 -10.511) 10.525 13.511 ( 3.238 0.000 7.949) 8.584 14.006 ( -10.637 0.000 5.298) 11.883 14.967 ( -3.923 0.000 -6.036) 7.199 15.538 ( 3.945 0.000 1.887) 4.373 15.571 ( -20.550 0.000 -2.446) 20.696 15.896 ( -3.669 0.000 -1.174) 3.852 16.156 ( -4.991 0.000 -0.023) 4.992 17.486 ( 6.414 0.000 8.115) 10.344 18.412 ( -5.579 0.000 9.843) 11.314 18.722 ( -0.761 0.000 -5.296) 5.351 19.263 ( 24.888 0.000 -1.968) 24.966 ======================= Grid point 190 (82/260) ======================= q-point: ( 0.10 0.00 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 250 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.975 ( 3.644 0.000 21.644) 21.948 1.504 ( 17.423 0.000 19.776) 26.356 2.270 ( 2.252 0.000 35.880) 35.951 2.993 ( 1.923 0.000 2.387) 3.065 3.970 ( -0.722 0.000 -8.210) 8.242 4.541 ( -1.841 0.000 4.775) 5.118 4.871 ( 8.591 0.000 -6.377) 10.699 4.941 ( 18.044 0.000 7.558) 19.563 5.882 ( 2.778 0.000 7.883) 8.358 5.942 ( 0.966 0.000 -0.909) 1.326 6.159 ( -2.676 0.000 -1.787) 3.218 6.232 ( 0.210 0.000 8.152) 8.155 6.340 ( -4.961 0.000 8.728) 10.040 6.830 ( -0.836 0.000 -7.489) 7.536 7.187 ( -3.557 0.000 0.675) 3.620 7.243 ( -6.480 0.000 -4.530) 7.906 7.575 ( 7.217 0.000 -10.772) 12.966 7.891 ( 5.663 0.000 -1.549) 5.871 8.010 ( 6.747 0.000 -0.443) 6.762 8.318 ( -5.751 0.000 4.508) 7.308 8.641 ( 11.787 0.000 4.746) 12.706 8.993 ( 7.613 0.000 -1.009) 7.679 9.104 ( -2.749 0.000 1.197) 2.998 9.697 ( -5.324 0.000 0.661) 5.365 9.946 ( -0.562 0.000 -9.672) 9.689 10.103 ( -4.488 0.000 -4.358) 6.255 10.375 ( 3.301 0.000 -3.244) 4.628 10.419 ( -12.597 0.000 -2.355) 12.815 10.969 ( -9.857 0.000 1.346) 9.948 11.104 ( -9.614 0.000 0.808) 9.648 11.314 ( -26.342 0.000 9.323) 27.943 11.810 ( 7.871 0.000 -8.347) 11.473 11.837 ( -4.402 0.000 0.958) 4.505 12.212 ( -6.556 0.000 2.893) 7.166 12.507 ( 25.689 0.000 -10.886) 27.900 12.871 ( 5.733 0.000 -7.915) 9.773 13.166 ( 1.138 0.000 -0.815) 1.400 13.654 ( 0.516 0.000 7.059) 7.078 13.994 ( 6.677 0.000 11.827) 13.582 14.849 ( -3.979 0.000 -8.840) 9.694 15.094 ( -20.258 0.000 -2.011) 20.358 15.651 ( 6.261 0.000 3.762) 7.304 16.025 ( 8.061 0.000 2.859) 8.553 16.072 ( -3.197 0.000 -1.917) 3.727 17.640 ( 3.283 0.000 10.365) 10.873 18.331 ( -8.327 0.000 7.587) 11.265 18.660 ( -1.492 0.000 -7.651) 7.795 19.508 ( 5.857 0.000 -4.682) 7.499 ======================= Grid point 191 (83/260) ======================= q-point: ( 0.20 0.00 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 260 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.286 ( 13.921 0.000 17.549) 22.400 1.891 ( 9.126 0.000 20.617) 22.546 2.565 ( 9.112 0.000 20.142) 22.107 3.028 ( 0.352 0.000 0.619) 0.712 3.910 ( -1.027 0.000 -5.401) 5.498 4.494 ( -4.880 0.000 1.848) 5.218 5.013 ( 9.457 0.000 -5.564) 10.973 5.233 ( 8.128 0.000 3.374) 8.801 5.883 ( -9.788 0.000 15.006) 17.916 5.979 ( 3.595 0.000 -1.009) 3.734 6.166 ( 5.846 0.000 -2.201) 6.246 6.284 ( 0.476 0.000 5.578) 5.598 6.356 ( 1.654 0.000 4.489) 4.784 6.753 ( -2.413 0.000 -8.664) 8.994 7.096 ( -6.061 0.000 -2.038) 6.394 7.133 ( -2.234 0.000 1.149) 2.512 7.611 ( 2.399 0.000 -8.132) 8.479 7.987 ( 6.108 0.000 -3.926) 7.261 8.081 ( 2.393 0.000 -4.297) 4.918 8.245 ( -4.312 0.000 3.886) 5.804 8.858 ( 6.971 0.000 1.806) 7.201 9.069 ( -1.109 0.000 0.016) 1.109 9.086 ( 2.335 0.000 -1.680) 2.877 9.564 ( -10.530 0.000 2.664) 10.862 9.864 ( -0.306 0.000 -10.325) 10.329 10.040 ( -0.518 0.000 0.802) 0.955 10.216 ( -8.199 0.000 6.321) 10.352 10.414 ( 2.007 0.000 -1.262) 2.371 10.776 ( -10.169 0.000 2.487) 10.469 10.895 ( -20.635 0.000 4.669) 21.157 10.926 ( -7.980 0.000 0.232) 7.984 11.814 ( -1.695 0.000 3.408) 3.806 11.825 ( -1.476 0.000 -13.032) 13.115 12.131 ( -3.333 0.000 7.721) 8.410 12.857 ( 0.316 0.000 -11.941) 11.945 12.873 ( 18.325 0.000 -8.372) 20.147 13.337 ( 13.178 0.000 7.158) 14.996 13.634 ( -4.559 0.000 6.761) 8.154 14.309 ( 15.764 0.000 6.769) 17.156 14.693 ( -5.879 0.000 -10.805) 12.301 14.802 ( -8.920 0.000 -0.828) 8.958 15.823 ( 7.736 0.000 5.927) 9.746 16.012 ( -0.578 0.000 -4.091) 4.132 16.171 ( 4.731 0.000 3.154) 5.686 17.719 ( -3.101 0.000 11.759) 12.161 18.205 ( -7.459 0.000 3.658) 8.307 18.573 ( -1.348 0.000 -11.042) 11.124 19.520 ( -0.795 0.000 -3.455) 3.546 ======================= Grid point 192 (84/260) ======================= q-point: ( 0.30 0.00 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 250 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.667 ( 14.199 0.000 14.284) 20.140 2.120 ( 1.500 0.000 21.591) 21.643 2.813 ( 6.905 0.000 6.119) 9.227 3.001 ( -3.203 0.000 -0.835) 3.310 3.867 ( -0.807 0.000 -2.341) 2.476 4.390 ( -5.912 0.000 -0.546) 5.937 5.157 ( 9.190 0.000 -6.274) 11.128 5.287 ( -1.357 0.000 -5.639) 5.800 5.762 ( -11.768 0.000 16.586) 20.337 6.068 ( 5.722 0.000 0.545) 5.748 6.302 ( 7.281 0.000 -0.471) 7.297 6.305 ( -0.401 0.000 -1.224) 1.288 6.448 ( 5.121 0.000 3.739) 6.341 6.622 ( -5.043 0.000 -7.762) 9.256 7.008 ( -2.711 0.000 0.957) 2.875 7.128 ( 0.531 0.000 3.113) 3.158 7.564 ( -2.991 0.000 -4.427) 5.342 8.072 ( 1.335 0.000 -8.670) 8.772 8.078 ( 6.592 0.000 -6.257) 9.088 8.196 ( -3.302 0.000 3.276) 4.651 8.871 ( -5.111 0.000 -2.981) 5.917 9.062 ( 0.319 0.000 0.006) 0.319 9.073 ( -0.371 0.000 -8.205) 8.214 9.330 ( -13.924 0.000 1.746) 14.034 9.862 ( 4.019 0.000 -2.069) 4.520 10.032 ( -1.246 0.000 -1.081) 1.650 10.149 ( -8.090 0.000 12.136) 14.585 10.477 ( 4.480 0.000 4.095) 6.069 10.598 ( -6.230 0.000 -0.786) 6.279 10.664 ( -7.191 0.000 7.816) 10.621 10.825 ( -2.485 0.000 -0.310) 2.504 11.623 ( -8.832 0.000 -13.848) 16.425 11.784 ( -3.552 0.000 3.369) 4.896 12.152 ( -0.664 0.000 7.318) 7.348 12.809 ( 1.379 0.000 -6.537) 6.680 13.111 ( 10.321 0.000 -3.821) 11.005 13.596 ( -3.693 0.000 7.304) 8.185 13.672 ( 15.240 0.000 6.441) 16.545 14.500 ( -6.460 0.000 -10.234) 12.102 14.534 ( 2.540 0.000 -0.325) 2.560 14.816 ( 11.782 0.000 2.300) 12.005 15.909 ( -1.172 0.000 -1.395) 1.822 16.095 ( 10.009 0.000 2.788) 10.390 16.241 ( 0.125 0.000 4.375) 4.377 17.635 ( -12.274 0.000 9.077) 15.266 18.131 ( -1.758 0.000 2.244) 2.851 18.477 ( -0.185 0.000 -14.964) 14.966 19.458 ( -2.962 0.000 -4.142) 5.092 ======================= Grid point 193 (85/260) ======================= q-point: ( 0.40 0.00 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 260 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.972 ( 8.141 0.000 12.082) 14.569 2.228 ( -3.978 0.000 20.798) 21.175 2.881 ( -0.788 0.000 -3.168) 3.264 2.906 ( -5.050 0.000 -1.995) 5.430 3.857 ( 0.609 0.000 0.015) 0.609 4.274 ( -4.881 0.000 -2.191) 5.350 5.142 ( -7.079 0.000 -12.364) 14.247 5.280 ( 7.497 0.000 -7.544) 10.636 5.647 ( -10.911 0.000 15.998) 19.365 6.157 ( -3.397 0.000 1.395) 3.672 6.254 ( 4.691 0.000 -8.765) 9.941 6.420 ( 5.608 0.000 -1.203) 5.735 6.530 ( -0.646 0.000 -1.948) 2.052 6.558 ( 2.450 0.000 3.538) 4.304 6.987 ( -0.934 0.000 2.247) 2.433 7.189 ( 2.142 0.000 5.998) 6.369 7.464 ( -3.621 0.000 -3.722) 5.193 8.030 ( 0.640 0.000 -11.050) 11.069 8.149 ( -3.743 0.000 2.557) 4.533 8.163 ( 6.916 0.000 -8.676) 11.095 8.688 ( -9.481 0.000 -6.193) 11.324 8.963 ( -3.734 0.000 -13.372) 13.883 9.077 ( 0.831 0.000 0.772) 1.135 9.112 ( -8.310 0.000 1.907) 8.526 9.888 ( -3.038 0.000 -0.268) 3.050 10.002 ( -11.630 0.000 9.109) 14.773 10.052 ( 5.613 0.000 -0.347) 5.623 10.541 ( -3.190 0.000 3.280) 4.576 10.596 ( 2.525 0.000 6.317) 6.803 10.731 ( 7.644 0.000 12.275) 14.460 10.827 ( 2.194 0.000 1.565) 2.695 11.372 ( -6.258 0.000 -15.059) 16.308 11.730 ( -3.591 0.000 2.436) 4.339 12.192 ( 0.345 0.000 7.812) 7.819 12.823 ( 2.860 0.000 -4.058) 4.965 13.223 ( 2.618 0.000 -0.261) 2.631 13.587 ( -2.042 0.000 7.696) 7.962 13.890 ( 1.822 0.000 -1.007) 2.082 14.414 ( 4.912 0.000 -0.929) 4.999 14.533 ( -0.150 0.000 -1.047) 1.057 15.117 ( 15.938 0.000 0.198) 15.939 15.852 ( -2.283 0.000 -4.785) 5.302 16.240 ( -3.451 0.000 6.811) 7.635 16.322 ( 9.855 0.000 5.704) 11.387 17.399 ( -15.255 0.000 3.738) 15.706 18.144 ( 0.704 0.000 3.357) 3.430 18.382 ( 1.197 0.000 -18.627) 18.665 19.358 ( -4.092 0.000 -5.866) 7.152 ======================= Grid point 194 (86/260) ======================= q-point: (-0.50 0.00 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 250 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.103 ( -2.368 0.000 10.837) 11.093 2.214 ( -10.648 0.000 18.426) 21.282 2.770 ( -6.498 0.000 -6.636) 9.288 2.814 ( -2.324 0.000 -2.562) 3.459 3.891 ( 2.572 0.000 0.882) 2.720 4.189 ( -2.105 0.000 -2.875) 3.563 4.888 ( -9.893 0.000 -15.024) 17.989 5.318 ( 1.092 0.000 -9.781) 9.842 5.532 ( -10.505 0.000 13.226) 16.891 6.015 ( -4.542 0.000 -4.605) 6.468 6.377 ( 6.065 0.000 -0.604) 6.095 6.455 ( -3.348 0.000 -1.445) 3.647 6.550 ( 3.490 0.000 0.234) 3.497 6.603 ( 2.758 0.000 2.317) 3.602 6.988 ( -0.334 0.000 1.712) 1.745 7.223 ( -3.567 0.000 5.692) 6.717 7.440 ( 4.158 0.000 -3.125) 5.201 7.965 ( -0.187 0.000 -10.608) 10.610 8.089 ( -3.317 0.000 2.026) 3.887 8.225 ( 5.094 0.000 -11.169) 12.276 8.468 ( -7.775 0.000 -8.613) 11.604 8.791 ( -4.402 0.000 -13.699) 14.389 9.055 ( -0.023 0.000 4.926) 4.926 9.112 ( 1.683 0.000 2.766) 3.238 9.804 ( -3.876 0.000 -2.565) 4.648 9.891 ( -4.248 0.000 7.253) 8.406 10.153 ( 3.886 0.000 -1.661) 4.226 10.518 ( -1.182 0.000 3.453) 3.649 10.656 ( 1.627 0.000 5.055) 5.310 10.853 ( -3.303 0.000 4.270) 5.399 11.014 ( 10.967 0.000 16.111) 19.489 11.271 ( 5.414 0.000 -12.169) 13.319 11.686 ( -1.998 0.000 1.401) 2.440 12.263 ( 1.910 0.000 6.411) 6.689 12.852 ( 3.340 0.000 -5.277) 6.245 13.209 ( -4.340 0.000 1.564) 4.614 13.613 ( -0.306 0.000 7.677) 7.683 13.772 ( -8.290 0.000 -4.273) 9.326 14.526 ( 0.091 0.000 -1.283) 1.286 14.641 ( 12.977 0.000 6.411) 14.474 15.397 ( 13.531 0.000 -2.654) 13.789 15.761 ( -3.785 0.000 -5.812) 6.936 16.214 ( -4.309 0.000 11.251) 12.048 16.530 ( 7.362 0.000 7.228) 10.317 17.126 ( -13.364 0.000 -0.658) 13.380 18.189 ( 1.415 0.000 4.200) 4.432 18.289 ( 1.978 0.000 -21.516) 21.607 19.229 ( -4.928 0.000 -7.535) 9.003 ======================= Grid point 195 (87/260) ======================= q-point: (-0.40 0.00 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 260 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.026 ( -11.851 0.000 11.032) 16.191 2.031 ( -17.997 0.000 12.045) 21.656 2.583 ( -10.455 0.000 0.186) 10.457 2.788 ( 0.727 0.000 -2.095) 2.218 3.957 ( 3.652 0.000 -0.121) 3.654 4.163 ( 1.168 0.000 -2.382) 2.653 4.589 ( -11.305 0.000 -14.447) 18.345 5.199 ( -5.528 0.000 -11.347) 12.622 5.409 ( -9.135 0.000 8.993) 12.819 5.974 ( 1.372 0.000 -1.112) 1.766 6.322 ( -7.486 0.000 0.019) 7.486 6.399 ( -3.334 0.000 0.868) 3.445 6.677 ( 1.937 0.000 2.481) 3.148 6.693 ( 9.343 0.000 1.929) 9.540 7.002 ( 1.729 0.000 -0.154) 1.736 7.170 ( -2.591 0.000 1.285) 2.892 7.528 ( 5.026 0.000 -1.863) 5.361 7.887 ( -2.312 0.000 -8.003) 8.330 8.079 ( 1.500 0.000 2.363) 2.798 8.166 ( -4.351 0.000 -10.652) 11.507 8.317 ( -1.335 0.000 -12.519) 12.590 8.667 ( 0.481 0.000 -11.623) 11.633 9.100 ( 0.396 0.000 4.165) 4.184 9.229 ( 7.407 0.000 9.679) 12.188 9.719 ( -2.344 0.000 -4.296) 4.893 9.931 ( 3.123 0.000 7.369) 8.003 10.177 ( 1.666 0.000 -5.038) 5.306 10.536 ( 0.925 0.000 2.695) 2.850 10.746 ( 3.909 0.000 5.351) 6.626 10.791 ( -3.438 0.000 1.793) 3.878 11.306 ( 8.268 0.000 14.034) 16.288 11.365 ( 8.072 0.000 -5.285) 9.649 11.683 ( 1.150 0.000 2.748) 2.979 12.306 ( -0.412 0.000 0.193) 0.455 12.911 ( 7.040 0.000 -5.870) 9.166 13.081 ( -9.855 0.000 2.052) 10.066 13.590 ( -8.854 0.000 -0.239) 8.857 13.664 ( 0.688 0.000 7.073) 7.106 14.519 ( 0.431 0.000 -2.789) 2.822 14.920 ( 11.160 0.000 6.816) 13.077 15.587 ( 8.649 0.000 -7.195) 11.250 15.632 ( -5.828 0.000 -6.039) 8.393 16.254 ( -0.147 0.000 19.815) 19.815 16.667 ( -1.136 0.000 10.631) 10.692 16.917 ( -3.913 0.000 -5.535) 6.778 18.183 ( 1.340 0.000 -23.888) 23.926 18.249 ( 1.792 0.000 5.285) 5.581 19.079 ( -5.401 0.000 -8.265) 9.873 ======================= Grid point 196 (88/260) ======================= q-point: (-0.30 0.00 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 250 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.695 ( -22.283 0.000 6.776) 23.291 1.811 ( -17.765 0.000 12.967) 21.995 2.364 ( -17.138 0.000 14.718) 22.591 2.802 ( 1.342 0.000 -0.388) 1.397 4.012 ( 2.502 0.000 -3.243) 4.096 4.201 ( 3.645 0.000 -0.599) 3.694 4.296 ( -10.132 0.000 -10.233) 14.401 5.013 ( -5.811 0.000 -10.686) 12.164 5.320 ( -3.519 0.000 4.430) 5.657 6.012 ( 1.841 0.000 0.386) 1.881 6.226 ( -3.054 0.000 3.121) 4.367 6.300 ( -7.317 0.000 3.126) 7.957 6.687 ( -2.904 0.000 4.534) 5.384 6.864 ( 5.818 0.000 1.089) 5.920 7.083 ( 7.867 0.000 -0.717) 7.899 7.164 ( 2.064 0.000 -2.727) 3.420 7.591 ( 3.163 0.000 -2.898) 4.290 7.773 ( -4.977 0.000 -5.782) 7.629 7.990 ( -6.395 0.000 -9.429) 11.393 8.171 ( 5.328 0.000 3.841) 6.568 8.221 ( -0.634 0.000 -11.403) 11.421 8.649 ( 3.867 0.000 -11.098) 11.752 9.126 ( -0.037 0.000 3.932) 3.932 9.496 ( 12.151 0.000 13.244) 17.973 9.686 ( 2.567 0.000 -4.950) 5.576 10.073 ( 5.253 0.000 10.319) 11.579 10.175 ( 2.132 0.000 -7.466) 7.764 10.590 ( 3.772 0.000 1.070) 3.921 10.738 ( -2.861 0.000 1.766) 3.362 10.876 ( 6.068 0.000 2.698) 6.641 11.445 ( 0.492 0.000 2.817) 2.860 11.487 ( 6.514 0.000 -1.194) 6.622 11.810 ( 7.134 0.000 12.376) 14.285 12.259 ( -1.829 0.000 -5.316) 5.622 12.865 ( -13.426 0.000 1.445) 13.504 13.042 ( 9.237 0.000 -5.630) 10.818 13.421 ( -9.555 0.000 1.743) 9.713 13.712 ( -0.395 0.000 5.928) 5.941 14.508 ( 1.497 0.000 -7.284) 7.436 15.140 ( 7.096 0.000 6.060) 9.332 15.472 ( -6.266 0.000 -5.994) 8.671 15.627 ( 1.545 0.000 -10.053) 10.171 16.500 ( 10.432 0.000 27.749) 29.645 16.571 ( -10.576 0.000 5.670) 12.000 16.964 ( 7.449 0.000 -0.750) 7.486 18.029 ( -1.851 0.000 -24.789) 24.858 18.320 ( 1.496 0.000 6.892) 7.053 18.930 ( -4.721 0.000 -7.205) 8.614 ======================= Grid point 197 (89/260) ======================= q-point: (-0.20 0.00 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 260 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.283 ( -24.492 0.000 8.756) 26.010 1.514 ( -21.858 0.000 15.488) 26.788 2.130 ( -20.694 0.000 30.986) 37.261 2.835 ( 1.394 0.000 2.544) 2.901 3.984 ( -1.517 0.000 -4.420) 4.673 4.138 ( -1.545 0.000 -3.901) 4.196 4.289 ( 4.728 0.000 2.085) 5.168 4.860 ( -3.213 0.000 -9.807) 10.320 5.350 ( 4.711 0.000 1.549) 4.959 6.025 ( -0.946 0.000 -0.282) 0.988 6.195 ( -5.582 0.000 6.022) 8.211 6.233 ( 0.847 0.000 3.744) 3.839 6.644 ( -5.046 0.000 7.534) 9.067 6.925 ( 1.838 0.000 -2.555) 3.147 7.189 ( 2.526 0.000 -4.839) 5.459 7.277 ( 10.601 0.000 0.987) 10.647 7.607 ( -1.939 0.000 -6.261) 6.554 7.654 ( -0.931 0.000 -0.648) 1.134 7.820 ( -5.509 0.000 -7.219) 9.081 8.173 ( 2.112 0.000 -7.336) 7.634 8.300 ( 4.596 0.000 4.931) 6.741 8.663 ( 4.478 0.000 -9.563) 10.560 9.149 ( -0.215 0.000 4.039) 4.044 9.767 ( 8.676 0.000 -4.864) 9.947 9.795 ( 9.136 0.000 6.895) 11.446 10.157 ( 1.366 0.000 -9.922) 10.016 10.273 ( 9.066 0.000 15.527) 17.979 10.684 ( -3.878 0.000 0.190) 3.882 10.715 ( 9.249 0.000 -0.114) 9.250 11.018 ( 7.483 0.000 1.088) 7.562 11.416 ( -2.655 0.000 -0.688) 2.742 11.593 ( 4.544 0.000 0.211) 4.549 12.052 ( 7.159 0.000 16.141) 17.657 12.206 ( 0.598 0.000 -5.846) 5.876 12.595 ( -14.491 0.000 -0.296) 14.494 13.152 ( 1.041 0.000 0.888) 1.368 13.246 ( -4.970 0.000 -6.749) 8.381 13.700 ( -4.294 0.000 2.919) 5.192 14.459 ( -0.729 0.000 -15.103) 15.120 15.210 ( -4.293 0.000 1.200) 4.458 15.387 ( 2.504 0.000 -2.192) 3.328 15.571 ( -0.620 0.000 -5.303) 5.339 16.405 ( -8.996 0.000 2.967) 9.473 16.867 ( 5.906 0.000 5.220) 7.882 17.124 ( 8.128 0.000 2.766) 8.585 17.908 ( 7.620 0.000 -1.214) 7.717 18.386 ( 0.142 0.000 8.718) 8.719 18.822 ( -2.459 0.000 -5.052) 5.619 ======================= Grid point 198 (90/260) ======================= q-point: (-0.10 0.00 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 250 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.949 ( -15.455 0.000 20.206) 25.439 1.184 ( -22.463 0.000 18.530) 29.120 1.998 ( -15.699 0.000 42.138) 44.967 2.884 ( 1.257 0.000 4.576) 4.746 4.034 ( 7.460 0.000 -2.773) 7.959 4.130 ( 3.923 0.000 2.718) 4.772 4.399 ( 4.275 0.000 4.721) 6.369 4.777 ( 0.817 0.000 -8.936) 8.974 5.506 ( 10.102 0.000 0.839) 10.137 5.983 ( -2.289 0.000 -0.558) 2.356 6.166 ( -2.434 0.000 7.632) 8.011 6.263 ( -0.048 0.000 0.401) 0.404 6.576 ( -8.259 0.000 9.293) 12.433 6.921 ( 0.387 0.000 -4.801) 4.816 7.213 ( 2.812 0.000 -1.905) 3.397 7.435 ( 3.997 0.000 -2.407) 4.666 7.495 ( -3.088 0.000 -4.250) 5.253 7.714 ( 5.437 0.000 -0.394) 5.452 7.720 ( -0.322 0.000 -1.861) 1.889 8.224 ( 6.531 0.000 -2.502) 6.993 8.387 ( 0.741 0.000 5.113) 5.166 8.718 ( 6.637 0.000 -6.169) 9.061 9.163 ( -1.130 0.000 3.796) 3.960 9.869 ( -2.271 0.000 0.838) 2.421 9.932 ( 10.424 0.000 -4.721) 11.443 10.109 ( 0.964 0.000 -10.990) 11.032 10.576 ( -6.705 0.000 -2.203) 7.058 10.593 ( 12.365 0.000 3.526) 12.858 10.925 ( 11.335 0.000 -2.384) 11.583 11.166 ( 6.486 0.000 0.885) 6.546 11.430 ( 6.774 0.000 5.480) 8.713 11.655 ( 2.825 0.000 -2.503) 3.774 12.162 ( -8.933 0.000 8.923) 12.626 12.221 ( 3.574 0.000 -3.039) 4.691 12.373 ( -6.078 0.000 0.512) 6.100 13.002 ( -11.959 0.000 4.887) 12.919 13.236 ( 4.639 0.000 -13.386) 14.167 13.573 ( -8.332 0.000 -1.810) 8.527 14.255 ( -10.719 0.000 -12.031) 16.113 15.087 ( -5.667 0.000 -3.411) 6.615 15.459 ( 3.754 0.000 0.876) 3.855 15.592 ( 4.036 0.000 1.924) 4.471 16.266 ( -6.913 0.000 1.530) 7.080 16.484 ( -31.441 0.000 -21.534) 38.109 17.304 ( 7.831 0.000 5.494) 9.567 18.425 ( -2.337 0.000 10.009) 10.278 18.534 ( 40.028 0.000 17.748) 43.786 18.767 ( -0.328 0.000 -3.876) 3.890 ======================= Grid point 199 (91/260) ======================= q-point: ( 0.00 0.12 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 400 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.040 ( 7.817 13.580 17.125) 23.211 1.285 ( -2.536 16.522 21.543) 27.267 2.147 ( -6.479 8.648 38.354) 39.847 2.887 ( 1.846 -5.084 5.215) 7.513 4.015 ( 1.102 -1.615 -9.372) 9.573 4.460 ( 15.895 -0.100 11.882) 19.845 4.546 ( 3.325 3.708 7.067) 8.646 4.802 ( 4.032 1.924 -5.115) 6.791 5.671 ( 7.970 -4.280 1.787) 9.221 6.005 ( 0.921 4.103 0.309) 4.216 6.126 ( -2.541 -4.739 3.143) 6.228 6.265 ( -1.101 2.449 0.065) 2.686 6.458 ( -8.619 1.856 9.308) 12.821 6.929 ( -1.857 2.089 -5.509) 6.178 7.170 ( -4.072 -6.476 -3.858) 8.567 7.446 ( 0.165 -6.850 -4.768) 8.348 7.548 ( 8.901 8.451 -9.781) 15.694 7.623 ( 1.876 5.327 2.065) 6.013 8.136 ( 7.717 15.436 1.415) 17.316 8.252 ( 2.668 -4.709 4.287) 6.904 8.601 ( 3.309 11.571 2.361) 12.264 8.838 ( 8.780 0.087 -3.139) 9.324 9.134 ( -2.398 -1.116 2.383) 3.560 9.768 ( -3.210 -1.849 -0.169) 3.709 10.007 ( 0.196 -0.127 -8.767) 8.771 10.099 ( 5.270 -3.006 -5.166) 7.969 10.389 ( -7.314 -3.074 -0.553) 7.953 10.589 ( -4.628 -4.245 -7.669) 9.912 11.025 ( 2.611 -1.946 -1.083) 3.432 11.240 ( -3.559 0.139 1.789) 3.986 11.489 ( 3.486 -5.989 5.589) 8.903 11.873 ( 6.075 6.073 -7.428) 11.356 12.031 ( -13.628 -2.668 1.580) 13.976 12.057 ( 6.411 -4.832 -1.963) 8.265 12.359 ( -3.705 5.373 -2.382) 6.948 12.890 ( -0.608 1.951 -6.857) 7.155 13.100 ( -1.501 -4.483 -1.515) 4.965 13.602 ( 1.838 6.361 5.123) 8.371 14.019 ( -8.103 1.076 3.886) 9.051 14.884 ( -3.600 -7.923 -5.537) 10.315 15.261 ( -16.418 -15.591 5.620) 23.328 15.695 ( 3.174 3.213 2.177) 5.014 15.918 ( 0.306 1.512 -5.197) 5.421 16.258 ( -9.992 8.187 -3.377) 13.352 17.498 ( 6.315 1.173 8.707) 10.820 18.187 ( 2.269 -15.741 17.538) 23.675 18.783 ( 1.709 4.176 -4.228) 6.183 19.364 ( 11.968 6.965 -7.705) 15.847 ======================= Grid point 200 (92/260) ======================= q-point: ( 0.10 0.12 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 400 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.190 ( 2.921 18.722 15.113) 24.238 1.610 ( 15.598 10.021 17.822) 25.717 2.338 ( 2.674 6.776 33.130) 33.921 2.954 ( 2.093 -3.896 3.568) 5.682 3.966 ( -0.204 -0.401 -8.084) 8.096 4.572 ( -1.952 2.598 5.148) 6.088 4.869 ( 9.365 -1.910 3.630) 10.224 4.898 ( 13.593 -0.398 3.546) 14.053 5.794 ( 2.119 -5.721 4.699) 7.700 6.026 ( -0.486 0.636 -1.052) 1.322 6.122 ( 1.949 -0.450 2.874) 3.501 6.246 ( -1.162 0.114 2.912) 3.138 6.362 ( -5.711 3.255 5.834) 8.789 6.870 ( -1.304 2.822 -4.711) 5.645 7.068 ( -3.537 -6.565 -3.572) 8.268 7.340 ( -4.301 -0.678 -7.224) 8.435 7.630 ( 3.956 7.320 -4.424) 9.424 7.779 ( 10.816 0.117 -2.645) 11.135 8.205 ( -0.379 8.031 1.267) 8.139 8.325 ( 1.324 4.213 2.610) 5.130 8.729 ( 7.703 7.522 4.842) 11.806 8.985 ( 6.424 -0.668 -1.142) 6.559 9.099 ( -1.054 -0.473 0.200) 1.173 9.685 ( -5.986 -0.378 1.424) 6.164 9.937 ( -1.117 -1.184 -10.765) 10.888 10.085 ( -3.287 -2.229 -3.222) 5.114 10.320 ( -2.122 -4.457 3.477) 6.038 10.399 ( -7.457 -1.915 -6.953) 10.374 10.953 ( -8.682 -1.498 0.438) 8.821 11.102 ( -10.326 -0.115 1.796) 10.481 11.404 ( -19.185 6.604 7.483) 21.626 11.792 ( 0.517 -1.503 -2.807) 3.225 11.864 ( 0.659 3.006 -4.654) 5.579 12.211 ( -8.037 0.136 2.133) 8.316 12.407 ( 19.329 -9.333 -7.685) 22.799 12.924 ( 7.754 1.676 -15.508) 17.420 13.125 ( 3.625 -0.452 5.112) 6.283 13.678 ( -0.411 2.234 6.033) 6.446 14.037 ( 7.338 3.638 9.420) 12.482 14.782 ( -3.584 -6.276 -7.536) 10.441 14.945 ( -15.524 -11.856 1.654) 19.604 15.759 ( 4.315 7.662 1.202) 8.876 16.005 ( 5.615 -1.208 -0.146) 5.745 16.124 ( -2.751 4.456 -0.599) 5.271 17.648 ( 2.723 0.814 10.596) 10.970 18.234 ( -5.090 -7.823 10.558) 14.092 18.743 ( -1.879 6.912 -7.795) 10.586 19.476 ( 4.306 -2.812 -5.039) 7.200 ======================= Grid point 201 (93/260) ======================= q-point: ( 0.20 0.12 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 400 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.416 ( 10.786 12.191 12.634) 20.606 1.956 ( 7.814 6.116 18.979) 21.416 2.625 ( 8.814 5.727 18.887) 21.615 3.000 ( 0.543 -2.832 1.771) 3.384 3.916 ( -0.530 0.635 -5.328) 5.392 4.524 ( -5.078 2.654 2.486) 6.246 4.996 ( 7.390 -1.541 -3.135) 8.174 5.191 ( 8.850 -3.522 5.677) 11.089 5.810 ( -5.394 -4.234 11.644) 13.513 5.978 ( -1.191 -1.758 -4.534) 5.006 6.224 ( 3.957 -2.742 5.478) 7.293 6.275 ( 1.474 -2.359 4.590) 5.367 6.322 ( 1.479 5.097 -2.432) 5.838 6.801 ( -3.034 3.922 -5.157) 7.154 7.005 ( -1.074 -1.943 -1.889) 2.915 7.233 ( -1.973 0.131 -5.451) 5.798 7.654 ( 0.542 6.542 -2.336) 6.967 7.946 ( 8.792 0.668 -5.333) 10.305 8.183 ( -2.107 4.789 1.670) 5.492 8.322 ( -1.792 8.302 -0.679) 8.521 8.899 ( 4.790 3.563 3.067) 6.711 9.024 ( 0.668 -2.732 -0.926) 2.961 9.124 ( 1.735 1.858 -1.994) 3.231 9.531 ( -11.368 -2.057 2.061) 11.735 9.843 ( -0.415 -2.184 -10.404) 10.639 10.046 ( -0.045 -0.179 1.218) 1.232 10.188 ( -7.904 -2.347 4.495) 9.391 10.347 ( -2.003 -4.476 1.093) 5.024 10.768 ( -10.024 -1.115 -0.218) 10.088 10.915 ( -8.278 1.275 0.971) 8.432 11.074 ( -15.086 12.202 4.087) 19.829 11.811 ( -1.800 -0.032 2.309) 2.928 11.824 ( -2.182 0.004 -11.326) 11.534 12.100 ( -3.701 -2.633 6.895) 8.256 12.665 ( 10.307 -12.014 -6.099) 16.964 12.961 ( 7.478 0.476 -12.447) 14.528 13.298 ( 8.336 -1.595 6.548) 10.720 13.688 ( -0.265 4.370 5.525) 7.050 14.330 ( 14.690 1.619 4.615) 15.483 14.629 ( -6.644 -5.534 -4.061) 9.553 14.757 ( -3.984 -4.163 -3.550) 6.768 15.892 ( 6.814 6.101 4.674) 10.272 16.002 ( -1.218 -0.945 -3.900) 4.193 16.184 ( 4.378 1.168 2.803) 5.328 17.713 ( -3.895 -0.489 11.441) 12.095 18.162 ( -6.333 -3.677 5.006) 8.871 18.639 ( -2.141 5.917 -11.068) 12.731 19.490 ( 0.134 -2.684 -3.215) 4.190 ======================= Grid point 202 (94/260) ======================= q-point: ( 0.30 0.12 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 400 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.715 ( 11.701 5.245 9.993) 16.257 2.159 ( 1.535 3.439 19.341) 19.704 2.843 ( 4.031 2.420 5.986) 7.612 2.993 ( -1.431 -0.700 0.119) 1.597 3.884 ( -0.244 1.734 -2.224) 2.831 4.422 ( -6.067 2.781 0.156) 6.676 5.115 ( 6.929 -3.154 -3.850) 8.531 5.283 ( 0.334 -1.700 -3.928) 4.293 5.741 ( -10.467 -2.247 16.587) 19.741 5.972 ( 3.850 -5.208 -3.201) 7.224 6.264 ( 0.318 -5.661 -3.308) 6.564 6.339 ( 2.726 -4.393 2.543) 5.762 6.419 ( 5.627 5.662 0.573) 8.003 6.711 ( -1.718 6.369 -3.651) 7.540 6.989 ( -0.215 3.094 -1.122) 3.298 7.218 ( 3.091 1.203 -2.154) 3.955 7.616 ( -3.732 7.642 0.315) 8.510 8.043 ( 4.960 0.178 -7.662) 9.129 8.166 ( 0.372 5.197 -0.296) 5.219 8.269 ( -2.522 7.262 -1.692) 7.871 8.876 ( -6.273 -0.313 -2.257) 6.674 9.046 ( 0.961 -0.672 -5.121) 5.253 9.102 ( -1.007 1.833 -3.234) 3.852 9.296 ( -12.637 -2.595 0.301) 12.904 9.837 ( 4.112 -2.531 -2.476) 5.427 10.032 ( -3.578 -0.234 -0.199) 3.591 10.120 ( -6.170 -2.664 10.990) 12.882 10.311 ( -1.145 -7.793 4.179) 8.916 10.589 ( -6.953 -1.502 -0.120) 7.114 10.833 ( -1.211 4.525 -0.060) 4.685 10.927 ( -2.785 13.432 5.319) 14.713 11.620 ( -8.944 -0.342 -13.060) 15.833 11.759 ( -4.583 -1.872 1.997) 5.338 12.136 ( 0.663 -1.444 8.443) 8.591 12.743 ( 3.212 -6.192 -4.364) 8.228 13.077 ( 8.791 -4.714 -6.228) 11.760 13.446 ( 2.154 -7.375 5.998) 9.747 13.789 ( 6.262 5.644 7.717) 11.429 14.416 ( -3.212 -5.543 -5.619) 8.522 14.611 ( 1.481 4.698 -3.829) 6.239 14.809 ( 13.359 -0.574 2.033) 13.525 15.916 ( -2.568 0.177 -2.829) 3.824 16.113 ( 9.927 2.156 4.053) 10.937 16.255 ( 0.506 1.270 4.370) 4.579 17.615 ( -12.442 -1.841 8.292) 15.065 18.092 ( -2.824 -3.178 1.554) 4.527 18.543 ( 0.175 5.773 -12.770) 14.016 19.447 ( -2.187 -0.939 -4.037) 4.686 ======================= Grid point 203 (95/260) ======================= q-point: ( 0.40 0.12 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 400 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.942 ( 4.548 -0.900 9.227) 10.327 2.276 ( -0.541 2.695 16.632) 16.857 2.826 ( -5.579 -2.137 -1.425) 6.142 2.961 ( -2.180 2.236 -2.580) 4.051 3.883 ( 0.965 2.638 0.012) 2.809 4.308 ( -4.955 3.057 -1.405) 5.989 5.117 ( -5.712 -1.954 -10.006) 11.686 5.264 ( 5.002 -1.992 -7.022) 8.848 5.632 ( -10.729 -1.955 15.665) 19.087 6.081 ( 6.925 -7.595 2.155) 10.501 6.195 ( -3.633 -1.207 -8.001) 8.870 6.404 ( 2.597 -4.317 0.409) 5.055 6.475 ( 1.882 1.734 -0.921) 2.720 6.731 ( 3.095 8.627 0.242) 9.168 6.976 ( -0.357 2.598 -1.205) 2.886 7.310 ( 6.000 5.245 1.075) 8.042 7.527 ( -5.585 8.797 1.440) 10.519 8.034 ( 0.415 0.401 -9.559) 9.576 8.182 ( -1.837 4.172 1.918) 4.945 8.224 ( 2.479 5.393 -7.059) 9.223 8.685 ( -9.411 -0.584 -6.044) 11.200 8.954 ( -3.882 -0.977 -12.280) 12.916 9.074 ( -3.461 -1.474 0.234) 3.769 9.116 ( -2.862 1.558 0.547) 3.304 9.871 ( -5.276 -1.327 1.437) 5.627 9.964 ( -2.371 -3.576 6.684) 7.943 10.060 ( -0.674 0.272 0.814) 1.091 10.386 ( 3.612 -10.278 7.874) 13.442 10.511 ( -2.549 -2.702 2.869) 4.694 10.831 ( 0.661 3.772 -0.058) 3.830 11.013 ( 4.878 13.155 9.585) 16.992 11.375 ( -5.781 0.143 -14.983) 16.060 11.685 ( -3.938 -3.245 2.048) 5.498 12.208 ( 1.150 1.179 9.264) 9.409 12.771 ( 2.341 -5.150 -4.273) 7.090 13.176 ( 3.844 -5.567 -1.926) 7.034 13.485 ( -0.778 -6.877 5.346) 8.745 13.915 ( -0.572 1.431 5.297) 5.516 14.379 ( 3.756 -3.305 -1.352) 5.183 14.613 ( 2.329 6.972 -2.130) 7.653 15.119 ( 16.074 0.252 -0.398) 16.081 15.840 ( -2.921 -1.294 -4.697) 5.680 16.258 ( -2.886 1.756 6.290) 7.140 16.337 ( 9.065 1.484 6.502) 11.254 17.374 ( -15.063 -2.283 2.921) 15.513 18.054 ( -1.725 -6.135 -1.530) 6.554 18.494 ( 2.885 8.316 -12.054) 14.926 19.359 ( -3.744 0.028 -5.970) 7.046 ======================= Grid point 204 (96/260) ======================= q-point: (-0.50 0.12 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 400 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.986 ( -6.150 -5.300 10.939) 13.623 2.331 ( -4.866 4.615 12.143) 13.872 2.671 ( -6.632 -5.697 -6.322) 10.789 2.869 ( -4.714 2.472 -2.792) 6.011 3.918 ( 2.379 2.582 0.350) 3.529 4.226 ( -2.164 3.464 -1.932) 4.518 4.873 ( -10.349 -1.227 -14.032) 17.479 5.277 ( -1.066 -3.378 -6.563) 7.458 5.545 ( -7.115 0.037 11.938) 13.898 6.061 ( -3.360 4.455 -5.278) 7.681 6.248 ( 6.754 -9.469 2.273) 11.851 6.411 ( -2.203 -2.596 0.078) 3.406 6.512 ( 1.451 0.391 -0.009) 1.502 6.785 ( 3.219 7.712 0.163) 8.358 6.963 ( 0.238 1.464 -1.788) 2.323 7.393 ( -4.077 13.262 5.690) 14.996 7.476 ( 4.590 3.389 -2.567) 6.256 7.969 ( -0.574 0.447 -9.678) 9.706 8.115 ( -4.569 3.163 1.876) 5.865 8.253 ( 3.960 2.763 -10.198) 11.283 8.480 ( -6.331 1.022 -8.550) 10.688 8.785 ( -4.413 -0.540 -13.051) 13.787 9.041 ( 0.315 -1.385 3.815) 4.071 9.138 ( 2.358 2.425 2.846) 4.420 9.772 ( -4.093 -2.005 1.075) 4.683 9.918 ( -3.531 1.499 4.055) 5.582 10.125 ( 3.864 -2.676 -1.644) 4.979 10.471 ( 0.470 -4.966 3.760) 6.246 10.552 ( 3.799 -7.254 8.469) 11.780 10.840 ( -1.354 1.313 2.750) 3.335 11.115 ( 1.014 5.280 2.403) 5.889 11.314 ( 6.916 2.188 -5.823) 9.302 11.650 ( -0.867 -1.422 3.084) 3.505 12.286 ( 1.047 1.565 6.752) 7.009 12.776 ( 1.604 -7.378 -5.262) 9.203 13.204 ( -0.142 -1.220 0.045) 1.230 13.498 ( -1.388 -6.603 5.677) 8.817 13.849 ( -6.305 4.126 2.558) 7.957 14.467 ( 2.630 -4.769 0.112) 5.447 14.723 ( 9.083 6.869 3.460) 11.902 15.394 ( 13.360 -0.246 -3.645) 13.850 15.742 ( -4.114 -2.048 -5.275) 6.996 16.233 ( -4.477 1.861 10.801) 11.840 16.538 ( 6.779 0.638 7.923) 10.447 17.103 ( -12.782 -2.108 -1.595) 13.052 17.994 ( -2.084 -10.102 -6.420) 12.150 18.506 ( 5.135 12.356 -9.018) 16.136 19.233 ( -4.782 0.312 -7.766) 9.126 ======================= Grid point 205 (97/260) ======================= q-point: (-0.40 0.12 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 400 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.870 ( -12.900 -6.083 13.220) 19.447 2.149 ( -18.228 2.831 1.745) 18.529 2.558 ( -3.694 -4.198 0.052) 5.592 2.778 ( -3.217 0.623 -0.329) 3.293 3.971 ( 3.069 1.564 -1.140) 3.628 4.206 ( 1.056 3.816 -1.340) 4.180 4.573 ( -11.415 -1.072 -13.407) 17.641 5.157 ( -6.366 -2.649 -5.249) 8.666 5.471 ( -6.660 3.603 5.468) 9.340 6.024 ( 1.616 4.662 -2.275) 5.433 6.269 ( -5.260 -4.315 -0.197) 6.806 6.385 ( -1.509 -1.179 2.078) 2.826 6.544 ( 1.422 -4.199 4.839) 6.563 6.882 ( 6.085 8.047 0.406) 10.097 6.980 ( 3.598 0.266 -2.851) 4.598 7.308 ( -5.057 11.326 1.736) 12.525 7.576 ( 5.269 4.107 -1.400) 6.825 7.886 ( -2.532 -0.035 -8.654) 9.017 8.055 ( -3.412 -0.291 2.249) 4.097 8.208 ( -1.076 3.469 -11.331) 11.899 8.366 ( 0.407 3.981 -10.356) 11.102 8.666 ( 0.496 0.087 -10.961) 10.972 9.083 ( 0.483 -1.536 3.810) 4.137 9.265 ( 7.278 3.339 8.754) 11.864 9.722 ( -0.592 -0.047 -2.936) 2.996 9.931 ( 1.772 0.100 6.142) 6.393 10.156 ( 2.019 -2.075 -4.699) 5.520 10.507 ( 1.693 -2.546 2.561) 3.988 10.697 ( 5.159 -5.054 7.670) 10.535 10.809 ( -2.444 1.673 1.627) 3.379 11.192 ( 6.682 -4.774 -0.481) 8.227 11.412 ( 3.275 -2.717 -1.091) 4.393 11.708 ( 3.653 3.783 7.351) 9.039 12.299 ( -1.775 -0.998 -0.690) 2.150 12.784 ( 1.153 -9.531 -1.930) 9.793 13.182 ( -0.994 6.461 -1.564) 6.722 13.489 ( -4.042 -4.645 6.085) 8.657 13.768 ( -3.479 5.460 4.017) 7.619 14.478 ( 0.045 -3.899 -2.599) 4.686 14.947 ( 9.459 2.756 6.698) 11.913 15.552 ( 3.457 -2.407 -8.598) 9.574 15.634 ( -0.726 -0.807 -4.947) 5.064 16.252 ( -2.290 -0.208 18.903) 19.042 16.662 ( -2.010 -0.638 10.506) 10.715 16.913 ( -1.898 -0.073 -5.649) 5.960 17.889 ( -3.377 -13.563 -10.839) 17.687 18.577 ( 6.912 16.875 -5.858) 19.154 19.084 ( -5.219 0.443 -8.421) 9.917 ======================= Grid point 206 (98/260) ======================= q-point: (-0.30 0.12 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 400 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.682 ( -15.788 -4.532 17.235) 23.808 1.723 ( -24.695 -1.647 -1.493) 24.795 2.458 ( -10.770 4.824 10.359) 15.703 2.750 ( -0.027 -3.994 0.837) 4.081 4.011 ( 2.365 0.441 -3.984) 4.653 4.238 ( 0.720 2.274 -1.448) 2.790 4.301 ( -6.946 1.894 -7.381) 10.311 4.999 ( -6.133 -0.601 -5.202) 8.065 5.382 ( -3.783 4.323 1.830) 6.029 6.056 ( 1.741 3.578 -1.024) 4.109 6.182 ( -3.127 -3.371 2.533) 5.250 6.321 ( -5.733 2.269 3.306) 6.996 6.592 ( -0.953 -5.193 5.783) 7.831 6.994 ( 4.436 7.220 0.883) 8.520 7.073 ( 7.342 -0.073 -3.612) 8.183 7.253 ( -0.042 7.556 -1.224) 7.654 7.653 ( 4.202 5.059 -2.368) 6.990 7.762 ( -4.985 -0.466 -7.412) 8.945 7.970 ( -5.671 -1.347 -1.696) 6.071 8.139 ( 0.839 2.330 -8.476) 8.830 8.360 ( 4.117 8.215 -4.824) 10.378 8.651 ( 3.852 0.748 -10.416) 11.131 9.108 ( -0.013 -1.664 3.598) 3.964 9.483 ( 7.805 -0.073 8.959) 11.882 9.752 ( 6.941 4.686 -2.318) 8.690 10.040 ( 3.726 -2.919 9.670) 10.766 10.163 ( 2.632 -1.153 -6.925) 7.497 10.574 ( 4.328 -1.227 1.112) 4.634 10.756 ( -2.474 1.413 1.999) 3.480 10.858 ( 6.475 -1.961 2.582) 7.241 11.343 ( 7.844 -8.610 2.050) 11.826 11.422 ( -0.294 -5.568 -3.468) 6.566 11.861 ( 5.466 3.237 11.709) 13.321 12.239 ( -1.613 -1.890 -4.760) 5.370 12.736 ( -6.963 -9.139 0.688) 11.510 13.185 ( 3.832 10.047 -5.239) 11.962 13.405 ( -7.960 -0.603 4.790) 9.309 13.759 ( -1.378 3.863 4.829) 6.336 14.450 ( 0.160 -5.164 -6.723) 8.479 15.133 ( 4.285 -0.863 7.138) 8.370 15.436 ( -5.171 -2.763 -6.241) 8.563 15.642 ( 2.126 0.938 -9.608) 9.885 16.352 ( -4.514 -10.583 20.083) 23.145 16.643 ( 1.121 3.732 11.143) 11.805 16.978 ( 7.170 1.471 -0.225) 7.323 17.720 ( -6.779 -15.882 -12.575) 21.362 18.691 ( 7.723 21.087 -4.528) 22.908 18.944 ( -3.681 1.757 -6.450) 7.631 ======================= Grid point 207 (99/260) ======================= q-point: (-0.20 0.12 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 400 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.223 ( -26.219 -4.440 4.548) 26.978 1.500 ( -15.634 2.085 21.874) 26.967 2.284 ( -16.390 10.737 20.503) 28.360 2.774 ( 0.969 -5.815 3.323) 6.767 3.993 ( -0.261 1.028 -5.704) 5.802 4.136 ( -1.662 0.745 -1.633) 2.447 4.341 ( 4.367 4.586 2.315) 6.743 4.868 ( -3.804 0.871 -5.579) 6.808 5.381 ( 3.180 2.372 0.489) 3.998 6.051 ( -1.823 1.860 0.089) 2.606 6.176 ( -0.836 -4.434 2.640) 5.228 6.254 ( -2.383 4.916 4.224) 6.905 6.583 ( -3.596 -3.269 7.051) 8.563 7.039 ( 0.730 4.840 -2.176) 5.357 7.177 ( 5.097 0.782 -3.521) 6.244 7.299 ( 5.190 1.822 -2.869) 6.204 7.604 ( -5.922 -1.960 -5.318) 8.197 7.743 ( 6.065 9.775 -3.252) 11.954 7.844 ( -4.696 1.878 -2.797) 5.780 8.135 ( 2.526 1.246 -3.529) 4.515 8.442 ( 5.102 9.130 -0.123) 10.460 8.667 ( 4.247 1.391 -9.139) 10.174 9.131 ( -0.016 -1.637 3.778) 4.118 9.652 ( 7.513 -4.788 0.818) 8.947 9.920 ( 7.032 5.821 -0.066) 9.129 10.131 ( 1.299 -2.864 -5.241) 6.112 10.245 ( 9.260 -2.337 9.711) 13.620 10.690 ( 2.137 0.440 0.070) 2.183 10.717 ( 3.109 0.367 -0.217) 3.138 11.010 ( 8.034 -1.164 1.310) 8.223 11.371 ( -2.192 -4.228 -2.241) 5.263 11.508 ( 7.556 -7.502 1.794) 10.797 12.050 ( 5.314 -0.709 13.625) 14.642 12.202 ( 0.755 -0.726 -4.429) 4.551 12.543 ( -11.745 -4.796 -0.477) 12.696 13.220 ( -2.878 6.591 1.620) 7.372 13.261 ( -3.358 1.476 -7.657) 8.490 13.731 ( -4.716 3.063 2.923) 6.338 14.386 ( -1.616 -6.194 -12.171) 13.752 15.139 ( -5.988 -6.612 0.800) 8.956 15.375 ( 0.644 -0.815 1.708) 1.999 15.605 ( 0.308 2.555 -6.405) 6.903 16.259 ( -10.339 -13.234 6.259) 17.922 16.877 ( 5.607 0.929 4.842) 7.466 17.106 ( 5.357 -1.119 2.737) 6.119 17.555 ( -0.889 -15.714 6.765) 17.131 18.758 ( 1.594 9.162 -5.926) 11.028 18.939 ( 7.343 19.152 -1.957) 20.604 ======================= Grid point 208 (100/260) ======================= q-point: (-0.10 0.12 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 400 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.892 ( -10.747 2.621 17.129) 20.390 1.352 ( -14.048 11.151 22.507) 28.780 2.132 ( -14.645 11.628 31.752) 36.850 2.823 ( 1.248 -5.971 5.458) 8.185 4.012 ( 4.697 -1.529 -5.545) 7.426 4.165 ( 5.118 3.817 5.951) 8.728 4.446 ( 3.950 4.136 4.833) 7.488 4.795 ( 0.022 1.683 -5.464) 5.718 5.499 ( 8.178 -0.787 0.455) 8.229 6.012 ( -1.754 2.398 0.509) 3.014 6.155 ( -2.739 -3.223 3.938) 5.779 6.269 ( 0.771 2.516 0.386) 2.660 6.545 ( -5.926 -1.382 9.211) 11.039 7.004 ( -1.602 3.208 -5.823) 6.838 7.228 ( 1.323 -2.478 -1.823) 3.349 7.369 ( 4.962 -0.150 -5.202) 7.190 7.508 ( 0.162 -3.106 -3.043) 4.351 7.688 ( -4.592 9.209 -5.822) 11.823 7.937 ( 9.763 10.491 2.739) 14.590 8.182 ( 3.188 0.534 0.182) 3.238 8.532 ( 3.425 10.260 1.611) 10.936 8.718 ( 6.414 0.774 -6.361) 9.067 9.148 ( -0.904 -1.323 3.561) 3.904 9.777 ( 4.057 -5.608 -1.238) 7.031 9.986 ( 3.064 2.490 -1.741) 4.315 10.093 ( 0.478 -1.616 -9.469) 9.618 10.481 ( 3.141 -6.396 2.871) 7.683 10.633 ( -0.114 1.037 -2.846) 3.031 10.897 ( 9.973 -1.755 -0.814) 10.159 11.180 ( 7.749 -0.127 1.458) 7.886 11.363 ( 3.069 -4.101 2.921) 5.897 11.663 ( 9.448 -1.561 -1.032) 9.631 12.135 ( -7.480 -2.475 8.283) 11.431 12.197 ( -0.595 -2.187 -3.277) 3.985 12.380 ( -1.448 0.008 1.148) 1.848 13.047 ( -10.731 3.870 0.739) 11.432 13.200 ( -1.947 -1.143 -11.795) 12.009 13.624 ( -5.550 4.718 0.207) 7.287 14.215 ( -8.859 -3.241 -8.203) 12.501 15.003 ( -6.019 -8.011 -3.179) 10.513 15.403 ( -2.631 -5.528 6.348) 8.819 15.609 ( 2.655 0.978 0.479) 2.870 16.077 ( -10.113 -11.116 -1.591) 15.112 16.603 ( -19.005 6.701 -14.776) 24.989 17.305 ( 8.531 0.087 7.301) 11.229 17.881 ( 14.343 -21.466 26.910) 37.292 18.757 ( 2.341 2.271 -3.650) 4.895 19.136 ( 14.031 23.894 -4.874) 28.134 ======================= Grid point 209 (101/260) ======================= q-point: ( 0.00 0.25 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 404 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.426 ( 15.633 22.718 8.516) 28.862 1.622 ( -2.566 16.810 20.740) 26.820 2.350 ( -3.401 9.538 22.754) 24.906 2.740 ( 2.328 -9.394 8.631) 12.967 3.990 ( 1.044 -0.026 -6.685) 6.766 4.523 ( 10.243 6.123 12.706) 17.432 4.617 ( 1.834 2.555 8.201) 8.783 4.850 ( 1.932 2.627 0.931) 3.392 5.567 ( 5.571 -5.758 0.969) 8.071 5.998 ( -2.685 -5.279 -3.322) 6.791 6.093 ( 0.172 2.146 5.588) 5.989 6.306 ( -1.579 1.764 -3.102) 3.902 6.517 ( -5.042 3.714 8.644) 10.674 6.906 ( -3.960 -6.521 -2.158) 7.928 7.033 ( -1.120 -4.608 -7.169) 8.595 7.217 ( 0.583 -10.045 -2.513) 10.371 7.744 ( 5.979 7.116 -4.924) 10.519 7.871 ( 2.816 14.747 -3.728) 15.469 8.185 ( 5.232 -1.462 3.985) 6.737 8.452 ( 3.985 15.890 0.611) 16.394 8.767 ( 6.301 2.311 2.031) 7.012 8.913 ( 4.886 9.782 -4.525) 11.833 9.114 ( -1.753 -0.565 1.482) 2.365 9.737 ( 1.034 -1.308 -1.672) 2.361 9.988 ( -0.675 -1.956 -8.579) 8.825 10.021 ( 1.289 -4.683 -3.110) 5.767 10.282 ( -5.733 -7.512 0.240) 9.452 10.528 ( -5.519 -1.113 -3.895) 6.847 10.988 ( 1.105 -1.458 0.815) 2.002 11.209 ( -2.395 -2.394 3.854) 5.131 11.441 ( 5.095 -0.062 5.655) 7.612 11.813 ( 11.154 -9.410 -5.438) 15.573 11.970 ( -4.517 -5.502 1.381) 7.252 12.038 ( -3.879 2.853 -3.906) 6.200 12.419 ( -1.707 -0.030 1.083) 2.021 12.865 ( -4.768 -0.322 -11.646) 12.588 13.211 ( 0.021 12.331 -2.953) 12.680 13.726 ( -0.634 5.911 4.457) 7.430 14.035 ( -2.829 0.129 -0.173) 2.837 14.678 ( -2.667 -11.966 -4.513) 13.063 14.980 ( -19.097 -12.235 10.004) 24.789 15.728 ( 6.668 0.701 4.168) 7.895 15.946 ( 3.030 1.241 -6.106) 6.929 16.414 ( -10.651 6.746 -6.604) 14.232 17.532 ( 6.176 2.298 10.424) 12.332 17.920 ( 6.206 -10.481 20.718) 24.033 18.870 ( 5.084 4.377 -2.488) 7.155 19.474 ( 0.251 3.896 -11.586) 12.226 ======================= Grid point 210 (102/260) ======================= q-point: ( 0.10 0.25 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 400 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.613 ( 1.870 22.004 8.539) 23.677 1.866 ( 11.730 14.554 14.035) 23.375 2.509 ( 4.390 8.686 23.420) 25.362 2.841 ( 2.652 -7.319 7.153) 10.572 3.963 ( 0.411 0.571 -5.901) 5.942 4.624 ( -2.431 2.110 6.003) 6.812 4.834 ( 6.958 -0.563 13.236) 14.964 4.932 ( 7.342 2.624 1.653) 7.970 5.684 ( 5.149 -4.794 2.676) 7.527 5.927 ( -2.035 -7.177 -3.024) 8.049 6.110 ( -3.895 -2.863 6.132) 7.808 6.266 ( 1.020 2.148 -3.963) 4.622 6.460 ( -3.947 5.290 3.746) 7.589 6.881 ( 1.587 -5.108 0.999) 5.442 6.960 ( -1.645 -1.820 -5.642) 6.152 7.209 ( 0.688 -7.318 -6.884) 10.070 7.808 ( 1.422 8.045 3.509) 8.891 7.937 ( 7.755 11.521 -9.924) 17.069 8.270 ( 1.391 2.503 3.859) 4.805 8.526 ( 1.957 12.380 0.704) 12.554 8.883 ( 4.312 6.248 4.265) 8.707 8.982 ( 1.980 1.341 -0.258) 2.405 9.096 ( 1.783 0.848 -2.336) 3.059 9.698 ( -5.217 0.978 -0.117) 5.309 9.889 ( -2.994 -3.807 -12.805) 13.690 9.997 ( -0.663 -6.546 -2.831) 7.163 10.214 ( -3.262 -5.882 4.649) 8.176 10.389 ( -5.403 2.009 -2.929) 6.466 10.918 ( -7.550 -1.721 -0.067) 7.744 11.100 ( -9.846 0.033 2.999) 10.293 11.489 ( -9.243 1.046 6.459) 11.324 11.756 ( 0.533 -1.800 -0.539) 1.953 11.960 ( -2.218 4.986 -6.138) 8.214 12.157 ( 15.054 -12.452 -4.477) 20.043 12.248 ( -12.160 2.254 0.014) 12.367 12.834 ( 4.275 -7.665 -8.820) 12.443 13.257 ( 5.578 10.643 -3.413) 12.492 13.738 ( -0.378 3.755 3.350) 5.046 14.107 ( 8.954 2.606 4.003) 10.148 14.627 ( -1.146 -8.491 -4.626) 9.738 14.702 ( -12.614 -11.585 5.657) 18.036 15.878 ( 6.041 3.785 2.549) 7.570 15.987 ( 3.757 -0.567 -2.599) 4.603 16.233 ( -4.850 5.920 -2.704) 8.117 17.675 ( 1.360 1.941 11.372) 11.616 18.075 ( -1.147 -7.535 14.300) 16.204 18.899 ( -0.637 8.331 -7.307) 11.100 19.411 ( 1.022 -3.567 -6.603) 7.575 ======================= Grid point 211 (103/260) ======================= q-point: ( 0.20 0.25 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 404 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.728 ( 5.936 18.206 5.379) 19.890 2.112 ( 4.288 8.797 15.247) 18.118 2.752 ( 6.919 5.310 13.438) 16.020 2.921 ( 1.777 -4.699 4.838) 6.974 3.941 ( 0.517 2.049 -3.779) 4.330 4.577 ( -5.280 2.016 3.835) 6.830 4.959 ( 3.425 -1.880 4.606) 6.040 5.120 ( 6.109 -3.120 5.185) 8.599 5.767 ( -2.284 -0.028 9.167) 9.448 5.897 ( 1.378 -5.277 -5.404) 7.678 6.046 ( -0.747 -10.527 -0.926) 10.595 6.282 ( -0.450 1.222 3.133) 3.393 6.456 ( 3.054 5.526 -1.093) 6.407 6.879 ( -2.751 3.449 -1.021) 4.528 6.987 ( 7.373 -3.641 -1.692) 8.395 7.158 ( -0.578 -2.216 -8.361) 8.669 7.849 ( -0.259 10.693 5.302) 11.938 8.017 ( 6.307 4.759 -9.103) 12.053 8.305 ( 0.111 8.345 3.442) 9.028 8.511 ( -2.737 9.528 -1.279) 9.996 8.953 ( -3.600 -0.639 -0.103) 3.657 8.998 ( 4.251 2.836 2.795) 5.824 9.145 ( 2.710 0.428 -3.255) 4.257 9.507 ( -12.533 -1.356 -2.936) 12.944 9.771 ( -0.499 -5.234 -10.555) 11.793 10.012 ( 1.948 -2.656 2.536) 4.157 10.138 ( -7.169 -3.040 4.678) 9.084 10.310 ( -3.828 2.234 1.405) 4.649 10.739 ( -10.090 -1.580 -0.910) 10.253 10.940 ( -5.997 1.110 0.960) 6.174 11.270 ( -11.796 4.772 2.742) 13.017 11.809 ( -2.837 -0.451 -3.213) 4.310 11.859 ( -2.789 4.288 -3.244) 6.057 12.053 ( -5.709 -1.255 4.147) 7.167 12.411 ( 12.614 -12.401 -2.714) 17.896 12.853 ( 2.910 -10.055 -6.871) 12.521 13.335 ( 3.332 4.443 -0.620) 5.589 13.782 ( 3.020 4.965 3.129) 6.600 14.323 ( 6.472 -3.957 -3.387) 8.307 14.541 ( 0.763 -1.459 9.652) 9.792 14.658 ( 3.305 -5.111 -6.364) 8.806 15.974 ( 0.416 -1.001 -4.000) 4.144 16.027 ( 3.969 5.674 4.399) 8.204 16.217 ( 2.825 2.282 1.357) 3.877 17.707 ( -5.896 0.074 11.046) 12.522 18.081 ( -4.365 -4.102 7.612) 9.686 18.779 ( -3.625 7.546 -11.609) 14.312 19.427 ( 2.214 -3.343 -2.738) 4.856 ======================= Grid point 212 (104/260) ======================= q-point: ( 0.30 0.25 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 400 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.888 ( 7.224 11.966 2.083) 14.132 2.234 ( -0.625 3.699 14.541) 15.017 2.865 ( -1.361 -1.294 4.643) 5.008 2.983 ( 2.196 -0.147 1.537) 2.685 3.938 ( 0.880 3.674 -1.356) 4.014 4.481 ( -6.098 2.614 1.534) 6.810 5.059 ( 4.649 -2.086 2.185) 5.545 5.199 ( 0.764 -5.984 -0.548) 6.058 5.682 ( -11.179 -3.780 11.151) 16.236 5.894 ( 2.203 -3.373 -3.726) 5.488 6.129 ( 8.512 -4.635 -5.563) 11.175 6.288 ( -0.987 -1.341 4.784) 5.066 6.518 ( 2.650 4.115 -1.852) 5.233 6.837 ( 0.190 5.645 -1.476) 5.838 7.100 ( 0.102 -0.061 -7.577) 7.578 7.153 ( 9.864 0.800 -0.192) 9.898 7.850 ( -3.052 13.496 4.640) 14.594 8.061 ( 3.132 1.261 -6.359) 7.200 8.314 ( -0.901 9.343 1.547) 9.513 8.443 ( -2.653 9.502 -1.750) 10.019 8.842 ( -7.334 -2.654 -2.753) 8.271 9.029 ( -1.353 -1.089 -5.092) 5.380 9.128 ( -1.874 0.382 -3.113) 3.654 9.257 ( -9.379 -1.531 -3.903) 10.273 9.762 ( 4.128 -5.058 -2.795) 7.102 10.010 ( -9.685 -2.454 5.464) 11.387 10.065 ( -0.526 -2.103 5.323) 5.748 10.248 ( -2.403 2.183 2.789) 4.280 10.556 ( -7.601 -1.660 -0.112) 7.781 10.895 ( 0.300 2.312 -0.997) 2.535 11.138 ( -3.437 4.261 3.506) 6.501 11.610 ( -9.367 -0.526 -10.178) 13.842 11.762 ( -5.912 3.723 0.114) 6.988 12.105 ( 3.089 -1.420 9.158) 9.769 12.589 ( 6.190 -8.410 -0.824) 10.475 12.883 ( 5.021 -13.756 -5.572) 15.668 13.379 ( 1.108 -0.024 1.738) 2.061 13.877 ( 2.493 3.521 7.711) 8.836 14.292 ( -1.552 -6.685 -3.201) 7.573 14.694 ( 4.780 2.797 -5.756) 7.988 14.811 ( 16.026 1.451 3.420) 16.450 15.899 ( -3.645 -1.742 -4.042) 5.715 16.185 ( 7.873 4.599 5.001) 10.399 16.284 ( 1.274 1.520 4.279) 4.717 17.574 ( -13.170 -1.937 6.702) 14.903 18.029 ( -4.084 -2.863 2.506) 5.582 18.672 ( 0.167 6.483 -10.595) 12.423 19.427 ( -0.474 -1.000 -3.872) 4.027 ======================= Grid point 213 (105/260) ======================= q-point: ( 0.40 0.25 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 404 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.988 ( 0.915 5.779 2.278) 6.279 2.291 ( -0.501 -0.930 8.914) 8.977 2.795 ( -6.940 -1.934 -0.682) 7.237 2.983 ( -2.063 0.250 -1.575) 2.608 3.956 ( 1.386 4.437 -0.056) 4.649 4.376 ( -4.892 3.265 0.059) 5.881 5.081 ( -5.307 -1.520 -5.836) 8.033 5.198 ( 3.664 -4.046 -3.951) 6.738 5.549 ( -9.414 -6.269 13.615) 17.700 5.960 ( 5.523 -3.682 1.076) 6.724 6.201 ( 1.794 0.955 -6.692) 6.994 6.329 ( 2.745 -2.352 3.115) 4.772 6.522 ( 0.047 2.839 -1.572) 3.245 6.858 ( 1.840 4.713 -2.991) 5.878 7.070 ( 0.933 3.756 -4.892) 6.238 7.350 ( 10.412 1.580 -0.826) 10.563 7.795 ( -5.394 15.416 4.906) 17.054 8.051 ( -0.311 1.420 -5.540) 5.727 8.298 ( -1.025 5.765 -0.994) 5.940 8.373 ( -3.538 9.849 -3.262) 10.962 8.659 ( -7.559 -1.561 -5.351) 9.392 8.911 ( -4.068 -3.691 -10.392) 11.755 9.044 ( -4.432 -1.064 -2.402) 5.153 9.149 ( -0.512 1.074 -0.890) 1.486 9.849 ( -8.876 -1.227 5.250) 10.385 9.868 ( 4.928 -5.415 3.330) 8.043 10.047 ( -2.443 -1.700 0.762) 3.072 10.271 ( 1.682 -0.665 4.785) 5.116 10.459 ( -3.215 -2.250 2.035) 4.420 10.901 ( 0.307 2.839 -0.963) 3.013 11.162 ( 1.587 -0.275 5.600) 5.827 11.378 ( -5.934 0.708 -13.921) 15.150 11.680 ( -3.048 3.962 3.404) 6.048 12.223 ( 2.462 0.255 10.351) 10.643 12.625 ( 0.026 -9.258 -4.912) 10.480 12.990 ( 7.705 -11.368 -0.969) 13.768 13.407 ( 0.116 -1.099 3.924) 4.076 13.936 ( -2.683 0.819 9.764) 10.159 14.292 ( 2.988 -5.098 -1.052) 6.002 14.766 ( 6.015 7.570 -3.682) 10.347 15.130 ( 15.696 0.803 -0.983) 15.747 15.797 ( -4.182 -2.948 -4.700) 6.947 16.305 ( -2.122 2.726 6.122) 7.029 16.375 ( 7.279 2.093 7.170) 10.430 17.321 ( -14.629 -2.718 1.007) 14.913 17.951 ( -4.392 -3.958 -1.725) 6.159 18.657 ( 4.121 7.436 -7.916) 11.616 19.360 ( -3.001 0.148 -6.330) 7.007 ======================= Grid point 214 (106/260) ======================= q-point: (-0.50 0.25 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 400 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.948 ( -6.884 1.494 5.202) 8.757 2.322 ( -1.069 -4.583 2.930) 5.543 2.589 ( -11.403 -2.814 -6.777) 13.560 2.908 ( -4.352 1.282 -1.393) 4.745 3.989 ( 2.068 4.392 -0.353) 4.867 4.306 ( -2.163 3.886 -0.317) 4.459 4.856 ( -10.758 -0.182 -11.027) 15.407 5.202 ( -2.063 -3.954 -3.193) 5.485 5.509 ( -3.462 -3.316 11.729) 12.671 6.088 ( 4.824 -4.654 0.839) 6.755 6.170 ( 0.202 3.304 -1.217) 3.527 6.382 ( 0.821 0.576 0.736) 1.244 6.519 ( -0.947 0.424 0.891) 1.367 6.856 ( 1.999 1.550 -4.642) 5.286 7.070 ( 1.535 6.415 -3.723) 7.575 7.525 ( 7.928 2.175 -0.856) 8.266 7.702 ( -7.429 15.652 3.594) 17.694 7.994 ( -1.855 2.324 -5.433) 6.194 8.207 ( -6.309 4.735 -0.688) 7.918 8.330 ( 2.254 4.881 -8.126) 9.744 8.502 ( -4.084 1.168 -8.817) 9.787 8.775 ( -3.117 -0.163 -10.538) 10.991 9.004 ( 0.966 -2.122 1.961) 3.047 9.186 ( 3.640 1.752 2.995) 5.029 9.749 ( -4.346 -0.178 3.369) 5.502 9.925 ( -1.061 -0.977 2.394) 2.795 10.050 ( 3.310 -4.730 -1.331) 5.924 10.356 ( 3.748 -4.093 4.693) 7.268 10.455 ( 1.016 -3.174 4.563) 5.650 10.885 ( -1.987 2.437 1.312) 3.407 11.189 ( -1.644 1.361 -2.440) 3.242 11.259 ( 2.391 -5.723 -9.244) 11.132 11.699 ( 1.185 4.759 7.578) 9.026 12.300 ( -0.896 -0.502 5.824) 5.914 12.579 ( -0.047 -11.567 -4.812) 12.528 13.140 ( 7.330 -4.455 0.527) 8.594 13.439 ( -0.291 0.458 7.334) 7.354 13.905 ( -5.392 1.687 7.616) 9.482 14.358 ( 2.679 -5.811 0.803) 6.449 14.883 ( 7.058 8.632 0.395) 11.157 15.389 ( 12.800 -0.318 -4.798) 13.673 15.678 ( -5.041 -4.232 -4.980) 8.254 16.283 ( -5.062 3.028 10.520) 12.061 16.547 ( 4.982 0.028 8.694) 10.020 17.058 ( -10.785 -1.988 -3.645) 11.556 17.837 ( -5.055 -5.608 -5.581) 9.389 18.727 ( 7.336 9.420 -5.435) 13.118 19.240 ( -4.469 0.400 -8.429) 9.549 ======================= Grid point 215 (107/260) ======================= q-point: (-0.40 0.25 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 404 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.810 ( -11.084 -0.191 6.895) 13.055 2.160 ( -17.609 -0.637 -2.787) 17.840 2.411 ( -0.560 -8.761 -4.649) 9.934 2.807 ( -5.307 0.535 -0.498) 5.357 4.026 ( 2.304 4.024 -1.766) 4.962 4.292 ( 0.703 4.327 0.134) 4.385 4.573 ( -11.047 1.443 -9.882) 14.892 5.105 ( -5.682 -3.071 -1.380) 6.605 5.504 ( -3.660 0.062 5.788) 6.849 6.104 ( 0.857 0.988 -3.340) 3.588 6.204 ( -2.285 -0.613 2.298) 3.298 6.395 ( 1.193 2.557 2.437) 3.729 6.490 ( -2.869 -1.282 5.726) 6.532 6.928 ( 7.526 -0.658 -3.247) 8.223 7.080 ( 1.725 6.752 -3.208) 7.672 7.550 ( -8.705 11.245 1.186) 14.270 7.649 ( 5.650 2.728 -2.123) 6.623 7.905 ( -3.882 2.496 -5.392) 7.097 8.086 ( -6.384 2.607 -1.286) 7.015 8.307 ( 1.503 6.214 -10.825) 12.572 8.438 ( 3.541 2.697 -8.566) 9.653 8.690 ( 1.211 3.065 -8.577) 9.188 9.050 ( 1.151 -1.544 2.438) 3.107 9.338 ( 7.873 3.092 7.849) 11.539 9.710 ( -0.112 -0.923 -0.547) 1.079 9.937 ( 1.018 0.413 3.622) 3.785 10.099 ( 3.072 -3.543 -3.540) 5.875 10.451 ( 4.029 -2.779 2.080) 5.318 10.569 ( 6.227 -6.623 7.543) 11.813 10.851 ( -2.226 2.408 1.511) 3.611 11.147 ( 2.520 -0.413 -10.222) 10.536 11.274 ( 1.633 -9.154 -1.684) 9.450 11.791 ( 2.238 3.004 9.518) 10.229 12.254 ( -3.415 -3.561 -2.550) 5.554 12.580 ( 0.062 -10.264 1.047) 10.317 13.264 ( 5.979 1.392 -2.074) 6.480 13.480 ( -1.944 3.911 10.596) 11.460 13.849 ( -3.823 2.776 5.279) 7.084 14.380 ( -0.385 -5.337 -0.962) 5.437 15.026 ( 5.246 4.815 4.899) 8.643 15.506 ( -1.125 -2.190 -9.293) 9.613 15.591 ( 4.198 -3.185 -4.486) 6.921 16.243 ( -8.280 -0.690 16.447) 18.427 16.643 ( -1.252 -1.059 8.982) 9.131 16.925 ( 1.488 1.282 -4.527) 4.935 17.686 ( -6.240 -7.055 -8.377) 12.604 18.867 ( 10.028 11.870 -4.196) 16.095 19.095 ( -4.613 0.590 -8.699) 9.864 ======================= Grid point 216 (108/260) ======================= q-point: (-0.30 0.25 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 400 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.584 ( -17.144 -2.282 1.363) 17.349 1.792 ( -16.976 6.878 6.516) 19.440 2.406 ( 0.413 -9.470 -0.452) 9.490 2.704 ( -5.510 -1.851 1.780) 6.079 4.049 ( 1.725 3.606 -3.856) 5.554 4.290 ( -4.586 4.099 -2.773) 6.747 4.375 ( -0.734 4.169 -1.195) 4.398 4.987 ( -5.898 -1.418 0.140) 6.068 5.448 ( -3.635 2.496 1.688) 4.721 6.104 ( 0.573 -0.377 -2.515) 2.607 6.127 ( -5.187 -0.798 3.418) 6.263 6.407 ( -1.770 6.039 1.045) 6.379 6.520 ( -0.116 -2.210 9.313) 9.572 7.064 ( 7.350 -1.558 -2.629) 7.960 7.090 ( 0.775 3.489 -2.518) 4.371 7.402 ( -5.595 5.448 -2.106) 8.089 7.734 ( 4.144 3.182 -4.199) 6.703 7.793 ( -3.177 3.452 -3.616) 5.923 7.958 ( -5.191 0.062 -1.112) 5.309 8.281 ( 3.228 10.245 -10.623) 15.107 8.488 ( 4.818 4.670 -4.841) 8.274 8.714 ( 5.804 5.894 -7.659) 11.274 9.075 ( 0.214 -1.195 2.356) 2.650 9.506 ( 4.213 1.866 4.153) 6.203 9.801 ( 10.055 -1.177 1.850) 10.291 9.992 ( 0.852 -0.712 6.121) 6.221 10.134 ( 3.749 -1.629 -5.742) 7.048 10.554 ( 6.033 -0.665 0.743) 6.115 10.741 ( 4.897 -5.508 6.677) 9.945 10.821 ( 0.269 0.493 -1.068) 1.206 11.177 ( 6.355 -6.738 -7.015) 11.619 11.291 ( 1.056 -7.069 -0.938) 7.209 11.897 ( 2.735 0.416 9.737) 10.122 12.187 ( -1.120 -3.261 -3.282) 4.761 12.549 ( -4.569 -9.150 1.352) 10.316 13.338 ( 3.497 3.377 -5.099) 7.045 13.464 ( -5.695 7.852 8.003) 12.575 13.837 ( -1.265 3.522 4.763) 6.057 14.339 ( -1.884 -5.196 -4.363) 7.042 15.091 ( -3.415 -3.739 4.946) 7.079 15.400 ( -2.589 -0.117 -2.982) 3.951 15.651 ( 4.599 -0.086 -9.138) 10.230 16.137 ( -12.912 -9.985 15.215) 22.314 16.706 ( 4.248 2.655 10.142) 11.311 17.019 ( 6.937 2.472 1.006) 7.433 17.492 ( -8.037 -7.576 -8.698) 14.059 18.924 ( -2.568 2.532 -9.736) 10.383 19.096 ( 11.133 12.785 -1.721) 17.040 ======================= Grid point 217 (109/260) ======================= q-point: (-0.20 0.25 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 404 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.226 ( -16.102 6.267 1.755) 17.367 1.626 ( -10.486 10.054 18.964) 23.889 2.396 ( -3.344 -2.407 4.886) 6.391 2.637 ( -3.145 -6.545 5.421) 9.062 4.033 ( 0.166 3.364 -6.861) 7.643 4.203 ( -1.226 6.089 3.135) 6.958 4.439 ( 3.708 4.488 3.336) 6.709 4.888 ( -4.499 0.643 1.072) 4.670 5.418 ( 0.402 1.170 0.059) 1.238 6.078 ( -3.099 -0.346 5.750) 6.541 6.088 ( -0.440 -2.483 -2.461) 3.524 6.373 ( -1.843 6.294 0.462) 6.574 6.551 ( -2.383 -0.139 8.276) 8.613 7.071 ( -0.556 -0.031 -3.268) 3.315 7.130 ( 0.062 -4.692 -2.740) 5.434 7.322 ( -0.866 -2.000 -4.454) 4.959 7.665 ( -1.886 7.275 -6.511) 9.944 7.866 ( 6.060 2.618 1.033) 6.681 7.890 ( -0.668 2.507 -0.889) 2.742 8.310 ( 5.282 14.357 -6.988) 16.819 8.549 ( 4.339 2.128 -3.197) 5.795 8.789 ( 5.976 10.395 -6.364) 13.574 9.097 ( 0.416 -1.416 2.900) 3.254 9.593 ( 5.172 -1.559 -1.601) 5.634 10.000 ( 4.319 1.885 -1.003) 4.818 10.039 ( 1.542 -5.855 4.999) 7.851 10.203 ( 7.900 -1.632 -2.188) 8.359 10.698 ( 8.342 0.446 0.434) 8.365 10.727 ( -3.974 0.327 0.322) 4.000 10.951 ( 8.589 -5.071 2.115) 10.196 11.260 ( 4.168 -6.394 -5.139) 9.201 11.353 ( 6.866 -6.783 2.960) 10.095 12.021 ( 3.612 -1.683 9.219) 10.043 12.167 ( 0.356 -2.808 -2.458) 3.748 12.429 ( -7.381 -5.922 0.120) 9.464 13.294 ( -5.694 2.092 -3.157) 6.838 13.400 ( -2.567 10.243 -2.723) 10.905 13.815 ( -4.321 4.995 3.602) 7.523 14.264 ( -2.254 -5.279 -7.270) 9.263 14.966 ( -8.967 -10.106 -0.444) 13.518 15.367 ( -4.393 0.051 8.326) 9.414 15.645 ( -0.504 1.042 -6.169) 6.277 15.987 ( -7.561 -11.719 5.596) 15.027 16.900 ( 4.966 1.255 3.979) 6.486 17.104 ( 0.334 0.961 2.415) 2.621 17.372 ( 2.075 -4.797 6.657) 8.464 18.826 ( -1.349 1.874 -6.589) 6.982 19.317 ( 12.330 14.610 -4.399) 19.617 ======================= Grid point 218 (110/260) ======================= q-point: (-0.10 0.25 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 400 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.132 ( 3.999 19.287 10.176) 22.171 1.590 ( -7.104 13.198 22.526) 27.057 2.346 ( -6.745 6.751 13.389) 16.442 2.657 ( 0.494 -10.151 8.174) 13.043 4.004 ( 1.384 1.483 -6.440) 6.752 4.285 ( 5.603 8.038 9.345) 13.540 4.533 ( 2.979 3.838 5.495) 7.335 4.837 ( -1.396 2.209 1.321) 2.928 5.466 ( 4.238 -2.701 0.084) 5.026 6.054 ( -0.940 -1.187 -2.929) 3.297 6.072 ( -1.834 -1.019 5.687) 6.062 6.344 ( -1.142 4.144 -1.018) 4.417 6.543 ( -3.759 1.010 9.144) 9.938 7.021 ( -4.552 -0.883 -2.302) 5.176 7.073 ( 0.254 -9.730 -6.772) 11.857 7.262 ( -3.203 -6.986 -2.723) 8.153 7.659 ( 5.651 9.312 -7.525) 13.239 7.866 ( -0.491 8.631 -0.151) 8.646 8.030 ( 8.087 0.646 2.311) 8.436 8.379 ( 4.561 16.682 -2.648) 17.496 8.635 ( 6.253 0.030 -0.969) 6.327 8.855 ( 4.797 12.429 -5.662) 14.476 9.120 ( -0.247 -1.220 2.985) 3.234 9.686 ( 5.521 -3.476 -3.456) 7.383 10.008 ( -0.963 -0.310 1.812) 2.075 10.049 ( 0.411 -2.732 -6.959) 7.487 10.337 ( 2.873 -7.825 -1.305) 8.437 10.636 ( -4.380 -0.443 -1.568) 4.673 10.877 ( 8.456 -0.318 1.154) 8.541 11.128 ( 7.179 -4.280 3.528) 9.073 11.322 ( 4.546 -0.580 0.988) 4.688 11.557 ( 12.823 -8.322 -0.439) 15.293 12.075 ( -4.822 -3.468 5.961) 8.415 12.146 ( -2.422 -2.498 -3.422) 4.880 12.353 ( 1.911 -2.487 1.736) 3.585 13.109 ( -9.699 2.858 -8.522) 13.224 13.296 ( -5.246 10.105 -4.494) 12.240 13.742 ( -3.698 6.539 2.145) 7.813 14.150 ( -5.339 -3.162 -5.353) 8.195 14.795 ( -7.044 -12.054 -2.690) 14.218 15.257 ( -15.474 -8.143 13.544) 22.118 15.616 ( 2.122 -0.235 0.265) 2.152 15.938 ( 0.941 -3.098 -3.928) 5.090 16.709 ( -13.031 4.063 -11.540) 17.875 17.310 ( 9.774 0.459 11.848) 15.366 17.611 ( 10.301 -7.549 20.851) 24.451 18.806 ( 2.579 2.523 -3.504) 5.030 19.474 ( 7.332 11.119 -9.257) 16.220 ======================= Grid point 219 (111/260) ======================= q-point: ( 0.00 0.38 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 400 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.871 ( 14.491 20.582 6.374) 25.966 1.955 ( -0.653 16.791 17.055) 23.942 2.440 ( 5.371 -1.975 6.308) 8.517 2.524 ( 2.017 -11.989 13.647) 18.277 4.034 ( -1.203 4.089 -2.497) 4.940 4.623 ( -1.738 -1.312 9.010) 9.270 4.680 ( 7.830 8.165 13.121) 17.324 4.888 ( 0.503 0.508 6.412) 6.452 5.459 ( 5.279 -4.557 1.034) 7.050 5.905 ( -4.493 -3.464 -5.296) 7.762 6.125 ( -1.635 1.041 5.890) 6.201 6.351 ( -1.663 3.168 -5.875) 6.878 6.587 ( -3.147 2.871 10.166) 11.022 6.692 ( -3.402 -11.839 -8.018) 14.698 7.000 ( -1.869 -0.738 -3.243) 3.815 7.085 ( 1.060 -3.384 -0.501) 3.582 7.834 ( 4.565 2.006 1.034) 5.092 8.091 ( 3.222 6.583 -1.963) 7.588 8.192 ( 7.286 2.150 0.317) 7.603 8.723 ( 3.101 5.401 -0.227) 6.232 8.817 ( 7.847 9.065 -0.353) 11.995 9.072 ( -1.139 0.813 1.827) 2.301 9.175 ( 2.858 10.175 -7.318) 12.855 9.689 ( 4.825 -4.191 -6.294) 8.970 9.885 ( -4.470 -7.973 -2.958) 9.607 9.973 ( -2.555 0.458 -5.683) 6.248 10.130 ( -2.852 -6.636 0.109) 7.224 10.528 ( -4.626 0.236 1.319) 4.816 10.981 ( 0.020 1.039 1.038) 1.469 11.180 ( 0.429 -0.303 5.842) 5.866 11.438 ( 3.115 -0.846 7.656) 8.309 11.615 ( 13.662 -8.819 -3.979) 16.741 11.850 ( -8.442 -5.358 -2.632) 10.340 12.093 ( -0.521 2.482 -3.452) 4.283 12.375 ( 2.137 -3.176 3.192) 4.984 12.921 ( -11.159 4.304 -10.911) 16.189 13.478 ( 1.584 12.801 -7.664) 15.004 13.829 ( -1.878 4.282 3.151) 5.639 14.006 ( 1.876 -3.338 -5.811) 6.959 14.450 ( -1.827 -9.719 -3.347) 10.440 14.786 ( -20.638 -6.886 14.092) 25.921 15.734 ( 7.291 0.065 4.477) 8.556 15.965 ( 3.446 0.690 -5.511) 6.536 16.516 ( -9.328 3.453 -7.404) 12.400 17.588 ( 6.314 3.197 13.099) 14.889 17.760 ( 6.267 -6.060 18.495) 20.446 18.946 ( 7.475 2.902 -0.953) 8.075 19.526 ( -5.197 1.556 -13.216) 14.286 ======================= Grid point 220 (112/260) ======================= q-point: ( 0.10 0.38 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 400 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.030 ( 1.656 19.296 7.323) 20.706 2.147 ( 6.727 12.471 10.212) 17.466 2.603 ( 5.265 -2.265 11.463) 12.816 2.684 ( 6.270 -6.123 10.321) 13.540 4.003 ( -0.537 3.298 -1.572) 3.693 4.621 ( -4.224 -2.639 9.173) 10.438 4.860 ( 1.415 3.019 12.974) 13.396 4.983 ( 5.388 1.989 4.889) 7.543 5.614 ( 9.930 -2.260 1.103) 10.243 5.793 ( -2.518 -5.471 -4.825) 7.717 6.053 ( -9.580 -1.887 3.705) 10.444 6.315 ( 1.602 2.912 -5.115) 6.100 6.520 ( -4.002 -0.827 1.569) 4.377 6.715 ( 5.072 -7.371 0.218) 8.951 6.956 ( -0.235 -0.155 -2.267) 2.284 7.137 ( 3.535 -0.494 -0.912) 3.684 7.928 ( 4.279 3.440 1.552) 5.706 8.118 ( 1.296 6.655 -2.605) 7.263 8.331 ( 6.532 2.737 0.859) 7.134 8.762 ( 0.247 9.250 -0.204) 9.256 8.940 ( 3.050 1.439 -0.176) 3.377 9.063 ( -0.158 5.428 4.701) 7.182 9.172 ( 1.673 7.214 -6.711) 9.994 9.659 ( -5.895 -5.562 -4.714) 9.377 9.752 ( -5.198 -10.421 -11.600) 16.437 9.911 ( 2.973 -0.095 -4.625) 5.499 10.105 ( -2.853 -4.660 6.184) 8.252 10.466 ( -2.371 4.328 1.176) 5.074 10.897 ( -7.885 -0.252 -0.823) 7.932 11.123 ( -8.774 3.077 4.216) 10.209 11.443 ( -10.092 -5.575 5.917) 12.959 11.732 ( 4.214 -0.491 0.322) 4.255 11.876 ( 9.113 -10.260 -0.677) 13.740 12.055 ( 1.451 1.275 -7.500) 7.745 12.343 ( -8.226 5.427 1.252) 9.934 12.696 ( -4.393 -5.472 -7.777) 10.475 13.458 ( 0.782 8.244 -7.366) 11.083 13.829 ( 2.228 5.420 -1.694) 6.100 14.112 ( 9.597 -2.457 -2.370) 10.186 14.458 ( 5.046 -8.032 -4.811) 10.636 14.531 ( -13.401 -4.655 14.155) 20.041 15.919 ( 8.125 0.847 5.354) 9.767 15.983 ( 1.635 0.068 -4.327) 4.626 16.336 ( -5.255 3.888 -4.471) 7.920 17.723 ( -0.477 2.672 12.629) 12.918 17.947 ( 1.528 -5.169 15.244) 16.169 19.061 ( 2.262 7.545 -5.282) 9.484 19.334 ( -2.957 -4.264 -9.398) 10.736 ======================= Grid point 221 (113/260) ======================= q-point: ( 0.20 0.38 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 400 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.103 ( 3.165 18.353 1.699) 18.701 2.275 ( -0.071 6.733 11.399) 13.239 2.736 ( 1.742 -7.401 8.758) 11.598 2.869 ( 6.638 -0.216 5.380) 8.547 3.999 ( 0.897 3.396 -1.091) 3.678 4.580 ( -5.147 -1.799 6.706) 8.643 4.942 ( 0.481 0.494 11.411) 11.432 5.077 ( 1.571 -1.305 1.607) 2.599 5.752 ( -0.127 -2.717 2.408) 3.633 5.844 ( -7.379 -1.555 0.286) 7.547 5.871 ( 10.723 -3.604 -2.811) 11.656 6.302 ( -1.691 0.648 -0.040) 1.812 6.523 ( 3.761 1.361 -0.972) 4.116 6.808 ( 4.030 -8.421 -1.993) 9.546 6.965 ( 2.976 2.567 -2.992) 4.940 7.197 ( 3.020 3.310 0.740) 4.542 8.017 ( 3.798 4.168 1.794) 5.918 8.118 ( 0.353 6.819 -2.199) 7.174 8.448 ( 4.617 3.828 1.317) 6.141 8.697 ( -5.816 9.059 -1.107) 10.822 8.923 ( -3.286 -1.792 -1.586) 4.065 9.113 ( 0.240 7.624 2.883) 8.155 9.166 ( 1.291 3.175 -5.466) 6.451 9.426 ( -11.656 -6.648 -7.808) 15.525 9.626 ( -0.384 -9.377 -9.603) 13.427 9.979 ( 3.043 -0.341 2.612) 4.024 10.064 ( -5.549 -3.794 6.091) 9.071 10.439 ( -1.818 9.017 0.246) 9.202 10.709 ( -10.088 -1.378 -1.098) 10.241 10.967 ( -6.912 2.145 1.551) 7.402 11.240 ( -10.700 -6.536 1.455) 12.622 11.801 ( -5.646 -0.158 -0.418) 5.664 11.918 ( 4.115 -0.253 2.129) 4.640 12.094 ( -6.792 3.718 -1.487) 7.885 12.237 ( 9.364 -2.026 -2.527) 9.908 12.622 ( -1.486 -12.118 -3.054) 12.585 13.422 ( -0.256 3.487 -4.766) 5.911 13.887 ( 3.616 5.638 0.046) 6.698 14.192 ( -1.142 -7.596 -2.058) 7.952 14.536 ( 8.439 -1.523 2.208) 8.855 14.592 ( 9.641 -0.207 2.365) 9.929 15.953 ( -1.932 -0.819 -3.938) 4.463 16.106 ( 6.932 2.129 6.002) 9.413 16.273 ( 0.566 2.825 -1.012) 3.054 17.716 ( -8.251 0.673 11.123) 13.866 18.010 ( -2.394 -2.747 9.233) 9.926 18.917 ( -5.842 5.671 -12.992) 15.332 19.365 ( 4.881 -2.680 -1.677) 5.816 ======================= Grid point 222 (114/260) ======================= q-point: ( 0.30 0.38 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 400 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.165 ( 3.366 14.647 -3.937) 15.536 2.295 ( -4.391 2.241 10.510) 11.609 2.780 ( -1.309 -6.973 3.786) 8.042 2.976 ( 2.017 -0.603 1.957) 2.875 4.019 ( 1.616 3.880 -0.846) 4.288 4.506 ( -5.607 -0.250 3.329) 6.526 5.040 ( 2.660 -0.028 9.626) 9.987 5.090 ( 0.404 -4.151 -1.420) 4.405 5.592 ( -12.828 -4.288 4.194) 14.161 5.830 ( 3.698 -2.738 -0.100) 4.603 6.119 ( 12.361 2.661 -3.879) 13.226 6.267 ( -2.080 -1.177 2.276) 3.300 6.596 ( 3.099 4.070 -2.864) 5.863 6.854 ( 4.000 -6.392 -2.261) 7.872 7.021 ( 4.865 0.619 -6.269) 7.960 7.280 ( 4.555 5.621 3.347) 7.971 8.081 ( 1.951 0.577 -3.971) 4.462 8.110 ( -0.422 11.902 3.616) 12.446 8.477 ( -3.634 5.697 -0.975) 6.827 8.617 ( -0.104 6.500 2.430) 6.940 8.787 ( -9.281 -2.968 -3.802) 10.459 9.037 ( -7.138 2.588 -7.937) 10.984 9.124 ( -2.065 0.085 -5.296) 5.685 9.212 ( -4.826 -2.601 -5.274) 7.608 9.634 ( 4.423 -7.500 -1.200) 8.789 9.948 ( -9.634 -2.856 9.499) 13.828 10.041 ( 0.227 -0.614 0.628) 0.907 10.387 ( -2.875 10.025 -0.626) 10.447 10.530 ( -7.448 -0.504 0.468) 7.480 10.912 ( -0.053 -1.365 -0.767) 1.567 11.096 ( -4.443 -5.525 1.544) 7.256 11.601 ( -9.864 -0.324 -5.749) 11.421 11.902 ( -6.828 8.468 -1.435) 10.972 12.084 ( 5.048 -0.645 7.411) 8.990 12.442 ( 6.647 -5.547 1.480) 8.783 12.598 ( 3.596 -13.319 -2.172) 13.965 13.398 ( 0.058 1.202 -1.819) 2.181 13.945 ( -0.263 3.649 6.738) 7.667 14.159 ( 0.221 -6.438 -0.959) 6.513 14.715 ( 11.213 0.024 -6.498) 12.959 14.864 ( 14.505 2.921 3.742) 15.262 15.862 ( -4.563 -1.640 -4.181) 6.403 16.263 ( 5.509 2.498 6.458) 8.849 16.316 ( 2.316 1.811 2.701) 3.993 17.545 ( -14.159 -0.887 5.547) 15.232 17.983 ( -4.452 -1.610 4.067) 6.241 18.781 ( -0.343 4.137 -9.799) 10.642 19.411 ( 1.116 -0.579 -3.702) 3.910 ======================= Grid point 223 (115/260) ======================= q-point: ( 0.40 0.38 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 400 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.148 ( -3.299 8.849 -3.153) 9.957 2.265 ( -2.706 -1.039 3.057) 4.213 2.722 ( -5.667 -5.151 -1.602) 7.824 2.981 ( -1.782 -0.356 -0.284) 1.840 4.047 ( 1.839 4.257 -0.551) 4.670 4.419 ( -4.488 0.800 1.253) 4.728 5.046 ( -3.825 -2.219 -4.078) 6.016 5.143 ( 2.623 -0.858 0.828) 2.881 5.422 ( -8.083 -5.222 11.604) 15.075 5.915 ( 4.633 -1.462 1.726) 5.156 6.205 ( 0.146 -0.306 -2.325) 2.350 6.327 ( 6.054 1.412 0.684) 6.254 6.585 ( -0.765 3.174 -3.943) 5.119 6.922 ( 1.693 1.244 -3.371) 3.972 7.082 ( 7.030 -1.002 -6.935) 9.926 7.408 ( 6.435 3.170 2.449) 7.580 8.057 ( -0.696 4.899 -2.385) 5.493 8.122 ( -2.360 10.753 2.755) 11.348 8.377 ( -4.009 2.265 -2.920) 5.453 8.520 ( -10.552 0.483 -4.508) 11.485 8.694 ( -0.015 6.733 1.972) 7.016 8.822 ( -5.602 -3.950 -11.526) 13.410 9.025 ( -3.910 -0.987 -5.934) 7.174 9.153 ( -0.046 -0.422 -0.465) 0.630 9.740 ( 3.939 -5.920 4.371) 8.346 9.842 ( -4.190 -0.449 4.673) 6.293 10.005 ( -3.775 -1.997 -0.091) 4.272 10.336 ( -1.611 4.476 -0.419) 4.775 10.440 ( -2.907 1.861 1.361) 3.710 10.912 ( 0.051 -3.060 0.246) 3.070 11.078 ( -0.297 -4.174 2.470) 4.859 11.401 ( -4.752 1.084 -11.627) 12.607 11.792 ( -4.828 5.415 3.467) 8.040 12.220 ( 3.180 -0.463 8.794) 9.363 12.422 ( -3.336 -9.978 -4.780) 11.556 12.805 ( 12.980 -6.175 3.914) 14.897 13.409 ( 0.923 0.618 2.618) 2.844 13.956 ( -3.934 1.279 10.379) 11.173 14.193 ( 3.150 -4.432 -0.384) 5.451 14.889 ( 10.399 4.353 -4.819) 12.260 15.150 ( 13.660 1.148 -0.452) 13.716 15.735 ( -5.537 -2.774 -4.962) 7.936 16.355 ( -1.304 2.028 7.779) 8.144 16.411 ( 5.095 1.354 5.781) 7.824 17.278 ( -14.153 -1.396 -0.564) 14.233 17.895 ( -5.801 -1.716 -0.192) 6.052 18.776 ( 4.538 4.289 -5.948) 8.624 19.364 ( -2.381 0.144 -6.804) 7.210 ======================= Grid point 224 (116/260) ======================= q-point: (-0.50 0.38 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 400 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.019 ( -7.703 4.660 -2.380) 9.312 2.214 ( -3.471 -5.230 -0.979) 6.353 2.545 ( -10.026 -1.423 -5.476) 11.513 2.907 ( -4.509 -1.274 -4.041) 6.188 4.083 ( 2.191 4.586 -0.515) 5.109 4.361 ( -1.884 1.467 0.743) 2.501 4.874 ( -9.093 1.912 -8.241) 12.420 5.122 ( -4.021 -3.985 -0.614) 5.694 5.439 ( -0.078 -3.060 12.058) 12.440 6.018 ( 4.016 -2.454 2.005) 5.116 6.210 ( 0.912 1.441 3.208) 3.633 6.409 ( 1.397 0.427 0.084) 1.463 6.549 ( -1.068 2.532 -1.841) 3.308 6.880 ( 0.076 0.808 -7.244) 7.289 7.175 ( 5.021 4.229 -4.437) 7.924 7.543 ( 6.254 -0.189 0.609) 6.287 7.987 ( -9.699 11.446 -0.090) 15.003 8.055 ( -2.535 3.428 -1.774) 4.618 8.269 ( -3.302 2.181 -3.735) 5.441 8.404 ( 0.628 0.835 -4.526) 4.645 8.520 ( -7.504 0.005 -11.040) 13.349 8.813 ( 1.940 4.626 -5.253) 7.263 8.963 ( 1.571 -2.014 -0.215) 2.564 9.198 ( 3.799 -0.318 4.589) 5.966 9.762 ( -3.157 1.421 4.075) 5.347 9.888 ( 3.311 -2.244 0.506) 4.031 9.945 ( 0.369 -5.441 0.112) 5.455 10.337 ( 1.798 0.853 0.491) 2.050 10.421 ( 0.432 0.395 0.601) 0.839 10.916 ( -0.833 0.055 2.435) 2.574 11.078 ( -0.945 -6.526 2.728) 7.135 11.267 ( -0.764 2.229 -16.987) 17.150 11.769 ( -1.383 1.937 8.122) 8.464 12.258 ( -3.885 -4.018 -0.001) 5.589 12.370 ( 1.227 -7.407 1.623) 7.681 13.073 ( 11.883 -1.812 3.040) 12.399 13.472 ( 2.142 1.943 8.377) 8.862 13.929 ( -5.194 0.891 9.517) 10.878 14.253 ( 2.453 -4.235 1.044) 5.004 15.045 ( 7.288 7.027 -1.377) 10.218 15.375 ( 11.020 -1.231 -3.902) 11.755 15.591 ( -5.592 -3.795 -6.247) 9.203 16.345 ( -6.305 2.791 11.491) 13.401 16.535 ( 3.247 -1.057 7.544) 8.281 17.034 ( -8.226 -0.495 -4.844) 9.559 17.762 ( -6.698 -2.180 -3.664) 7.940 18.873 ( 8.312 5.085 -3.281) 10.282 19.247 ( -4.218 0.215 -9.285) 10.200 ======================= Grid point 225 (117/260) ======================= q-point: (-0.40 0.38 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 400 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.832 ( -9.560 1.706 -4.125) 10.551 2.122 ( -6.702 -4.290 2.078) 8.224 2.304 ( -9.164 0.123 -7.136) 11.616 2.766 ( -6.283 -4.273 -6.484) 9.988 4.120 ( 2.068 4.821 -1.159) 5.373 4.359 ( 0.891 2.001 1.364) 2.580 4.634 ( -9.738 4.423 -7.967) 13.337 5.020 ( -6.122 -5.265 1.407) 8.196 5.501 ( -0.339 -0.068 6.684) 6.692 6.069 ( 0.971 -2.527 -0.422) 2.740 6.244 ( -3.913 3.371 4.360) 6.759 6.400 ( -0.385 -2.453 6.942) 7.372 6.531 ( 0.360 3.882 -1.807) 4.297 6.907 ( 6.036 -1.113 -3.655) 7.144 7.207 ( 1.101 5.978 -4.502) 7.564 7.639 ( 0.217 -0.970 3.615) 3.749 7.752 ( -8.187 6.075 -6.495) 12.088 7.976 ( -4.737 3.601 -1.289) 6.088 8.136 ( -7.569 2.312 -7.824) 11.129 8.381 ( 2.583 -0.021 -9.040) 9.402 8.500 ( 8.231 4.087 -3.942) 9.999 8.793 ( 2.222 6.273 -7.810) 10.261 9.030 ( 3.046 -0.389 0.727) 3.155 9.366 ( 8.412 -0.117 9.320) 12.556 9.696 ( -3.254 -0.396 -1.435) 3.578 9.941 ( 2.625 -0.205 2.683) 3.759 10.023 ( 5.306 -3.706 -1.130) 6.571 10.412 ( 5.505 -0.753 0.828) 5.617 10.471 ( 4.173 -2.947 1.218) 5.252 10.902 ( -2.028 2.771 2.056) 4.002 11.096 ( 1.548 -7.942 0.920) 8.143 11.149 ( -0.536 0.153 -14.874) 14.884 11.819 ( 0.904 0.426 8.111) 8.173 12.166 ( -2.958 -4.767 -3.575) 6.652 12.407 ( -0.622 -6.333 4.660) 7.887 13.280 ( 8.337 0.714 -0.332) 8.374 13.578 ( 1.163 4.445 12.287) 13.118 13.886 ( -3.818 1.127 6.691) 7.785 14.286 ( 0.165 -3.735 0.526) 3.776 15.118 ( -1.482 3.848 2.622) 4.887 15.465 ( -2.302 -1.748 -6.278) 6.911 15.529 ( 8.886 -2.470 -7.348) 11.792 16.228 ( -14.557 -0.725 13.851) 20.107 16.628 ( 2.123 -0.378 7.640) 7.938 16.954 ( 2.929 1.312 -3.167) 4.509 17.593 ( -7.705 -2.663 -6.212) 10.249 19.044 ( 9.386 5.868 -3.853) 11.721 19.105 ( -2.321 0.446 -8.022) 8.363 ======================= Grid point 226 (118/260) ======================= q-point: (-0.30 0.38 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 400 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.608 ( -9.912 4.264 -5.113) 11.941 1.972 ( -10.303 9.803 7.590) 16.120 2.179 ( -0.404 -11.040 -4.052) 11.767 2.608 ( -5.891 -7.592 -4.767) 10.727 4.144 ( 1.453 5.075 -2.851) 6.000 4.395 ( -0.698 4.861 0.161) 4.914 4.443 ( -3.311 3.193 -1.390) 4.805 4.923 ( -5.260 -4.667 3.754) 7.971 5.497 ( -2.969 2.342 2.525) 4.547 6.065 ( -0.775 -1.921 -1.039) 2.317 6.139 ( -6.238 0.766 4.183) 7.550 6.492 ( 0.879 -0.771 12.731) 12.784 6.522 ( 0.106 4.591 -3.070) 5.524 7.013 ( 4.738 -2.725 -1.562) 5.684 7.164 ( -1.504 3.880 -5.964) 7.272 7.457 ( -12.480 0.701 0.248) 12.502 7.777 ( 6.853 1.202 -3.916) 7.984 7.863 ( -6.790 2.140 1.864) 7.360 7.980 ( -1.793 2.304 -9.096) 9.553 8.403 ( 5.401 1.156 -9.079) 10.627 8.640 ( 6.798 10.366 -3.724) 12.944 8.837 ( 7.205 4.761 -6.271) 10.672 9.078 ( 2.163 1.649 -0.469) 2.760 9.537 ( 2.343 1.299 1.814) 3.235 9.714 ( 6.771 -6.260 4.568) 10.290 10.002 ( 1.172 0.337 3.477) 3.684 10.113 ( 5.998 -0.037 -5.035) 7.831 10.548 ( 7.635 -0.010 0.418) 7.647 10.595 ( 7.130 -6.857 3.659) 10.548 10.856 ( -3.424 2.357 -0.488) 4.186 11.085 ( 3.950 -2.820 -11.554) 12.532 11.156 ( 2.867 -6.137 2.588) 7.251 11.900 ( 2.898 0.492 6.335) 6.984 12.114 ( -0.763 -3.779 -2.023) 4.353 12.392 ( -3.409 -5.961 3.311) 7.623 13.378 ( 2.254 1.479 -1.935) 3.318 13.625 ( -2.696 6.448 6.950) 9.856 13.891 ( -0.093 1.835 6.052) 6.324 14.261 ( -2.119 -2.502 -2.156) 3.924 15.001 ( -10.628 -4.282 1.061) 11.507 15.430 ( -0.994 2.353 0.520) 2.607 15.644 ( 8.100 -0.455 -8.426) 11.697 15.977 ( -17.953 -5.887 10.768) 21.747 16.747 ( 5.335 1.466 9.131) 10.676 17.066 ( 7.521 1.983 2.263) 8.101 17.390 ( -8.797 -3.126 -6.929) 11.627 18.950 ( -3.428 0.726 -9.562) 10.184 19.293 ( 13.242 6.521 -1.317) 14.819 ======================= Grid point 227 (119/260) ======================= q-point: (-0.20 0.38 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 400 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.454 ( -2.363 15.118 0.319) 15.305 1.874 ( -6.276 13.987 12.884) 20.025 2.201 ( 3.220 -14.313 0.763) 14.690 2.497 ( -3.895 -9.056 0.145) 9.859 4.127 ( -0.312 5.318 -6.181) 8.160 4.352 ( 0.116 7.748 4.566) 8.994 4.500 ( 2.742 1.478 5.225) 6.083 4.870 ( -3.380 -2.575 5.876) 7.251 5.436 ( -3.570 0.840 0.735) 3.741 6.036 ( -1.442 -1.185 0.030) 1.867 6.091 ( -2.078 0.147 4.405) 4.872 6.485 ( -1.807 4.612 -2.557) 5.574 6.561 ( -1.586 0.839 10.506) 10.659 6.985 ( -3.586 -5.801 -7.721) 10.302 7.123 ( -2.463 2.207 -1.124) 3.493 7.257 ( -6.454 -3.482 -2.405) 7.718 7.759 ( -3.794 1.412 1.636) 4.367 7.906 ( 7.132 1.518 -0.543) 7.312 7.958 ( 3.834 4.187 -5.560) 7.946 8.480 ( 7.695 1.048 -6.479) 10.114 8.703 ( 3.446 13.794 -5.480) 15.237 8.962 ( 7.289 3.510 -2.788) 8.557 9.115 ( 2.631 4.967 -2.226) 6.046 9.562 ( 3.195 -1.985 -4.364) 5.762 9.897 ( 5.997 -6.937 5.851) 10.877 10.019 ( -1.721 -0.351 3.734) 4.126 10.184 ( 5.449 -0.312 -8.886) 10.429 10.695 ( 2.306 -2.006 4.125) 5.134 10.724 ( 3.245 0.001 0.747) 3.329 10.844 ( 7.389 -3.587 1.509) 8.351 11.155 ( 9.401 -3.578 -8.578) 13.220 11.248 ( 4.202 -3.877 5.386) 7.855 12.002 ( 3.294 0.073 4.522) 5.595 12.098 ( 0.105 -3.722 -1.636) 4.066 12.329 ( -4.153 -3.710 1.864) 5.873 13.338 ( -4.235 2.138 -3.536) 5.917 13.587 ( -2.723 7.548 -1.159) 8.108 13.908 ( -2.512 3.795 4.759) 6.585 14.186 ( -2.954 -2.566 -5.531) 6.775 14.776 ( -11.739 -7.856 -0.897) 14.154 15.373 ( -11.391 0.381 12.952) 17.252 15.639 ( -6.205 -1.350 -2.750) 6.920 15.830 ( 3.664 -4.175 -2.055) 5.922 16.922 ( 4.494 0.857 3.263) 5.619 17.133 ( -3.670 1.608 2.100) 4.524 17.310 ( 6.210 -1.980 6.840) 9.448 18.856 ( -0.815 1.079 -6.513) 6.652 19.519 ( 10.934 6.172 -4.396) 13.303 ======================= Grid point 228 (120/260) ======================= q-point: (-0.10 0.38 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 400 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.562 ( 10.383 22.166 7.499) 25.600 1.882 ( -2.664 15.781 16.079) 22.687 2.302 ( 5.318 -11.451 4.294) 13.336 2.462 ( -1.922 -9.162 6.946) 11.657 4.077 ( -0.998 5.082 -4.592) 6.922 4.463 ( 6.036 8.823 10.063) 14.681 4.578 ( 1.064 0.560 7.229) 7.328 4.861 ( -1.845 -0.236 7.152) 7.390 5.401 ( 0.121 -3.150 0.694) 3.227 5.998 ( -2.303 -1.791 -2.663) 3.950 6.101 ( -0.302 1.261 5.258) 5.416 6.423 ( -2.603 3.584 -3.340) 5.548 6.575 ( -2.744 2.065 9.278) 9.893 6.847 ( -5.174 -10.025 -8.926) 14.385 7.041 ( -2.824 1.037 -0.979) 3.163 7.148 ( -4.783 -4.376 -2.502) 6.949 7.755 ( 2.321 1.263 1.059) 2.847 8.019 ( 4.813 5.049 -0.762) 7.017 8.052 ( 7.467 2.392 -1.401) 7.965 8.614 ( 8.282 -0.474 -1.500) 8.430 8.728 ( 3.218 15.658 -5.177) 16.802 9.053 ( 2.794 1.449 0.119) 3.149 9.152 ( 3.482 8.928 -5.345) 10.972 9.618 ( 5.773 -4.070 -6.346) 9.495 9.971 ( -1.413 -4.583 -2.728) 5.518 9.997 ( -1.493 -0.784 6.332) 6.553 10.193 ( 0.789 -5.732 -8.626) 10.387 10.620 ( -5.758 -1.202 1.754) 6.138 10.886 ( 7.662 1.391 2.152) 8.080 11.047 ( 8.469 -3.508 5.647) 10.767 11.310 ( 8.482 -0.876 -1.428) 8.645 11.392 ( 9.066 -6.620 1.636) 11.344 12.002 ( -5.228 -3.401 0.775) 6.285 12.112 ( 0.849 -0.782 -1.698) 2.053 12.303 ( 1.407 -2.151 2.228) 3.402 13.181 ( -8.445 3.814 -8.270) 12.420 13.517 ( -1.989 10.361 -4.384) 11.424 13.861 ( -3.661 4.891 2.658) 6.663 14.083 ( -3.481 -3.640 -7.167) 8.760 14.567 ( -8.334 -9.527 -2.047) 12.822 15.115 ( -22.412 -5.440 16.424) 28.313 15.607 ( 3.420 -0.400 0.640) 3.502 15.913 ( 5.525 -0.220 -5.137) 7.547 16.769 ( -10.520 1.987 -10.042) 14.678 17.322 ( 10.425 0.599 16.502) 19.529 17.521 ( 7.653 -2.330 13.440) 15.641 18.849 ( 3.415 1.677 -3.135) 4.929 19.621 ( 3.374 4.361 -9.446) 10.938 ======================= Grid point 229 (121/260) ======================= q-point: ( 0.00 -0.50 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 252 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.171 ( 5.646 -0.000 5.761) 8.066 2.254 ( 2.527 -0.000 17.991) 18.168 2.273 ( 1.951 0.000 20.765) 20.856 2.329 ( 14.931 -0.000 -7.529) 16.722 4.093 ( -2.118 -0.000 -1.567) 2.635 4.595 ( -4.034 0.000 11.940) 12.603 4.798 ( 9.319 -0.000 9.606) 13.383 4.868 ( -2.046 0.000 10.523) 10.720 5.409 ( 5.635 0.000 1.542) 5.842 5.869 ( -5.621 -0.000 -6.065) 8.270 6.136 ( -2.278 0.000 5.407) 5.867 6.419 ( -0.425 0.000 -3.756) 3.780 6.528 ( -4.213 -0.000 -13.043) 13.706 6.618 ( -3.339 0.000 11.511) 11.986 6.988 ( -3.098 -0.000 -3.416) 4.611 7.059 ( 2.524 -0.000 1.003) 2.716 7.848 ( 4.487 0.000 3.396) 5.627 8.147 ( 3.700 -0.000 -0.421) 3.724 8.228 ( 7.452 0.000 -1.441) 7.590 8.742 ( 5.933 0.000 1.169) 6.047 9.014 ( 6.615 -0.000 -3.236) 7.364 9.018 ( -1.500 0.000 1.175) 1.906 9.334 ( 3.263 0.000 -9.952) 10.473 9.608 ( 5.593 -0.000 -8.213) 9.937 9.775 ( -9.067 0.000 -1.508) 9.192 10.007 ( -2.884 -0.000 -13.379) 13.686 10.040 ( -1.536 0.000 9.996) 10.114 10.527 ( -3.500 0.000 2.983) 4.599 11.005 ( -0.425 0.000 -0.279) 0.508 11.183 ( 3.365 0.000 7.931) 8.616 11.415 ( -0.271 -0.000 10.574) 10.577 11.522 ( 14.310 -0.000 -5.519) 15.337 11.792 ( -8.456 0.000 -4.653) 9.652 12.123 ( -0.153 0.000 -3.456) 3.460 12.335 ( 2.911 0.000 3.762) 4.757 12.974 ( -12.666 -0.000 -10.471) 16.433 13.636 ( 0.166 0.000 -7.864) 7.866 13.894 ( 2.955 0.000 3.329) 4.451 13.928 ( 0.398 -0.000 -10.913) 10.920 14.343 ( -1.745 -0.000 -2.654) 3.176 14.716 ( -21.165 0.000 16.415) 26.784 15.734 ( 7.403 0.000 4.527) 8.677 15.972 ( 3.427 0.000 -5.225) 6.249 16.551 ( -8.737 0.000 -7.498) 11.513 17.652 ( 9.404 0.000 18.766) 20.991 17.670 ( 3.008 -0.000 12.728) 13.078 18.976 ( 8.434 0.000 -0.292) 8.439 19.541 ( -6.866 -0.000 -13.808) 15.421 ======================= Grid point 231 (122/260) ======================= q-point: ( 0.10 -0.50 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 250 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.292 ( 2.291 -0.000 8.060) 8.379 2.319 ( 1.204 -0.000 4.241) 4.409 2.449 ( 3.155 0.000 17.192) 17.479 2.641 ( 13.390 0.000 4.383) 14.089 4.050 ( -1.467 0.000 -0.190) 1.479 4.577 ( -5.305 0.000 12.485) 13.565 4.903 ( -1.221 -0.000 10.809) 10.877 5.002 ( 5.279 0.000 6.739) 8.561 5.591 ( 12.131 -0.000 0.935) 12.167 5.734 ( -3.012 0.000 -5.732) 6.475 6.038 ( -10.801 0.000 2.920) 11.189 6.375 ( -2.284 -0.000 -2.739) 3.567 6.448 ( 3.528 0.000 -8.482) 9.187 6.658 ( 1.062 -0.000 7.848) 7.920 6.954 ( 1.444 0.000 -2.695) 3.057 7.140 ( 4.396 -0.000 1.422) 4.621 7.956 ( 4.696 0.000 2.061) 5.128 8.191 ( 1.462 0.000 -0.414) 1.519 8.358 ( 6.292 -0.000 0.137) 6.293 8.843 ( 3.778 0.000 0.764) 3.854 8.962 ( -4.725 -0.000 -0.339) 4.737 9.149 ( 6.977 -0.000 2.277) 7.339 9.301 ( -0.408 0.000 -9.722) 9.730 9.568 ( -9.740 0.000 -4.716) 10.822 9.590 ( -3.064 -0.000 -10.100) 10.554 9.927 ( 3.609 -0.000 -9.532) 10.192 10.050 ( -4.057 0.000 10.701) 11.445 10.514 ( 0.448 -0.000 2.256) 2.301 10.899 ( -8.819 0.000 -1.695) 8.980 11.206 ( -4.459 0.000 4.369) 6.242 11.324 ( -15.634 0.000 5.919) 16.717 11.737 ( 6.023 0.000 -0.566) 6.050 11.760 ( 10.519 0.000 1.073) 10.573 12.067 ( -1.614 0.000 -6.323) 6.526 12.406 ( 1.262 0.000 4.193) 4.379 12.637 ( -14.469 -0.000 -10.815) 18.064 13.545 ( -3.077 0.000 -7.177) 7.809 13.918 ( 4.735 0.000 -9.149) 10.301 14.051 ( 8.349 -0.000 -0.523) 8.365 14.367 ( 6.139 0.000 -4.091) 7.378 14.492 ( -10.503 0.000 16.739) 19.762 15.926 ( 8.650 0.000 5.983) 10.517 15.984 ( 0.935 0.000 -4.502) 4.598 16.376 ( -5.106 0.000 -4.926) 7.095 17.760 ( -2.513 -0.000 13.576) 13.807 17.886 ( 3.670 0.000 14.870) 15.316 19.165 ( 10.027 0.000 0.779) 10.057 19.264 ( -11.026 -0.000 -15.704) 19.188 ======================= Grid point 233 (123/260) ======================= q-point: ( 0.20 -0.50 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 252 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.347 ( -2.398 0.000 9.468) 9.767 2.363 ( 2.161 -0.000 -1.528) 2.647 2.587 ( 1.878 0.000 11.269) 11.425 2.864 ( 7.108 0.000 3.696) 8.012 4.042 ( 0.740 0.000 -0.540) 0.917 4.549 ( -5.004 -0.000 9.581) 10.809 4.955 ( -0.549 0.000 12.191) 12.203 5.064 ( -0.363 0.000 0.591) 0.694 5.718 ( 2.996 -0.000 -0.762) 3.091 5.784 ( -8.797 -0.000 -2.365) 9.109 5.892 ( 11.264 0.000 2.906) 11.633 6.308 ( -3.093 0.000 -1.252) 3.337 6.528 ( 8.040 0.000 -3.821) 8.902 6.715 ( 1.207 0.000 0.076) 1.210 6.994 ( 3.568 0.000 -1.833) 4.012 7.235 ( 4.143 -0.000 2.984) 5.105 8.045 ( 3.814 0.000 -0.764) 3.890 8.215 ( 1.168 0.000 1.054) 1.574 8.469 ( 4.404 -0.000 2.108) 4.883 8.831 ( -8.225 0.000 -0.830) 8.267 8.871 ( -1.718 -0.000 -1.259) 2.130 9.205 ( -3.791 0.000 -6.863) 7.840 9.259 ( 0.030 -0.000 0.331) 0.332 9.363 ( -6.764 -0.000 -9.482) 11.648 9.446 ( -0.707 0.000 -7.835) 7.867 9.988 ( 4.997 -0.000 -3.119) 5.890 10.013 ( -7.204 0.000 11.483) 13.556 10.560 ( 2.982 -0.000 -0.517) 3.026 10.688 ( -10.880 -0.000 -1.979) 11.058 11.032 ( -14.513 0.000 2.103) 14.664 11.107 ( -6.405 0.000 1.813) 6.657 11.801 ( -7.845 0.000 0.371) 7.854 11.902 ( 8.109 0.000 4.348) 9.201 12.099 ( 6.633 0.000 -1.415) 6.782 12.334 ( -7.450 -0.000 -9.389) 11.986 12.426 ( -1.403 0.000 2.732) 3.072 13.458 ( -1.607 0.000 -5.780) 5.999 13.979 ( 5.870 0.000 -5.766) 8.228 14.079 ( -4.891 -0.000 4.440) 6.606 14.510 ( 11.366 -0.000 -5.811) 12.765 14.601 ( 10.815 0.000 9.307) 14.268 15.945 ( -2.488 -0.000 -3.887) 4.615 16.125 ( 7.523 -0.000 6.608) 10.013 16.305 ( 0.002 0.000 -1.782) 1.782 17.725 ( -9.520 -0.000 11.315) 14.787 17.981 ( -1.326 0.000 9.621) 9.711 18.979 ( -7.615 0.000 -14.269) 16.174 19.335 ( 6.795 -0.000 -0.551) 6.817 ======================= Grid point 235 (124/260) ======================= q-point: ( 0.30 -0.50 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 250 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.318 ( -6.247 0.000 9.038) 10.987 2.368 ( 1.174 0.000 -8.751) 8.829 2.658 ( -0.060 0.000 5.626) 5.626 2.968 ( 1.840 0.000 2.827) 3.373 4.064 ( 1.965 0.000 -1.334) 2.375 4.495 ( -5.261 -0.000 5.002) 7.259 5.044 ( 1.948 -0.000 11.807) 11.967 5.047 ( -0.311 0.000 -1.856) 1.882 5.546 ( -12.423 -0.000 1.584) 12.523 5.800 ( 4.452 0.000 1.626) 4.740 6.167 ( 12.753 -0.000 -0.783) 12.777 6.245 ( -2.578 0.000 -1.388) 2.928 6.693 ( -1.323 -0.000 -5.552) 5.707 6.708 ( 12.269 0.000 -1.205) 12.328 7.044 ( 2.810 0.000 -3.410) 4.418 7.339 ( 4.193 0.000 4.344) 6.037 8.085 ( 1.697 0.000 -3.390) 3.791 8.255 ( 1.876 0.000 2.044) 2.774 8.524 ( -2.120 -0.000 1.019) 2.352 8.692 ( -3.324 0.000 2.806) 4.350 8.732 ( -10.720 -0.000 -4.248) 11.531 9.064 ( -6.887 -0.000 -8.981) 11.318 9.143 ( -4.687 0.000 -8.790) 9.961 9.201 ( -3.848 -0.000 -6.423) 7.487 9.526 ( 6.560 0.000 2.156) 6.905 9.917 ( -8.866 0.000 9.741) 13.172 10.035 ( 0.211 -0.000 -0.191) 0.285 10.487 ( -8.478 0.000 -1.062) 8.544 10.580 ( -0.084 -0.000 -4.152) 4.153 10.849 ( -6.002 0.000 3.918) 7.168 11.036 ( -0.982 0.000 0.644) 1.175 11.598 ( -9.925 0.000 -4.296) 10.814 12.014 ( -8.557 0.000 -3.295) 9.169 12.076 ( 6.225 -0.000 6.416) 8.939 12.388 ( -3.320 -0.000 -0.139) 3.323 12.435 ( 13.571 0.000 2.849) 13.867 13.412 ( -0.350 0.000 -2.878) 2.899 14.013 ( -5.470 0.000 8.704) 10.280 14.061 ( 5.172 -0.000 -2.570) 5.776 14.713 ( 13.339 0.000 -6.414) 14.801 14.897 ( 14.235 -0.000 3.455) 14.648 15.844 ( -5.097 -0.000 -4.207) 6.609 16.284 ( 4.295 -0.000 7.465) 8.612 16.340 ( 3.111 0.000 1.638) 3.516 17.537 ( -14.613 -0.000 5.179) 15.504 17.967 ( -4.438 0.000 4.696) 6.461 18.824 ( -0.658 0.000 -9.674) 9.696 19.405 ( 1.773 0.000 -3.594) 4.007 ======================= Grid point 237 (125/260) ======================= q-point: ( 0.40 -0.50 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 252 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.235 ( -7.429 -0.000 7.693) 10.695 2.283 ( -2.932 0.000 -13.730) 14.040 2.647 ( -3.297 -0.000 0.473) 3.331 2.976 ( -1.905 0.000 -0.349) 1.936 4.097 ( 2.280 -0.000 -1.122) 2.541 4.421 ( -4.219 0.000 2.014) 4.675 5.018 ( -1.660 -0.000 -4.128) 4.450 5.141 ( 0.794 0.000 3.699) 3.783 5.368 ( -7.939 0.000 10.574) 13.222 5.898 ( 4.505 0.000 2.189) 5.008 6.202 ( -0.762 -0.000 -0.516) 0.920 6.346 ( 6.294 0.000 -0.187) 6.297 6.624 ( -1.308 0.000 -6.096) 6.235 6.921 ( 6.020 0.000 -2.461) 6.504 7.075 ( 6.973 0.000 -7.019) 9.894 7.443 ( 3.901 0.000 3.586) 5.299 8.083 ( 0.746 0.000 -2.605) 2.710 8.304 ( 1.791 0.000 1.139) 2.123 8.415 ( -5.954 0.000 -0.373) 5.966 8.447 ( -14.364 -0.000 -5.788) 15.487 8.753 ( 3.795 -0.000 0.683) 3.856 8.821 ( -10.295 -0.000 -7.445) 12.705 9.012 ( -3.093 0.000 -9.458) 9.951 9.147 ( -0.414 -0.000 0.686) 0.801 9.669 ( 6.436 0.000 3.115) 7.151 9.836 ( -3.925 0.000 6.615) 7.692 9.983 ( -4.793 -0.000 -1.211) 4.943 10.363 ( -3.890 0.000 0.278) 3.900 10.517 ( -2.249 -0.000 -6.199) 6.595 10.831 ( -0.263 0.000 6.893) 6.898 11.048 ( 0.117 0.000 0.848) 0.856 11.413 ( -3.755 0.000 -11.248) 11.858 11.854 ( -7.115 0.000 2.115) 7.423 12.213 ( 3.209 0.000 7.713) 8.354 12.303 ( -3.979 0.000 -3.311) 5.176 12.747 ( 15.100 0.000 5.853) 16.194 13.416 ( 1.249 0.000 2.295) 2.612 13.974 ( -4.980 0.000 10.293) 11.435 14.141 ( 3.971 -0.000 -0.218) 3.977 14.933 ( 12.924 0.000 -5.352) 13.988 15.165 ( 12.056 0.000 0.105) 12.057 15.704 ( -6.233 -0.000 -5.196) 8.115 16.376 ( -0.335 -0.000 9.488) 9.493 16.425 ( 3.497 0.000 4.139) 5.419 17.265 ( -13.916 -0.000 -1.090) 13.959 17.879 ( -6.180 0.000 0.504) 6.201 18.820 ( 4.609 0.000 -5.342) 7.056 19.365 ( -2.155 0.000 -7.026) 7.349 ======================= Grid point 239 (126/260) ======================= q-point: (-0.50 -0.50 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 250 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.092 ( -7.334 -0.000 -14.094) 15.888 2.139 ( -6.778 0.000 5.945) 9.016 2.534 ( -7.433 0.000 -3.044) 8.033 2.885 ( -5.288 0.000 -6.583) 8.444 4.138 ( 2.414 0.000 -0.534) 2.473 4.371 ( -1.704 0.000 1.158) 2.060 4.905 ( -6.050 0.000 -8.571) 10.491 5.070 ( -7.261 0.000 1.721) 7.462 5.406 ( 1.405 -0.000 12.405) 12.484 5.992 ( 3.389 0.000 1.949) 3.909 6.229 ( 2.616 0.000 4.630) 5.318 6.405 ( -1.448 0.000 2.088) 2.541 6.581 ( 0.384 0.000 -4.822) 4.837 6.888 ( -0.808 0.000 -7.692) 7.734 7.225 ( 8.365 -0.000 -5.449) 9.983 7.535 ( 3.874 0.000 2.438) 4.578 8.082 ( -0.869 0.000 -1.001) 1.326 8.118 ( -15.339 -0.000 -4.280) 15.925 8.346 ( 2.512 -0.000 -3.737) 4.503 8.347 ( -0.837 0.000 -2.825) 2.947 8.515 ( -9.093 -0.000 -10.262) 13.711 8.910 ( 6.337 0.000 4.215) 7.611 8.913 ( -0.874 -0.000 -9.191) 9.232 9.191 ( 3.145 0.000 6.200) 6.952 9.792 ( 1.399 0.000 1.936) 2.388 9.854 ( 1.699 0.000 4.616) 4.919 9.877 ( -1.270 -0.000 -2.328) 2.652 10.342 ( 1.060 -0.000 1.218) 1.615 10.449 ( -0.106 0.000 -6.674) 6.675 10.894 ( 1.625 -0.000 7.621) 7.792 11.020 ( -3.289 0.000 1.434) 3.588 11.291 ( -0.718 0.000 -17.976) 17.990 11.787 ( -2.612 0.000 7.128) 7.592 12.191 ( -4.172 0.000 -3.281) 5.308 12.308 ( 1.036 0.000 6.596) 6.677 13.059 ( 13.442 0.000 3.706) 13.944 13.494 ( 3.056 0.000 9.155) 9.651 13.939 ( -5.286 0.000 9.700) 11.047 14.207 ( 2.521 0.000 1.069) 2.739 15.127 ( 8.763 0.000 -2.212) 9.037 15.353 ( 8.047 0.000 -2.167) 8.334 15.551 ( -4.793 0.000 -7.747) 9.110 16.377 ( -7.520 -0.000 12.920) 14.949 16.520 ( 3.188 0.000 5.812) 6.629 17.031 ( -7.148 0.000 -5.043) 8.747 17.742 ( -7.190 0.000 -2.862) 7.739 18.924 ( 8.567 0.000 -2.477) 8.918 19.249 ( -4.141 0.000 -9.733) 10.577 ======================= Grid point 241 (127/260) ======================= q-point: (-0.40 -0.50 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 252 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.856 ( -7.975 -0.000 -11.455) 13.958 2.056 ( -4.791 0.000 3.741) 6.078 2.339 ( -10.317 0.000 -2.609) 10.642 2.701 ( -7.638 -0.000 -10.764) 13.199 4.178 ( 2.104 0.000 -0.777) 2.243 4.374 ( 0.977 0.000 1.977) 2.205 4.701 ( -8.059 -0.000 -10.518) 13.251 4.945 ( -7.570 0.000 5.349) 9.270 5.501 ( 1.381 -0.000 7.050) 7.184 6.040 ( 0.947 0.000 0.425) 1.038 6.303 ( -9.301 -0.000 2.190) 9.555 6.349 ( 3.864 0.000 11.185) 11.833 6.573 ( 1.427 0.000 -4.218) 4.453 6.894 ( 4.993 0.000 -3.442) 6.064 7.282 ( 1.357 -0.000 -6.281) 6.425 7.615 ( 0.290 0.000 5.566) 5.574 7.815 ( -10.388 -0.000 -7.917) 13.061 8.014 ( -5.828 0.000 0.840) 5.888 8.165 ( -8.026 0.000 -12.621) 14.957 8.368 ( 3.381 -0.000 -6.755) 7.554 8.548 ( 10.667 0.000 -0.935) 10.708 8.871 ( 2.214 -0.000 -8.906) 9.177 9.028 ( 4.566 0.000 -0.096) 4.567 9.359 ( 8.137 0.000 11.149) 13.803 9.693 ( -5.526 0.000 -3.619) 6.605 9.933 ( 3.060 -0.000 3.841) 4.911 9.981 ( 7.598 0.000 0.111) 7.599 10.412 ( 5.247 0.000 1.067) 5.355 10.443 ( 3.466 0.000 -5.015) 6.096 10.964 ( -3.003 -0.000 0.364) 3.025 10.979 ( 2.582 0.000 6.520) 7.012 11.150 ( -2.096 0.000 -16.571) 16.703 11.825 ( 1.733 0.000 5.959) 6.206 12.107 ( -2.384 -0.000 -2.726) 3.622 12.344 ( -1.537 0.000 6.302) 6.487 13.289 ( 9.052 0.000 -0.229) 9.055 13.626 ( 2.085 0.000 13.583) 13.742 13.897 ( -3.857 0.000 7.107) 8.086 14.246 ( 0.698 0.000 0.827) 1.082 15.160 ( -6.864 0.000 1.601) 7.049 15.447 ( 3.400 -0.000 -2.710) 4.348 15.503 ( 7.470 0.000 -10.711) 13.059 16.220 ( -17.020 -0.000 12.848) 21.325 16.625 ( 3.697 0.000 7.274) 8.159 16.968 ( 3.208 0.000 -2.739) 4.218 17.568 ( -8.192 0.000 -5.390) 9.806 19.099 ( -4.445 -0.000 -10.784) 11.664 19.113 ( 11.928 0.000 -0.776) 11.953 ======================= Grid point 243 (128/260) ======================= q-point: (-0.30 -0.50 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 250 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.685 ( -2.777 0.000 -6.794) 7.339 2.001 ( -2.273 -0.000 -0.141) 2.277 2.145 ( -9.178 0.000 4.931) 10.418 2.489 ( -6.968 -0.000 -9.591) 11.855 4.205 ( 1.645 0.000 -2.817) 3.262 4.428 ( 2.505 0.000 4.066) 4.775 4.505 ( -5.682 -0.000 -6.336) 8.511 4.856 ( -5.407 0.000 7.017) 8.859 5.524 ( -2.520 -0.000 2.729) 3.714 6.044 ( -0.385 0.000 -0.284) 0.478 6.147 ( -7.422 -0.000 4.363) 8.610 6.485 ( 1.583 0.000 13.874) 13.964 6.570 ( 0.637 0.000 -4.474) 4.519 6.982 ( 3.468 -0.000 -1.190) 3.667 7.213 ( -2.381 -0.000 -8.824) 9.140 7.456 ( -15.197 0.000 3.996) 15.714 7.789 ( 7.577 0.000 -5.205) 9.192 7.878 ( -8.992 0.000 4.444) 10.031 8.013 ( 0.327 0.000 -12.140) 12.145 8.404 ( 5.233 0.000 -7.651) 9.269 8.768 ( 11.114 0.000 -0.407) 11.121 8.880 ( 4.371 -0.000 -9.317) 10.291 9.106 ( 4.894 -0.000 -2.199) 5.365 9.584 ( -2.765 -0.000 -4.877) 5.606 9.600 ( 8.903 0.000 10.805) 14.000 9.999 ( 0.936 0.000 4.032) 4.139 10.120 ( 7.564 0.000 -4.886) 9.005 10.522 ( 6.111 0.000 0.636) 6.144 10.549 ( 8.319 0.000 0.353) 8.327 10.891 ( -4.807 -0.000 -1.103) 4.932 11.058 ( 3.203 0.000 -12.279) 12.690 11.080 ( 4.009 0.000 6.044) 7.253 11.913 ( 4.236 0.000 3.423) 5.446 12.066 ( -0.919 -0.000 -1.056) 1.400 12.330 ( -3.198 0.000 4.724) 5.704 13.395 ( 2.380 0.000 -1.781) 2.973 13.691 ( -2.279 0.000 7.550) 7.887 13.909 ( 0.417 0.000 6.905) 6.918 14.237 ( -1.648 -0.000 -1.496) 2.225 14.954 ( -13.069 0.000 -0.162) 13.070 15.459 ( -1.317 -0.000 0.939) 1.617 15.638 ( 10.813 0.000 -7.739) 13.297 15.915 ( -20.546 -0.000 9.049) 22.450 16.762 ( 5.615 0.000 8.751) 10.398 17.088 ( 8.194 0.000 2.886) 8.687 17.359 ( -9.542 0.000 -6.565) 11.582 18.958 ( -3.313 0.000 -9.591) 10.147 19.357 ( 13.324 0.000 -1.046) 13.365 ======================= Grid point 245 (129/260) ======================= q-point: (-0.20 -0.50 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 252 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.700 ( 6.769 0.000 0.244) 6.774 1.965 ( -0.567 -0.000 0.900) 1.064 2.085 ( -3.262 0.000 12.597) 13.013 2.337 ( -3.751 -0.000 -5.316) 6.506 4.192 ( 0.024 -0.000 -6.660) 6.660 4.448 ( 1.171 -0.000 3.461) 3.654 4.509 ( 1.994 0.000 6.744) 7.033 4.827 ( -2.756 0.000 8.514) 8.949 5.447 ( -5.796 -0.000 1.192) 5.917 6.026 ( -1.121 0.000 -0.735) 1.341 6.092 ( -2.030 -0.000 5.714) 6.064 6.534 ( -1.449 0.000 -4.586) 4.809 6.575 ( -0.907 0.000 13.040) 13.071 6.917 ( -6.074 -0.000 -9.502) 11.277 7.160 ( 0.302 -0.000 -4.381) 4.391 7.209 ( -11.504 0.000 2.036) 11.683 7.765 ( -5.002 0.000 4.600) 6.795 7.922 ( 7.762 -0.000 -1.532) 7.912 8.007 ( 5.001 -0.000 -7.269) 8.823 8.481 ( 6.995 0.000 -5.284) 8.766 8.911 ( 4.823 0.000 -9.898) 11.011 8.935 ( 5.547 -0.000 1.554) 5.760 9.202 ( 7.363 0.000 -5.442) 9.156 9.532 ( 1.006 -0.000 -6.113) 6.196 9.810 ( 6.429 0.000 7.889) 10.177 10.012 ( -2.524 0.000 4.961) 5.566 10.183 ( 3.880 0.000 -11.321) 11.968 10.653 ( 1.255 0.000 6.608) 6.726 10.729 ( 9.942 0.000 0.395) 9.950 10.819 ( 1.794 0.000 0.685) 1.920 11.120 ( 9.758 -0.000 -9.727) 13.778 11.206 ( 4.546 -0.000 7.330) 8.625 12.022 ( 5.140 0.000 1.252) 5.291 12.040 ( -1.826 -0.000 -0.561) 1.910 12.292 ( -2.827 0.000 2.886) 4.040 13.363 ( -3.404 -0.000 -3.675) 5.010 13.667 ( -2.000 0.000 -0.044) 2.001 13.949 ( -1.274 0.000 5.309) 5.460 14.160 ( -3.944 -0.000 -5.623) 6.868 14.692 ( -13.008 0.000 -1.152) 13.059 15.377 ( -15.472 -0.000 14.915) 21.491 15.620 ( -8.381 -0.000 -1.301) 8.482 15.794 ( 9.309 0.000 -5.788) 10.962 16.931 ( 4.340 0.000 3.000) 5.276 17.152 ( -6.207 0.000 1.780) 6.457 17.289 ( 8.845 -0.000 7.263) 11.445 18.867 ( -0.550 0.000 -6.498) 6.521 19.578 ( 10.250 -0.000 -4.224) 11.086 ======================= Grid point 247 (130/260) ======================= q-point: (-0.10 -0.50 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 250 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.936 ( 13.999 0.000 8.184) 16.216 2.025 ( 4.263 -0.000 6.409) 7.697 2.142 ( -0.304 0.000 16.046) 16.049 2.278 ( -0.006 -0.000 -2.580) 2.580 4.144 ( -1.118 -0.000 -4.603) 4.737 4.573 ( 7.244 -0.000 8.340) 11.047 4.574 ( -0.664 0.000 9.321) 9.345 4.844 ( -2.015 0.000 10.414) 10.607 5.367 ( -2.100 -0.000 1.280) 2.459 5.982 ( -2.882 0.000 -2.754) 3.986 6.114 ( 0.099 -0.000 5.326) 5.327 6.466 ( -2.337 0.000 -3.556) 4.255 6.614 ( -2.826 0.000 11.350) 11.697 6.718 ( -6.362 -0.000 -13.090) 14.554 7.063 ( -4.273 0.000 1.168) 4.430 7.095 ( -4.572 -0.000 -3.350) 5.668 7.760 ( 1.604 -0.000 3.889) 4.207 8.053 ( 6.122 -0.000 -0.247) 6.127 8.098 ( 7.280 0.000 -3.347) 8.013 8.606 ( 7.621 0.000 -0.886) 7.673 8.944 ( 4.886 0.000 -8.636) 9.922 9.009 ( 1.310 -0.000 2.277) 2.627 9.298 ( 6.395 0.000 -8.359) 10.525 9.547 ( 4.805 -0.000 -7.433) 8.850 9.904 ( -2.003 0.000 0.112) 2.006 9.994 ( -1.711 0.000 10.461) 10.600 10.133 ( -0.692 0.000 -13.468) 13.485 10.602 ( -5.802 0.000 3.263) 6.656 10.916 ( 8.249 0.000 0.661) 8.275 10.999 ( 9.118 0.000 8.366) 12.374 11.294 ( 13.728 -0.000 -8.728) 16.268 11.329 ( 2.575 -0.000 8.864) 9.231 11.964 ( -5.901 0.000 -1.736) 6.151 12.107 ( 3.159 0.000 -0.858) 3.273 12.279 ( 0.320 0.000 2.449) 2.470 13.227 ( -7.345 -0.000 -7.976) 10.842 13.638 ( 0.880 0.000 -3.471) 3.581 13.916 ( -4.206 0.000 2.768) 5.036 14.031 ( -3.792 -0.000 -9.555) 10.280 14.464 ( -9.041 0.000 -1.831) 9.225 15.059 ( -24.413 -0.000 17.357) 29.954 15.603 ( 3.949 0.000 0.788) 4.027 15.912 ( 6.329 0.000 -5.297) 8.253 16.789 ( -9.798 0.000 -9.602) 13.719 17.328 ( 10.590 -0.000 18.611) 21.413 17.500 ( 6.872 0.000 10.472) 12.525 18.867 ( 3.773 0.000 -2.976) 4.806 19.663 ( 2.198 0.000 -9.364) 9.619 ======================= Grid point 279 (131/260) ======================= q-point: ( 0.00 0.00 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 250 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.354 ( -10.224 0.000 19.515) 22.031 1.500 ( 7.361 0.000 19.774) 21.099 2.762 ( -3.606 0.000 24.375) 24.640 2.986 ( 0.168 0.000 0.340) 0.380 3.871 ( -0.205 0.000 -4.118) 4.123 4.589 ( 1.516 0.000 -4.277) 4.537 4.673 ( 5.439 0.000 3.910) 6.698 4.717 ( 17.440 0.000 12.764) 21.612 5.762 ( 11.341 0.000 2.135) 11.541 5.934 ( -1.576 0.000 -0.736) 1.739 6.196 ( -1.666 0.000 -1.273) 2.097 6.363 ( -0.707 0.000 9.291) 9.318 6.658 ( -9.715 0.000 9.856) 13.839 6.740 ( -1.576 0.000 -8.312) 8.460 7.264 ( -2.337 0.000 1.225) 2.639 7.273 ( -3.242 0.000 -5.115) 6.056 7.332 ( 3.091 0.000 -5.818) 6.588 7.764 ( 4.454 0.000 -3.320) 5.555 7.907 ( 6.525 0.000 4.582) 7.973 8.423 ( 13.907 0.000 -0.156) 13.908 8.485 ( -4.014 0.000 4.984) 6.400 8.808 ( 9.987 0.000 -0.117) 9.988 9.208 ( -4.800 0.000 3.197) 5.767 9.782 ( 0.799 0.000 -13.294) 13.318 9.790 ( -4.199 0.000 0.508) 4.229 10.019 ( 7.405 0.000 -5.128) 9.007 10.342 ( -5.393 0.000 -3.082) 6.212 10.495 ( -5.324 0.000 -7.171) 8.931 11.026 ( 3.190 0.000 0.057) 3.191 11.230 ( -0.791 0.000 -1.428) 1.633 11.587 ( 2.635 0.000 -5.011) 5.662 11.716 ( 7.930 0.000 -0.045) 7.930 11.974 ( -18.711 0.000 -5.209) 19.422 12.165 ( -4.047 0.000 5.530) 6.853 12.265 ( 2.718 0.000 -0.186) 2.725 12.681 ( -0.505 0.000 -14.526) 14.535 13.209 ( -2.221 0.000 7.903) 8.209 13.732 ( 5.252 0.000 13.303) 14.303 14.033 ( 0.303 0.000 -2.641) 2.658 14.816 ( -5.601 0.000 -9.157) 10.734 15.517 ( -23.303 0.000 -2.332) 23.419 15.559 ( 6.063 0.000 0.185) 6.065 15.905 ( 6.443 0.000 1.879) 6.711 16.141 ( -5.951 0.000 -1.541) 6.148 17.682 ( 6.919 0.000 11.314) 13.262 18.588 ( -1.914 0.000 -8.104) 8.327 18.619 ( -7.231 0.000 10.603) 12.834 19.210 ( 17.503 0.000 -3.505) 17.850 ======================= Grid point 280 (132/260) ======================= q-point: ( 0.10 0.00 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 250 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.403 ( 2.181 0.000 20.764) 20.878 1.838 ( 14.935 0.000 13.768) 20.313 2.849 ( -1.885 0.000 19.674) 19.764 2.992 ( 1.194 0.000 -2.490) 2.762 3.852 ( 0.116 0.000 -1.209) 1.215 4.564 ( -1.614 0.000 -4.127) 4.432 4.804 ( 6.346 0.000 1.050) 6.432 5.077 ( 12.348 0.000 4.447) 13.124 5.910 ( 0.279 0.000 -2.284) 2.301 5.975 ( 9.309 0.000 2.075) 9.537 6.172 ( -1.355 0.000 3.357) 3.620 6.400 ( -1.759 0.000 8.214) 8.400 6.539 ( -8.986 0.000 10.829) 14.072 6.651 ( -1.354 0.000 -10.304) 10.393 7.174 ( -4.449 0.000 -2.018) 4.885 7.181 ( -3.433 0.000 -2.416) 4.198 7.404 ( 5.727 0.000 -4.993) 7.598 7.825 ( 4.643 0.000 -5.084) 6.885 8.017 ( 2.304 0.000 1.226) 2.610 8.414 ( -6.006 0.000 5.143) 7.907 8.674 ( 11.938 0.000 -1.799) 12.073 8.977 ( 6.581 0.000 -1.312) 6.711 9.131 ( -4.148 0.000 1.719) 4.490 9.705 ( 0.278 0.000 -12.601) 12.604 9.720 ( -4.750 0.000 1.235) 4.908 10.039 ( -0.291 0.000 -3.317) 3.330 10.335 ( 4.006 0.000 -0.574) 4.047 10.338 ( -5.441 0.000 -4.108) 6.817 10.967 ( -8.231 0.000 -0.254) 8.235 11.097 ( -9.749 0.000 -1.744) 9.904 11.495 ( -25.225 0.000 7.461) 26.305 11.638 ( 4.192 0.000 -8.016) 9.046 11.842 ( 3.432 0.000 0.144) 3.435 12.272 ( -1.943 0.000 2.315) 3.022 12.358 ( 18.026 0.000 -4.202) 18.510 12.648 ( 4.640 0.000 -10.606) 11.576 13.269 ( 3.943 0.000 8.363) 9.246 13.798 ( -3.525 0.000 5.523) 6.552 14.180 ( 11.650 0.000 7.329) 13.763 14.647 ( -5.537 0.000 -11.482) 12.748 15.096 ( -18.565 0.000 2.721) 18.764 15.713 ( 9.136 0.000 2.575) 9.491 16.026 ( -4.695 0.000 -2.828) 5.480 16.078 ( 8.198 0.000 2.658) 8.619 17.859 ( 3.839 0.000 11.519) 12.142 18.476 ( -3.664 0.000 -10.788) 11.393 18.491 ( -11.997 0.000 8.042) 14.443 19.398 ( 6.239 0.000 -6.412) 8.946 ======================= Grid point 281 (133/260) ======================= q-point: ( 0.20 0.00 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 250 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.658 ( 10.089 0.000 18.937) 21.457 2.185 ( 12.611 0.000 9.470) 15.771 2.923 ( -1.358 0.000 12.976) 13.047 2.990 ( 0.368 0.000 -4.401) 4.417 3.859 ( 0.100 0.000 2.176) 2.178 4.476 ( -4.716 0.000 -3.940) 6.145 4.925 ( 6.794 0.000 -3.090) 7.464 5.204 ( 1.534 0.000 -6.221) 6.408 5.928 ( 3.971 0.000 -4.080) 5.694 6.153 ( 7.862 0.000 0.194) 7.865 6.161 ( -5.346 0.000 11.767) 12.925 6.370 ( -4.730 0.000 0.941) 4.823 6.479 ( -2.361 0.000 8.999) 9.304 6.570 ( -1.197 0.000 -7.403) 7.499 7.093 ( -3.595 0.000 1.968) 4.098 7.128 ( -0.247 0.000 -2.353) 2.366 7.470 ( 3.987 0.000 -4.805) 6.244 7.880 ( 4.874 0.000 -6.587) 8.194 8.002 ( -2.708 0.000 -3.682) 4.571 8.336 ( -5.148 0.000 4.999) 7.176 8.830 ( 5.519 0.000 -4.226) 6.951 8.976 ( -3.312 0.000 -10.681) 11.183 9.086 ( -1.631 0.000 2.100) 2.659 9.565 ( -11.373 0.000 -2.291) 11.601 9.706 ( 6.350 0.000 -4.396) 7.723 10.027 ( 0.252 0.000 -2.514) 2.527 10.307 ( 2.307 0.000 5.016) 5.521 10.424 ( 4.973 0.000 1.935) 5.336 10.771 ( -10.726 0.000 -0.123) 10.727 10.904 ( -7.800 0.000 -2.652) 8.238 11.102 ( -20.934 0.000 11.583) 23.925 11.582 ( -4.321 0.000 -10.605) 11.451 11.886 ( -0.890 0.000 3.780) 3.884 12.262 ( -0.996 0.000 5.120) 5.216 12.690 ( 3.962 0.000 -4.085) 5.690 12.692 ( 19.703 0.000 -8.885) 21.614 13.481 ( 12.541 0.000 7.241) 14.481 13.759 ( -3.015 0.000 4.757) 5.632 14.444 ( 9.227 0.000 5.498) 10.741 14.460 ( -5.826 0.000 -12.535) 13.823 14.871 ( -7.138 0.000 8.237) 10.899 15.922 ( -2.361 0.000 -1.782) 2.958 15.939 ( 10.116 0.000 2.617) 10.449 16.230 ( 5.582 0.000 2.918) 6.299 17.947 ( -3.581 0.000 11.047) 11.613 18.285 ( -11.350 0.000 4.169) 12.092 18.320 ( -4.196 0.000 -14.091) 14.703 19.407 ( -0.009 0.000 -7.487) 7.487 ======================= Grid point 282 (134/260) ======================= q-point: ( 0.30 0.00 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 250 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.977 ( 10.626 0.000 16.068) 19.263 2.427 ( 6.731 0.000 8.671) 10.977 2.932 ( -4.069 0.000 4.665) 6.190 2.938 ( -2.733 0.000 -5.534) 6.172 3.878 ( -0.379 0.000 4.770) 4.785 4.346 ( -5.909 0.000 -3.877) 7.067 5.027 ( 7.071 0.000 -6.864) 9.855 5.095 ( -5.633 0.000 -12.535) 13.742 6.011 ( 7.241 0.000 -7.239) 10.239 6.075 ( -10.295 0.000 12.113) 15.896 6.241 ( -5.996 0.000 -4.516) 7.506 6.294 ( 6.202 0.000 1.239) 6.324 6.521 ( -0.934 0.000 -1.349) 1.641 6.559 ( 3.640 0.000 7.223) 8.088 7.060 ( -2.161 0.000 4.281) 4.796 7.152 ( 3.847 0.000 -0.876) 3.945 7.476 ( -1.286 0.000 -3.710) 3.927 7.902 ( -2.726 0.000 -8.115) 8.561 7.929 ( 5.006 0.000 -8.313) 9.704 8.276 ( -4.346 0.000 4.070) 5.954 8.750 ( -9.162 0.000 -12.469) 15.473 8.845 ( -0.801 0.000 -10.377) 10.408 9.091 ( 0.212 0.000 3.291) 3.297 9.305 ( -12.005 0.000 -2.563) 12.275 9.850 ( 7.930 0.000 -0.311) 7.936 9.987 ( -2.138 0.000 -3.168) 3.822 10.367 ( -7.189 0.000 9.278) 11.737 10.572 ( 7.910 0.000 4.406) 9.054 10.631 ( -1.604 0.000 3.702) 4.034 10.787 ( -1.720 0.000 -3.712) 4.091 10.877 ( -8.120 0.000 12.847) 15.198 11.365 ( -10.338 0.000 -10.649) 14.841 11.853 ( -4.452 0.000 3.328) 5.558 12.291 ( 0.086 0.000 6.511) 6.511 12.741 ( 2.395 0.000 -0.336) 2.419 12.977 ( 15.057 0.000 -8.666) 17.372 13.746 ( -2.069 0.000 6.529) 6.849 13.775 ( 11.300 0.000 3.497) 11.828 14.307 ( -0.643 0.000 -8.524) 8.549 14.539 ( -0.219 0.000 1.760) 1.773 14.954 ( 7.531 0.000 10.093) 12.593 15.832 ( -2.953 0.000 -5.257) 6.029 16.198 ( 11.541 0.000 6.423) 13.208 16.326 ( 2.161 0.000 4.274) 4.789 17.785 ( -17.205 0.000 5.798) 18.156 18.150 ( -3.078 0.000 -17.309) 17.581 18.199 ( -1.146 0.000 4.656) 4.795 19.325 ( -2.931 0.000 -8.827) 9.301 ======================= Grid point 283 (135/260) ======================= q-point: ( 0.40 0.00 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 250 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.231 ( 5.468 0.000 13.382) 14.456 2.554 ( -0.212 0.000 10.600) 10.602 2.817 ( -7.534 0.000 -3.000) 8.109 2.829 ( -4.164 0.000 -5.881) 7.206 3.904 ( -0.274 0.000 5.719) 5.726 4.217 ( -4.720 0.000 -3.348) 5.787 4.867 ( -8.666 0.000 -14.394) 16.801 5.101 ( 5.570 0.000 -10.604) 11.978 5.933 ( -11.471 0.000 10.386) 15.475 5.986 ( -2.679 0.000 -12.254) 12.544 6.245 ( 7.103 0.000 2.607) 7.566 6.419 ( 5.183 0.000 2.858) 5.918 6.519 ( 0.882 0.000 0.922) 1.276 6.639 ( 0.013 0.000 4.220) 4.220 7.046 ( -2.208 0.000 3.538) 4.170 7.256 ( 6.281 0.000 1.070) 6.371 7.373 ( -5.498 0.000 -5.207) 7.572 7.824 ( 0.125 0.000 -8.950) 8.951 7.968 ( 4.970 0.000 -10.320) 11.454 8.210 ( -4.646 0.000 2.771) 5.410 8.484 ( -8.775 0.000 -14.810) 17.214 8.720 ( -5.203 0.000 -9.998) 11.270 9.126 ( -0.021 0.000 4.435) 4.435 9.144 ( -2.712 0.000 2.732) 3.850 9.862 ( -4.483 0.000 -2.270) 5.025 10.017 ( 5.578 0.000 -3.890) 6.801 10.184 ( -13.080 0.000 8.734) 15.728 10.622 ( -3.399 0.000 4.696) 5.796 10.679 ( 0.842 0.000 1.830) 2.015 10.874 ( 11.762 0.000 -0.234) 11.764 11.017 ( 10.029 0.000 15.349) 18.335 11.095 ( -10.316 0.000 -8.871) 13.606 11.776 ( -4.748 0.000 1.959) 5.136 12.336 ( -0.023 0.000 6.213) 6.213 12.763 ( 0.449 0.000 -1.962) 2.012 13.151 ( 7.722 0.000 -6.540) 10.119 13.755 ( -1.754 0.000 7.810) 8.004 13.833 ( -3.400 0.000 -3.614) 4.962 14.440 ( 14.265 0.000 2.641) 14.507 14.532 ( -1.163 0.000 1.887) 2.217 15.180 ( 9.648 0.000 5.302) 11.009 15.742 ( -2.838 0.000 -6.050) 6.683 16.378 ( 0.113 0.000 7.067) 7.068 16.449 ( 10.058 0.000 6.874) 12.183 17.453 ( -18.427 0.000 1.727) 18.507 17.994 ( -1.116 0.000 -19.558) 19.590 18.232 ( 0.677 0.000 5.377) 5.419 19.195 ( -4.201 0.000 -10.151) 10.986 ======================= Grid point 284 (136/260) ======================= q-point: (-0.50 0.00 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 250 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.325 ( -3.923 0.000 11.074) 11.748 2.460 ( -14.842 0.000 4.089) 15.395 2.721 ( -1.014 0.000 2.994) 3.161 2.744 ( -0.411 0.000 -4.479) 4.498 3.938 ( 0.320 0.000 4.827) 4.838 4.138 ( -1.523 0.000 -1.967) 2.488 4.603 ( -9.475 0.000 -12.976) 16.067 5.081 ( -0.059 0.000 -13.771) 13.771 5.761 ( -12.367 0.000 7.944) 14.699 5.906 ( 1.104 0.000 -5.476) 5.586 6.407 ( 5.558 0.000 2.952) 6.293 6.470 ( -4.239 0.000 3.237) 5.334 6.578 ( 5.123 0.000 2.839) 5.857 6.657 ( 2.441 0.000 3.597) 4.347 7.013 ( -2.473 0.000 0.736) 2.580 7.218 ( -5.615 0.000 -5.508) 7.865 7.397 ( 6.498 0.000 -0.813) 6.549 7.787 ( 0.889 0.000 -6.736) 6.795 7.982 ( 3.265 0.000 -12.392) 12.815 8.150 ( -2.759 0.000 3.229) 4.247 8.247 ( -6.461 0.000 -13.310) 14.795 8.554 ( -4.440 0.000 -10.117) 11.048 9.166 ( 0.905 0.000 7.112) 7.169 9.214 ( 5.296 0.000 7.092) 8.851 9.746 ( -5.404 0.000 -3.354) 6.360 10.050 ( -5.421 0.000 8.309) 9.921 10.050 ( 1.990 0.000 -8.308) 8.543 10.597 ( -1.928 0.000 4.326) 4.736 10.722 ( 2.777 0.000 1.826) 3.324 10.890 ( -5.563 0.000 -6.517) 8.568 11.119 ( 11.897 0.000 2.093) 12.080 11.317 ( 9.778 0.000 13.144) 16.382 11.719 ( -1.392 0.000 2.321) 2.706 12.337 ( -2.730 0.000 0.003) 2.730 12.756 ( 1.691 0.000 -3.071) 3.505 13.191 ( -0.228 0.000 -3.727) 3.734 13.724 ( -5.426 0.000 -0.342) 5.436 13.773 ( -1.241 0.000 7.413) 7.516 14.513 ( -1.963 0.000 0.701) 2.085 14.755 ( 14.488 0.000 4.551) 15.186 15.364 ( 7.578 0.000 -0.447) 7.591 15.641 ( -3.839 0.000 -6.161) 7.259 16.446 ( 1.778 0.000 11.546) 11.682 16.667 ( 8.342 0.000 6.202) 10.395 17.124 ( -16.085 0.000 0.589) 16.096 17.864 ( 0.250 0.000 -20.286) 20.288 18.289 ( 1.700 0.000 5.904) 6.144 19.044 ( -4.543 0.000 -10.710) 11.634 ======================= Grid point 285 (137/260) ======================= q-point: (-0.40 0.00 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 250 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.148 ( -18.140 0.000 2.843) 18.362 2.240 ( -10.752 0.000 10.134) 14.775 2.733 ( -2.981 0.000 10.219) 10.645 2.754 ( 2.695 0.000 -1.359) 3.018 3.967 ( 0.045 0.000 2.380) 2.381 4.140 ( 2.323 0.000 0.347) 2.349 4.357 ( -8.829 0.000 -8.399) 12.186 4.950 ( -3.895 0.000 -13.196) 13.759 5.561 ( -12.072 0.000 5.342) 13.201 5.944 ( 4.066 0.000 -1.596) 4.368 6.358 ( -6.624 0.000 2.461) 7.066 6.452 ( -2.393 0.000 4.273) 4.897 6.762 ( 9.500 0.000 5.094) 10.780 6.764 ( 3.644 0.000 7.347) 8.201 6.973 ( -0.119 0.000 -2.899) 2.901 7.089 ( -3.213 0.000 -7.603) 8.254 7.492 ( 4.034 0.000 -1.608) 4.342 7.758 ( -0.776 0.000 -4.839) 4.900 7.915 ( -2.146 0.000 -13.385) 13.556 8.087 ( -1.926 0.000 -11.111) 11.277 8.168 ( 2.023 0.000 5.559) 5.915 8.455 ( 0.681 0.000 -9.387) 9.412 9.212 ( -0.648 0.000 7.676) 7.703 9.427 ( 10.299 0.000 9.390) 13.937 9.627 ( -3.514 0.000 -5.165) 6.246 10.018 ( 1.306 0.000 -10.507) 10.588 10.091 ( 4.076 0.000 8.231) 9.185 10.597 ( -0.736 0.000 3.474) 3.551 10.791 ( -1.799 0.000 -3.539) 3.970 10.800 ( 3.797 0.000 1.130) 3.961 11.343 ( 9.585 0.000 3.133) 10.084 11.463 ( 0.391 0.000 1.455) 1.506 11.827 ( 8.298 0.000 11.652) 14.304 12.234 ( -4.567 0.000 -7.181) 8.510 12.809 ( 5.509 0.000 -3.750) 6.665 13.100 ( -7.525 0.000 -0.997) 7.591 13.620 ( -6.742 0.000 3.110) 7.424 13.797 ( -0.648 0.000 5.511) 5.549 14.452 ( -3.762 0.000 -3.301) 5.005 15.031 ( 11.340 0.000 3.604) 11.899 15.461 ( 4.177 0.000 -4.278) 5.979 15.512 ( -5.787 0.000 -5.790) 8.186 16.614 ( 7.064 0.000 14.846) 16.441 16.817 ( -3.480 0.000 -4.316) 5.544 16.882 ( -2.239 0.000 10.709) 10.940 17.749 ( 0.486 0.000 -18.441) 18.447 18.372 ( 2.713 0.000 7.117) 7.617 18.896 ( -3.962 0.000 -9.929) 10.691 ======================= Grid point 286 (138/260) ======================= q-point: (-0.30 0.00 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 250 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.825 ( -18.916 0.000 8.830) 20.875 2.055 ( -15.250 0.000 11.303) 18.982 2.725 ( -6.278 0.000 16.151) 17.328 2.819 ( 3.732 0.000 1.926) 4.200 3.953 ( -2.017 0.000 -1.128) 2.311 4.186 ( -5.180 0.000 -0.462) 5.201 4.227 ( 5.256 0.000 3.277) 6.194 4.794 ( -4.148 0.000 -11.051) 11.804 5.403 ( -6.187 0.000 3.583) 7.149 6.006 ( 2.405 0.000 -0.490) 2.454 6.282 ( -2.532 0.000 1.050) 2.741 6.399 ( -5.863 0.000 6.498) 8.752 6.856 ( -1.661 0.000 13.527) 13.629 6.874 ( 0.240 0.000 -1.047) 1.074 7.024 ( 2.735 0.000 -9.545) 9.929 7.075 ( 11.364 0.000 0.949) 11.403 7.537 ( 1.923 0.000 -2.511) 3.162 7.692 ( -3.047 0.000 -2.767) 4.116 7.775 ( -3.098 0.000 -11.583) 11.990 8.021 ( 1.361 0.000 -9.173) 9.273 8.283 ( 5.089 0.000 6.776) 8.474 8.450 ( 4.067 0.000 -8.177) 9.133 9.241 ( -1.236 0.000 7.735) 7.833 9.579 ( 2.705 0.000 -5.788) 6.389 9.687 ( 10.605 0.000 6.545) 12.462 9.975 ( 1.467 0.000 -12.182) 12.270 10.277 ( 8.585 0.000 8.785) 12.283 10.613 ( 1.230 0.000 1.517) 1.953 10.740 ( -2.160 0.000 -1.393) 2.570 10.890 ( 5.282 0.000 -0.863) 5.352 11.435 ( -1.554 0.000 -2.287) 2.765 11.521 ( 6.536 0.000 3.468) 7.399 12.099 ( 10.012 0.000 14.854) 17.913 12.118 ( -1.559 0.000 -8.082) 8.231 12.891 ( 6.277 0.000 -8.896) 10.888 12.895 ( -13.453 0.000 0.673) 13.470 13.492 ( -9.307 0.000 5.299) 10.710 13.801 ( -2.278 0.000 2.345) 3.269 14.327 ( -4.673 0.000 -9.430) 10.524 15.235 ( 8.121 0.000 1.924) 8.346 15.348 ( -7.443 0.000 -5.515) 9.264 15.493 ( 2.265 0.000 -2.821) 3.618 16.612 ( -10.111 0.000 -1.028) 10.163 16.827 ( 4.225 0.000 3.215) 5.309 17.045 ( 7.101 0.000 8.200) 10.847 17.717 ( 7.875 0.000 -4.485) 9.063 18.477 ( 2.805 0.000 8.865) 9.298 18.778 ( -2.295 0.000 -7.994) 8.317 ======================= Grid point 287 (139/260) ======================= q-point: (-0.20 0.00 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 250 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.540 ( -18.189 0.000 16.485) 24.547 1.800 ( -18.639 0.000 13.091) 22.777 2.699 ( -8.325 0.000 22.045) 23.565 2.908 ( 2.997 0.000 4.260) 5.209 3.913 ( -0.151 0.000 -2.187) 2.192 4.159 ( 0.433 0.000 7.245) 7.258 4.370 ( 6.219 0.000 6.048) 8.675 4.666 ( -2.210 0.000 -9.424) 9.680 5.391 ( 3.041 0.000 2.681) 4.054 6.016 ( -1.128 0.000 -0.231) 1.151 6.257 ( -0.350 0.000 -1.440) 1.482 6.338 ( -4.495 0.000 8.039) 9.211 6.852 ( -0.197 0.000 -4.683) 4.687 6.855 ( -5.357 0.000 9.396) 10.816 7.081 ( 5.563 0.000 -0.697) 5.606 7.288 ( 8.479 0.000 -0.640) 8.503 7.511 ( -2.896 0.000 -4.084) 5.007 7.660 ( 1.363 0.000 1.269) 1.862 7.680 ( -0.428 0.000 -6.190) 6.205 8.035 ( 5.799 0.000 -6.899) 9.012 8.416 ( 3.834 0.000 6.340) 7.409 8.507 ( 6.324 0.000 -5.388) 8.308 9.260 ( -1.667 0.000 7.093) 7.287 9.662 ( 9.127 0.000 -5.506) 10.659 9.869 ( 4.371 0.000 1.828) 4.738 9.920 ( 1.140 0.000 -13.473) 13.521 10.477 ( 6.525 0.000 5.104) 8.284 10.668 ( -5.056 0.000 -1.518) 5.279 10.702 ( 8.330 0.000 -0.689) 8.358 11.000 ( 7.472 0.000 -2.506) 7.881 11.410 ( 0.696 0.000 0.046) 0.698 11.621 ( 2.008 0.000 1.031) 2.257 12.098 ( 3.548 0.000 -4.082) 5.408 12.356 ( 6.102 0.000 12.813) 14.192 12.603 ( -16.947 0.000 0.894) 16.970 12.914 ( 3.392 0.000 -15.871) 16.230 13.340 ( -9.981 0.000 8.207) 12.922 13.706 ( -7.535 0.000 -1.898) 7.770 14.190 ( -2.502 0.000 -10.315) 10.614 15.165 ( -7.790 0.000 -5.718) 9.664 15.371 ( 5.590 0.000 0.045) 5.590 15.542 ( 3.662 0.000 1.649) 4.016 16.429 ( -8.554 0.000 -0.359) 8.562 16.662 ( -15.765 0.000 -15.564) 22.153 17.245 ( 8.134 0.000 8.963) 12.103 18.108 ( 27.340 0.000 11.899) 29.817 18.579 ( 1.225 0.000 10.535) 10.606 18.708 ( -0.576 0.000 -6.335) 6.361 ======================= Grid point 288 (140/260) ======================= q-point: (-0.10 0.00 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 250 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.380 ( -8.964 0.000 21.683) 23.463 1.528 ( -18.001 0.000 15.985) 24.074 2.700 ( -6.486 0.000 25.555) 26.366 2.970 ( 0.745 0.000 3.392) 3.473 3.901 ( 0.365 0.000 -4.782) 4.796 4.335 ( 11.228 0.000 14.404) 18.263 4.524 ( 4.930 0.000 7.532) 9.002 4.604 ( 1.640 0.000 -8.074) 8.238 5.537 ( 9.698 0.000 2.372) 9.984 5.976 ( -2.409 0.000 -0.066) 2.410 6.235 ( -0.811 0.000 -2.665) 2.786 6.330 ( -1.958 0.000 8.733) 8.950 6.778 ( -7.961 0.000 7.724) 11.092 6.809 ( -0.808 0.000 -6.355) 6.406 7.194 ( 4.913 0.000 2.784) 5.648 7.345 ( 0.246 0.000 -6.137) 6.142 7.408 ( -4.382 0.000 -4.018) 5.945 7.696 ( 3.744 0.000 -1.514) 4.039 7.751 ( 5.859 0.000 4.022) 7.106 8.175 ( 11.643 0.000 -2.458) 11.899 8.492 ( 0.100 0.000 5.395) 5.396 8.630 ( 8.770 0.000 -2.257) 9.056 9.257 ( -2.999 0.000 5.575) 6.330 9.819 ( 6.845 0.000 -8.024) 10.547 9.873 ( -3.389 0.000 -0.261) 3.399 9.875 ( 6.000 0.000 -10.604) 12.184 10.518 ( -8.503 0.000 -3.467) 9.182 10.572 ( 1.978 0.000 -3.858) 4.336 10.884 ( 9.893 0.000 -0.853) 9.930 11.145 ( 8.549 0.000 -2.691) 8.963 11.507 ( 9.169 0.000 1.929) 9.370 11.617 ( -1.564 0.000 -1.870) 2.438 12.181 ( 5.554 0.000 -0.877) 5.623 12.279 ( -16.426 0.000 1.882) 16.533 12.392 ( -9.680 0.000 2.114) 9.909 12.818 ( -1.738 0.000 -17.815) 17.899 13.237 ( -6.053 0.000 8.812) 10.690 13.596 ( -1.152 0.000 5.589) 5.706 14.097 ( -2.241 0.000 -6.484) 6.860 14.984 ( -6.761 0.000 -7.023) 9.749 15.463 ( 4.597 0.000 -0.760) 4.659 15.655 ( 5.309 0.000 4.020) 6.659 16.153 ( -24.540 0.000 -12.708) 27.636 16.275 ( -7.224 0.000 -0.611) 7.249 17.465 ( 8.301 0.000 10.343) 13.262 18.641 ( -2.279 0.000 11.335) 11.561 18.645 ( 2.966 0.000 -5.526) 6.271 18.758 ( 25.689 0.000 4.065) 26.009 ======================= Grid point 289 (141/260) ======================= q-point: ( 0.00 0.12 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 400 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.394 ( 2.966 6.738 17.947) 19.399 1.673 ( -2.127 13.655 16.951) 21.871 2.759 ( -1.835 -0.504 20.383) 20.471 2.965 ( 0.552 -2.116 2.364) 3.220 3.880 ( -0.434 1.338 -1.793) 2.279 4.627 ( 2.700 3.449 -0.345) 4.394 4.718 ( 4.978 4.324 2.377) 7.010 4.751 ( 13.515 3.494 12.156) 18.510 5.705 ( 8.290 -4.825 1.719) 9.745 5.964 ( 0.971 -0.054 -4.284) 4.393 6.166 ( -1.537 -0.562 2.555) 3.034 6.347 ( -1.856 -1.621 7.061) 7.479 6.656 ( -8.662 0.298 9.161) 12.611 6.814 ( -1.296 5.851 -6.575) 8.896 7.091 ( -3.660 -9.973 -3.930) 11.327 7.280 ( -2.586 -6.150 -10.960) 12.831 7.453 ( 5.822 9.052 0.992) 10.809 7.687 ( 3.608 2.718 3.501) 5.715 8.144 ( 4.696 15.442 -0.378) 16.145 8.337 ( 6.043 -3.856 3.930) 8.176 8.632 ( 4.505 9.583 0.150) 10.590 8.803 ( 9.495 -0.382 0.167) 9.504 9.190 ( -4.933 -1.506 3.119) 6.027 9.752 ( -0.244 -2.959 -7.299) 7.880 9.789 ( -0.374 -0.374 -6.267) 6.289 10.004 ( 4.143 -1.557 -4.670) 6.434 10.362 ( -4.033 0.592 -1.750) 4.436 10.449 ( -5.931 -3.032 -6.121) 9.046 11.015 ( 2.410 -0.868 0.268) 2.575 11.240 ( -1.080 0.390 -1.837) 2.166 11.539 ( 6.744 -2.277 -0.119) 7.119 11.772 ( 6.694 2.248 -3.891) 8.062 11.962 ( -16.813 -0.889 -1.919) 16.945 12.142 ( -3.178 -2.385 4.928) 6.330 12.311 ( -1.405 4.429 -2.124) 5.109 12.646 ( 0.607 -2.901 -14.442) 14.743 13.186 ( -1.640 -1.210 8.030) 8.285 13.770 ( 2.792 3.223 10.747) 11.562 14.017 ( 1.705 -1.624 -3.729) 4.410 14.745 ( -4.954 -6.865 -8.476) 11.980 15.352 ( -16.864 -9.285 4.058) 19.674 15.690 ( 0.152 6.132 -2.829) 6.755 15.887 ( 6.866 -1.327 1.971) 7.265 16.195 ( -6.788 4.567 -3.278) 8.814 17.704 ( 6.583 2.202 11.770) 13.664 18.466 ( -2.435 -8.952 9.270) 13.114 18.686 ( -0.293 4.398 -3.691) 5.749 19.236 ( 10.704 1.985 -5.833) 12.351 ======================= Grid point 290 (142/260) ======================= q-point: ( 0.10 0.12 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 400 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.516 ( 1.202 10.651 16.802) 19.930 1.915 ( 13.480 7.359 12.519) 19.815 2.852 ( -0.248 0.226 15.185) 15.188 2.989 ( 0.933 -0.447 0.690) 1.243 3.870 ( -0.144 2.022 0.789) 2.175 4.612 ( -2.018 4.230 -3.041) 5.587 4.830 ( 5.338 2.595 0.825) 5.992 5.077 ( 11.280 0.353 6.440) 12.994 5.819 ( 2.947 -5.576 -1.844) 6.571 5.985 ( 3.431 -5.491 -2.409) 6.908 6.193 ( 2.647 5.494 4.973) 7.869 6.353 ( -2.323 -5.259 7.245) 9.249 6.522 ( -10.806 0.005 9.352) 14.291 6.757 ( -0.722 7.956 -6.780) 10.478 7.010 ( -2.285 -8.051 -2.149) 8.640 7.167 ( -1.968 -6.592 -10.031) 12.164 7.552 ( 4.637 12.346 -1.047) 13.230 7.791 ( 4.920 0.414 1.425) 5.139 8.187 ( 0.522 12.253 -2.307) 12.479 8.395 ( -1.877 -0.281 4.173) 4.584 8.772 ( 9.055 8.112 -1.330) 12.229 8.961 ( 5.784 -1.508 -1.748) 6.228 9.113 ( -3.555 -1.676 1.366) 4.161 9.683 ( -0.439 -2.172 -12.741) 12.932 9.712 ( -5.623 -0.751 0.703) 5.716 10.023 ( 1.373 -2.537 -3.637) 4.642 10.288 ( -5.439 -1.816 -3.746) 6.849 10.363 ( 2.661 0.553 1.658) 3.184 10.946 ( -8.324 -1.830 -0.497) 8.537 11.110 ( -9.671 1.088 -1.084) 9.792 11.542 ( -20.695 3.645 5.105) 21.624 11.673 ( 2.716 3.336 -6.156) 7.510 11.839 ( 2.627 0.160 0.737) 2.733 12.250 ( -3.256 -1.992 0.369) 3.835 12.293 ( 13.945 -6.353 -2.276) 15.493 12.654 ( 6.996 0.573 -10.777) 12.862 13.259 ( 4.271 -0.520 8.083) 9.157 13.788 ( -3.258 -0.879 3.472) 4.842 14.177 ( 11.404 -0.491 5.400) 12.628 14.605 ( -3.691 -4.059 -10.214) 11.594 15.023 ( -17.114 -6.069 6.468) 19.276 15.773 ( 7.851 4.882 0.351) 9.252 16.014 ( -0.249 -0.516 -0.032) 0.574 16.110 ( 3.366 2.618 -0.086) 4.265 17.871 ( 2.830 1.265 11.656) 12.061 18.406 ( -7.443 -4.145 4.467) 9.620 18.579 ( -6.703 5.955 -6.345) 10.984 19.364 ( 5.937 -3.125 -6.332) 9.225 ======================= Grid point 291 (143/260) ======================= q-point: ( 0.20 0.12 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 400 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.700 ( 7.240 4.582 14.970) 17.249 2.228 ( 10.846 4.038 8.743) 14.504 2.928 ( 0.683 0.324 6.832) 6.874 2.999 ( -0.735 0.561 0.395) 1.005 3.883 ( -0.094 2.581 3.822) 4.613 4.521 ( -5.077 4.002 -3.307) 7.261 4.931 ( 5.754 0.831 -2.645) 6.387 5.212 ( 1.742 0.429 -4.234) 4.598 5.845 ( 3.232 -5.197 -3.495) 7.048 6.045 ( 2.376 -8.325 2.663) 9.058 6.260 ( -5.615 1.429 1.980) 6.123 6.355 ( 2.200 -2.346 7.515) 8.174 6.414 ( -3.726 1.083 6.624) 7.677 6.694 ( -1.583 7.448 -4.582) 8.887 6.981 ( -0.415 -2.299 -0.295) 2.354 7.101 ( 1.649 -7.255 -7.790) 10.773 7.619 ( 2.576 12.674 -0.346) 12.938 7.878 ( 4.180 1.260 -2.275) 4.923 8.139 ( -2.746 10.816 -5.133) 12.283 8.360 ( -3.657 2.811 3.875) 6.024 8.894 ( 3.789 5.550 -3.751) 7.696 8.944 ( -3.400 -2.829 -9.327) 10.323 9.089 ( -0.382 -0.247 0.172) 0.487 9.512 ( -11.549 -4.454 -3.163) 12.776 9.688 ( 5.286 -1.923 -4.275) 7.065 10.028 ( 0.582 -0.398 -2.850) 2.936 10.243 ( 1.387 -3.623 3.368) 5.137 10.437 ( 1.501 -0.434 5.582) 5.797 10.753 ( -10.244 -1.502 -0.415) 10.361 10.914 ( -8.311 1.112 -1.624) 8.541 11.200 ( -16.345 8.094 7.495) 19.719 11.605 ( -5.467 2.231 -9.077) 10.828 11.874 ( -1.884 -0.796 3.208) 3.804 12.226 ( 0.116 -3.152 5.677) 6.495 12.570 ( 13.612 -8.163 -2.825) 16.121 12.736 ( 8.544 0.324 -9.336) 12.659 13.438 ( 7.710 -3.346 7.147) 11.033 13.780 ( 1.975 1.606 2.932) 3.883 14.372 ( 2.046 -4.521 -2.259) 5.453 14.510 ( 2.379 1.996 -5.185) 6.044 14.840 ( -5.854 -2.478 10.624) 12.380 15.921 ( -1.519 -0.777 -4.100) 4.441 15.981 ( 8.332 4.522 4.026) 10.299 16.240 ( 5.766 0.850 2.958) 6.536 17.927 ( -5.443 -1.538 9.506) 11.061 18.246 ( -10.444 -2.096 2.330) 10.904 18.409 ( -3.904 6.448 -10.463) 12.896 19.386 ( 0.821 -1.995 -6.968) 7.294 ======================= Grid point 292 (144/260) ======================= q-point: ( 0.30 0.12 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 400 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.947 ( 8.550 -1.852 12.491) 15.250 2.424 ( 4.557 -0.246 6.887) 8.262 2.944 ( -3.154 0.518 1.914) 3.725 2.950 ( -2.798 0.996 -3.218) 4.379 3.909 ( -0.418 3.073 5.915) 6.679 4.389 ( -6.065 3.826 -3.542) 7.998 5.015 ( 4.894 -0.267 -6.155) 7.868 5.121 ( -4.272 1.325 -11.322) 12.173 5.927 ( 6.592 -5.399 -2.334) 8.835 6.083 ( -11.948 -3.206 10.422) 16.176 6.102 ( 2.063 -6.612 -3.655) 7.831 6.406 ( -0.798 2.408 2.470) 3.541 6.443 ( 1.638 0.214 1.535) 2.255 6.690 ( 2.614 6.783 1.858) 7.503 6.968 ( -0.775 -1.959 -0.652) 2.206 7.149 ( 6.872 -3.347 -4.534) 8.887 7.634 ( -1.828 13.400 1.610) 13.619 7.907 ( 0.828 1.961 -6.061) 6.424 8.055 ( -0.150 9.729 -8.340) 12.816 8.313 ( -3.830 4.019 3.551) 6.590 8.737 ( -8.785 -1.657 -13.978) 16.592 8.872 ( -2.368 2.364 -8.206) 8.862 9.095 ( 0.229 -0.026 2.170) 2.182 9.262 ( -10.739 -3.659 -2.295) 11.575 9.821 ( 8.021 -2.823 -0.186) 8.505 9.991 ( -2.320 0.224 -3.387) 4.111 10.316 ( -2.680 -4.650 8.099) 9.716 10.444 ( -2.801 -7.041 7.484) 10.650 10.609 ( -3.886 -2.297 2.322) 5.076 10.808 ( -1.312 2.498 -2.649) 3.870 11.062 ( -1.682 11.461 7.120) 13.597 11.385 ( -10.649 2.196 -8.417) 13.751 11.814 ( -5.309 -2.970 2.968) 6.769 12.298 ( 1.895 0.302 7.770) 8.004 12.694 ( 1.965 -4.376 -0.633) 4.839 12.919 ( 14.147 -6.120 -8.864) 17.781 13.561 ( 1.143 -8.430 4.813) 9.774 13.938 ( 8.974 6.539 6.537) 12.885 14.292 ( -1.398 -1.442 -6.543) 6.844 14.549 ( 1.196 0.965 -0.917) 1.790 14.946 ( 7.629 -0.445 10.003) 12.588 15.830 ( -3.287 -0.355 -5.177) 6.142 16.216 ( 10.750 1.943 5.708) 12.326 16.345 ( 2.845 1.703 4.703) 5.755 17.738 ( -16.747 -4.045 3.465) 17.574 18.082 ( -6.158 -2.604 -4.863) 8.267 18.332 ( 0.907 8.431 -5.120) 9.906 19.319 ( -2.463 -0.498 -8.405) 8.773 ======================= Grid point 293 (145/260) ======================= q-point: ( 0.40 0.12 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 400 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.148 ( 3.859 -6.372 10.990) 13.277 2.504 ( 0.475 -4.924 5.075) 7.087 2.789 ( -10.852 -0.857 -2.270) 11.120 2.892 ( -2.071 3.210 -4.316) 5.763 3.938 ( -0.625 3.129 6.306) 7.068 4.261 ( -4.558 4.021 -3.120) 6.832 4.873 ( -8.883 0.747 -13.346) 16.049 5.103 ( 4.873 0.023 -9.633) 10.796 5.902 ( -9.858 -3.171 7.286) 12.662 5.998 ( 0.739 0.569 -8.275) 8.328 6.173 ( 5.054 -5.442 7.109) 10.281 6.435 ( 1.636 0.347 3.248) 3.653 6.465 ( 1.285 -0.732 0.591) 1.593 6.760 ( 2.011 6.259 1.892) 6.841 6.942 ( -1.019 -3.739 -2.051) 4.385 7.284 ( 8.768 0.673 -2.660) 9.187 7.561 ( -6.362 15.170 1.280) 16.500 7.857 ( -0.351 3.278 -7.555) 8.243 8.038 ( 3.182 6.350 -9.789) 12.094 8.245 ( -5.037 3.719 2.181) 6.630 8.475 ( -8.207 -0.898 -14.919) 17.051 8.729 ( -5.904 0.629 -9.572) 11.264 9.102 ( -1.635 -2.623 3.336) 4.548 9.153 ( 0.121 1.086 3.567) 3.730 9.863 ( -4.357 0.080 -2.093) 4.834 9.987 ( 5.024 -2.846 -3.381) 6.691 10.169 ( -11.814 -1.553 8.065) 14.388 10.532 ( 1.624 -9.979 6.099) 11.808 10.591 ( 0.745 -4.601 4.600) 6.549 10.829 ( 5.297 1.185 -1.508) 5.633 11.092 ( -6.085 0.962 -10.404) 12.091 11.228 ( 3.868 10.164 10.779) 15.312 11.737 ( -3.915 -2.229 2.849) 5.330 12.366 ( -0.074 2.251 5.926) 6.340 12.697 ( 0.202 -6.376 -2.708) 6.930 13.097 ( 8.480 -5.457 -5.581) 11.525 13.590 ( -0.391 -7.244 4.737) 8.664 14.013 ( -4.480 9.087 3.777) 10.813 14.380 ( 9.224 -4.596 1.780) 10.458 14.588 ( 5.005 4.234 0.126) 6.558 15.166 ( 9.414 -1.096 4.390) 10.445 15.734 ( -3.236 -0.952 -5.749) 6.665 16.385 ( 1.483 0.882 6.315) 6.546 16.479 ( 8.704 2.566 7.581) 11.825 17.405 ( -17.783 -4.367 0.071) 18.312 17.931 ( -4.363 -3.687 -11.098) 12.482 18.356 ( 2.990 9.375 -0.834) 9.876 19.197 ( -4.133 0.126 -9.879) 10.710 ======================= Grid point 294 (146/260) ======================= q-point: (-0.50 0.12 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 400 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.207 ( -4.818 -8.393 10.928) 14.597 2.477 ( -13.381 -0.799 0.823) 13.430 2.569 ( -1.003 -9.298 -2.273) 9.625 2.836 ( -1.815 3.576 -1.312) 4.220 3.962 ( -0.542 2.310 4.934) 5.475 4.189 ( -1.251 4.573 -1.609) 5.007 4.608 ( -9.908 0.774 -11.904) 15.507 5.088 ( 0.277 0.463 -11.817) 11.830 5.768 ( -10.130 -0.050 8.380) 13.147 5.949 ( 0.804 4.032 -5.093) 6.546 6.318 ( 3.397 -6.748 4.278) 8.682 6.437 ( -1.626 -0.988 2.290) 2.977 6.554 ( 4.525 -0.188 6.005) 7.522 6.798 ( 2.604 7.058 0.408) 7.534 6.908 ( -0.524 -4.309 -3.598) 5.638 7.402 ( -1.068 8.949 -4.374) 10.018 7.452 ( 1.167 8.502 0.285) 8.587 7.814 ( -0.275 3.110 -5.254) 6.112 8.026 ( 1.948 4.150 -11.849) 12.705 8.168 ( -3.782 1.827 2.613) 4.947 8.259 ( -4.621 1.053 -12.967) 13.806 8.561 ( -4.412 0.794 -9.647) 10.638 9.141 ( 1.093 -2.427 6.711) 7.219 9.238 ( 5.758 2.273 6.820) 9.210 9.746 ( -5.386 0.036 -3.045) 6.187 10.021 ( 1.102 -2.403 -4.596) 5.302 10.052 ( -3.840 -0.355 4.453) 5.891 10.551 ( -0.811 -4.387 4.369) 6.244 10.681 ( 3.836 -4.806 3.914) 7.289 10.906 ( -5.303 1.520 -6.885) 8.822 10.984 ( 9.796 -6.715 1.578) 11.980 11.388 ( 3.293 -0.212 5.537) 6.446 11.739 ( 2.577 4.032 6.125) 7.772 12.336 ( -4.249 -0.823 -2.415) 4.956 12.710 ( 2.627 -4.451 -0.100) 5.170 13.167 ( 1.822 -2.373 -4.022) 5.013 13.615 ( -0.626 -3.783 6.019) 7.137 13.925 ( -6.018 8.193 3.937) 10.902 14.467 ( -0.455 -4.034 0.997) 4.180 14.799 ( 13.308 3.793 3.247) 14.213 15.338 ( 7.171 -2.166 -1.579) 7.656 15.630 ( -3.942 -1.464 -5.903) 7.248 16.456 ( 1.622 1.129 10.877) 11.055 16.692 ( 8.181 2.188 7.189) 11.108 17.079 ( -15.591 -4.190 -0.408) 16.149 17.780 ( -3.312 -5.482 -13.607) 15.039 18.430 ( 4.696 11.033 0.748) 12.014 19.047 ( -4.553 0.248 -10.507) 11.454 ======================= Grid point 295 (147/260) ======================= q-point: (-0.40 0.12 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 400 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.116 ( -14.429 -9.572 4.732) 17.950 2.147 ( -14.471 -0.443 7.319) 16.223 2.609 ( 2.124 -9.809 2.414) 10.322 2.805 ( -1.519 1.478 1.881) 2.834 3.975 ( -0.699 1.232 2.619) 2.978 4.196 ( 2.264 4.853 0.602) 5.389 4.364 ( -8.789 1.327 -6.972) 11.297 4.985 ( -3.078 2.637 -10.884) 11.614 5.600 ( -11.242 2.957 5.584) 12.896 5.978 ( 3.602 3.075 -2.058) 5.164 6.298 ( -4.663 -3.905 2.536) 6.590 6.448 ( -1.305 -0.153 4.099) 4.304 6.685 ( 2.419 -2.952 10.214) 10.904 6.891 ( 6.466 6.343 -0.153) 9.059 6.900 ( 3.533 -2.837 -4.712) 6.537 7.267 ( -5.480 12.389 -4.894) 14.404 7.539 ( 4.596 3.741 -1.830) 6.202 7.757 ( -2.890 0.762 -4.659) 5.535 7.948 ( -1.716 3.681 -13.070) 13.686 8.095 ( -3.582 0.559 -2.514) 4.412 8.217 ( 4.803 4.475 -1.440) 6.721 8.466 ( 0.659 1.372 -8.955) 9.084 9.188 ( -0.596 -2.390 7.147) 7.560 9.444 ( 8.682 1.829 8.271) 12.130 9.642 ( -1.394 1.184 -4.695) 5.039 10.002 ( 1.548 -1.580 -10.178) 10.415 10.082 ( 3.319 -0.826 8.141) 8.831 10.569 ( 0.020 -2.699 3.527) 4.442 10.775 ( 4.348 -2.671 0.745) 5.157 10.806 ( -2.105 1.224 -3.832) 4.541 11.196 ( 9.804 -11.246 4.114) 15.476 11.409 ( -0.898 -5.825 -1.088) 5.993 11.899 ( 7.026 5.365 10.779) 13.940 12.213 ( -4.177 -1.994 -6.909) 8.316 12.772 ( 2.528 -4.304 0.279) 4.999 13.125 ( -2.994 2.392 -4.371) 5.812 13.615 ( -4.418 0.856 6.457) 7.870 13.856 ( -3.175 4.760 3.915) 6.933 14.417 ( -3.858 -3.114 -2.729) 5.659 15.064 ( 11.307 2.966 3.865) 12.312 15.401 ( 0.465 -4.361 -5.479) 7.018 15.521 ( -2.208 -0.457 -5.696) 6.126 16.600 ( 4.183 -1.507 14.085) 14.770 16.802 ( -8.942 -1.984 -3.359) 9.756 16.893 ( 4.872 1.609 10.796) 11.953 17.634 ( -3.027 -7.866 -12.876) 15.389 18.543 ( 6.067 13.270 1.710) 14.692 18.903 ( -3.563 0.715 -9.550) 10.218 ======================= Grid point 296 (148/260) ======================= q-point: (-0.30 0.12 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 400 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.752 ( -21.003 -7.139 5.530) 22.862 2.021 ( -11.237 -1.134 15.943) 19.538 2.655 ( -1.069 -7.798 7.381) 10.791 2.809 ( 0.404 -1.404 3.998) 4.257 3.955 ( -2.190 0.731 -0.365) 2.337 4.207 ( -4.572 2.675 1.740) 5.576 4.283 ( 4.994 5.033 2.788) 7.618 4.853 ( -3.903 4.835 -8.977) 10.918 5.446 ( -6.660 3.733 3.819) 8.537 6.027 ( 2.097 1.467 -1.760) 3.106 6.240 ( -2.640 -2.668 2.298) 4.402 6.415 ( -4.859 1.543 5.880) 7.783 6.739 ( -1.644 -4.422 7.999) 9.287 6.983 ( 5.678 -0.638 -4.053) 7.005 7.005 ( 3.816 3.851 -0.155) 5.424 7.191 ( 1.982 8.199 -2.994) 8.951 7.599 ( 2.147 3.091 -3.075) 4.860 7.655 ( -2.820 1.204 -3.676) 4.787 7.830 ( -2.374 4.529 -9.963) 11.199 8.052 ( 0.753 2.410 -2.482) 3.540 8.342 ( 6.623 5.243 2.805) 8.900 8.461 ( 3.978 1.764 -8.021) 9.125 9.215 ( -1.026 -2.442 7.239) 7.708 9.540 ( 2.076 -2.124 -2.477) 3.867 9.752 ( 10.396 4.431 2.187) 11.510 9.964 ( 1.735 -1.052 -12.106) 12.275 10.247 ( 7.030 -2.835 9.153) 11.884 10.599 ( 2.071 -1.235 1.527) 2.855 10.748 ( -2.000 0.740 -2.333) 3.161 10.872 ( 5.676 -1.987 -1.017) 6.099 11.346 ( 1.362 -9.567 -2.538) 9.991 11.432 ( 6.129 -6.344 5.021) 10.150 12.097 ( 3.721 -0.607 4.913) 6.193 12.134 ( 2.815 0.985 0.648) 3.052 12.751 ( -6.355 -7.791 0.306) 10.059 13.038 ( -0.710 7.582 -8.818) 11.651 13.515 ( -9.346 2.642 5.901) 11.365 13.837 ( -2.284 3.428 2.472) 4.804 14.294 ( -4.903 -2.895 -7.856) 9.702 15.266 ( 1.340 -0.622 5.671) 5.860 15.287 ( -0.586 -2.023 -8.638) 8.891 15.503 ( 2.096 0.396 -3.817) 4.373 16.534 ( -11.455 -7.550 1.212) 13.773 16.836 ( 4.360 0.852 3.245) 5.501 17.061 ( 5.735 1.737 7.764) 9.808 17.565 ( 3.892 -10.258 0.292) 10.975 18.659 ( 3.797 10.836 -0.003) 11.482 18.822 ( 1.537 6.455 -5.162) 8.407 ======================= Grid point 297 (149/260) ======================= q-point: (-0.20 0.12 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 400 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.418 ( -18.688 -7.414 13.925) 24.456 1.895 ( -12.843 6.429 17.489) 22.630 2.660 ( -4.725 -4.435 14.685) 16.051 2.868 ( 2.131 -3.937 5.164) 6.834 3.913 ( -0.952 0.692 -1.004) 1.547 4.205 ( 1.230 4.671 8.625) 9.885 4.421 ( 6.006 4.625 5.813) 9.552 4.735 ( -2.575 6.064 -7.533) 10.008 5.416 ( 1.543 2.198 2.939) 3.981 6.027 ( -0.684 0.274 -2.343) 2.456 6.215 ( -1.383 -2.711 0.953) 3.189 6.362 ( -4.116 2.184 6.628) 8.102 6.750 ( -2.063 -3.475 7.078) 8.150 6.962 ( -1.552 2.866 -5.570) 6.454 7.114 ( 6.200 0.950 -0.221) 6.277 7.252 ( 2.714 -0.543 -0.826) 2.888 7.510 ( -4.102 -4.992 -5.929) 8.769 7.667 ( -0.517 12.468 -3.354) 12.922 7.809 ( 6.650 4.985 0.469) 8.325 8.084 ( 4.014 4.708 -2.563) 6.697 8.481 ( 5.529 4.887 3.618) 8.218 8.512 ( 5.526 2.109 -5.503) 8.078 9.238 ( -1.288 -2.038 6.939) 7.346 9.605 ( 6.913 -4.329 -4.267) 9.205 9.895 ( 2.238 0.539 -8.471) 8.778 9.940 ( 4.195 2.648 -5.091) 7.109 10.416 ( 5.128 -5.545 4.810) 8.955 10.677 ( -3.140 0.720 -1.310) 3.478 10.703 ( 7.092 0.205 -0.617) 7.122 10.993 ( 8.430 -0.935 -2.574) 8.864 11.344 ( 1.268 -5.547 -0.284) 5.697 11.583 ( 4.845 -4.439 4.206) 7.802 12.106 ( 2.963 0.462 -4.146) 5.117 12.316 ( 5.219 -3.795 10.874) 12.644 12.543 ( -14.024 -5.145 0.759) 14.957 12.967 ( -0.507 4.822 -15.333) 16.081 13.356 ( -10.308 1.931 6.320) 12.244 13.753 ( -6.787 4.518 -0.247) 8.157 14.167 ( -2.388 -2.093 -8.898) 9.447 15.091 ( -8.241 -6.959 -5.454) 12.087 15.408 ( 4.835 3.342 0.747) 5.925 15.547 ( 3.769 0.357 0.748) 3.859 16.309 ( -12.666 -10.253 -0.357) 16.300 16.709 ( -11.978 3.351 -12.420) 17.577 17.254 ( 8.505 1.006 9.793) 13.010 17.868 ( 18.326 -14.697 17.504) 29.296 18.669 ( 0.596 2.283 -4.283) 4.890 18.913 ( 7.379 17.606 -0.138) 19.090 ======================= Grid point 298 (150/260) ======================= q-point: (-0.10 0.12 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 400 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.270 ( -6.108 -1.931 19.657) 20.675 1.746 ( -13.131 13.583 17.233) 25.572 2.683 ( -3.830 -2.017 20.363) 20.819 2.931 ( 0.977 -3.784 4.572) 6.014 3.899 ( -0.037 0.571 -2.210) 2.283 4.380 ( 9.853 4.590 13.702) 17.490 4.571 ( 4.876 4.203 7.653) 10.000 4.675 ( 0.997 6.381 -6.305) 9.026 5.528 ( 7.621 -0.911 2.467) 8.062 5.989 ( -1.019 0.084 -2.954) 3.126 6.191 ( -1.683 -2.591 0.739) 3.177 6.343 ( -2.296 1.011 6.585) 7.046 6.734 ( -4.564 -1.417 7.023) 8.495 6.889 ( -2.280 4.183 -5.708) 7.435 7.171 ( -0.729 -8.242 -4.130) 9.248 7.314 ( 5.226 6.294 2.146) 8.458 7.401 ( -2.704 -9.152 -7.822) 12.339 7.636 ( -0.051 9.709 0.669) 9.732 8.003 ( 9.141 12.808 3.441) 16.107 8.178 ( 7.175 1.311 -0.790) 7.336 8.572 ( 2.654 7.267 0.930) 7.793 8.628 ( 8.357 0.066 -0.740) 8.390 9.240 ( -2.885 -1.509 5.579) 6.459 9.726 ( 6.711 -6.818 -3.527) 10.196 9.841 ( 0.970 -0.292 -13.273) 13.312 9.967 ( 1.033 3.762 -2.213) 4.485 10.467 ( -1.871 -5.712 -3.001) 6.718 10.570 ( -4.460 0.833 -3.233) 5.571 10.881 ( 9.631 -0.059 -0.233) 9.634 11.156 ( 9.332 0.422 -3.172) 9.865 11.418 ( 5.411 -5.051 2.142) 7.706 11.670 ( 3.648 1.084 0.775) 3.883 12.143 ( 0.241 -2.805 -1.858) 3.374 12.271 ( -12.826 -1.617 4.339) 13.636 12.393 ( -3.420 -0.448 0.647) 3.509 12.801 ( -4.948 -0.246 -17.431) 18.121 13.223 ( -7.132 -0.109 6.999) 9.993 13.669 ( -0.926 6.122 5.209) 8.091 14.078 ( -2.260 -1.923 -6.752) 7.376 14.906 ( -6.914 -7.501 -6.657) 12.181 15.468 ( 0.599 0.216 0.841) 1.055 15.658 ( 5.574 0.252 4.010) 6.871 16.007 ( -16.433 -9.045 -5.000) 19.413 16.394 ( -11.369 6.873 -7.122) 15.074 17.485 ( 8.462 2.013 10.949) 13.983 18.308 ( 12.017 -17.330 17.078) 27.137 18.669 ( 2.865 2.251 -5.511) 6.606 19.064 ( 9.216 14.986 -2.654) 17.792 ======================= Grid point 299 (151/260) ======================= q-point: ( 0.00 0.25 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 400 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.627 ( 10.234 15.416 11.739) 21.914 1.968 ( -3.982 15.039 13.546) 20.628 2.727 ( 2.601 -3.131 12.928) 13.554 2.901 ( 1.523 -4.420 6.733) 8.197 3.943 ( -1.451 5.152 3.348) 6.314 4.710 ( 2.566 4.381 5.081) 7.183 4.825 ( 6.995 5.428 5.966) 10.677 4.851 ( 5.474 6.427 5.612) 10.138 5.589 ( 5.061 -6.501 1.175) 8.322 5.884 ( -0.496 -6.030 -7.621) 9.731 6.210 ( -0.089 2.686 6.052) 6.622 6.309 ( -4.384 -1.442 4.016) 6.118 6.684 ( -6.685 2.676 7.310) 10.261 6.840 ( -1.784 -14.882 -6.461) 16.322 6.924 ( 0.092 4.622 -2.462) 5.238 7.139 ( -2.583 -6.062 -5.490) 8.577 7.634 ( 7.741 9.092 -2.416) 12.183 7.865 ( 0.853 11.546 1.207) 11.640 8.279 ( 4.687 -1.602 5.221) 7.197 8.459 ( 4.284 15.245 -0.505) 15.844 8.788 ( 9.747 1.162 -2.976) 10.258 8.837 ( 4.555 8.611 0.284) 9.746 9.165 ( -4.728 -0.724 3.275) 5.797 9.658 ( 3.803 -6.413 -8.495) 11.303 9.775 ( 0.654 -0.966 -8.776) 8.853 9.945 ( -2.987 -5.009 -4.868) 7.597 10.294 ( -1.542 -4.769 1.180) 5.149 10.473 ( -6.090 3.822 -1.996) 7.462 10.999 ( 0.318 -0.657 0.710) 1.018 11.233 ( 0.416 -0.700 -1.557) 1.757 11.526 ( 9.598 0.382 2.657) 9.966 11.732 ( 5.525 -5.441 -2.231) 8.068 11.949 ( -9.663 -2.478 -0.134) 9.976 12.073 ( -6.394 -2.828 4.021) 8.065 12.408 ( -1.929 3.705 -2.120) 4.685 12.612 ( -1.647 0.802 -13.069) 13.197 13.210 ( -0.623 4.294 2.869) 5.202 13.833 ( -3.146 2.259 4.592) 6.007 13.968 ( 6.064 -2.981 -4.461) 8.097 14.565 ( -3.533 -10.449 -6.803) 12.960 15.184 ( -19.498 -7.108 10.278) 23.159 15.785 ( 3.980 3.516 -1.691) 5.573 15.866 ( 6.827 -0.610 1.153) 6.950 16.293 ( -7.298 4.785 -5.840) 10.501 17.767 ( 5.859 4.029 12.916) 14.744 18.278 ( 2.275 -9.179 14.974) 17.711 18.789 ( 3.798 5.687 -5.338) 8.675 19.265 ( 1.133 0.701 -9.473) 9.566 ======================= Grid point 300 (152/260) ======================= q-point: ( 0.10 0.25 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 400 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.789 ( 0.276 15.765 9.308) 18.310 2.106 ( 9.672 10.992 9.401) 17.399 2.848 ( 2.869 -0.891 8.222) 8.754 2.963 ( 0.809 -2.589 5.543) 6.171 3.943 ( -1.200 5.256 5.214) 7.500 4.704 ( -3.292 4.253 0.264) 5.385 4.904 ( 3.234 4.740 0.234) 5.743 5.094 ( 7.916 1.078 8.394) 11.588 5.700 ( 6.308 -6.253 -1.209) 8.965 5.835 ( 0.408 -7.658 -5.718) 9.566 6.213 ( -5.576 -6.728 3.141) 9.286 6.292 ( 0.882 1.850 9.203) 9.429 6.566 ( -8.222 4.047 6.128) 11.024 6.812 ( 2.656 -9.483 -6.776) 11.954 6.917 ( -0.060 4.072 -1.429) 4.316 7.066 ( -0.654 -1.011 -6.603) 6.712 7.769 ( 7.601 7.479 -4.035) 11.401 7.901 ( 1.265 10.489 3.848) 11.244 8.357 ( 0.734 3.276 4.287) 5.446 8.499 ( 0.560 11.462 -2.875) 11.830 8.926 ( 3.124 -0.217 -1.261) 3.376 8.941 ( 8.069 6.134 -3.942) 10.875 9.088 ( -3.869 0.400 1.747) 4.264 9.614 ( -0.215 -4.929 -12.855) 13.769 9.677 ( -8.457 -3.596 -2.868) 9.627 9.922 ( 4.494 -6.806 -4.158) 9.155 10.270 ( -3.280 -0.604 1.635) 3.714 10.392 ( -0.933 3.362 2.398) 4.234 10.907 ( -8.364 -1.883 -0.684) 8.600 11.133 ( -9.439 1.259 0.113) 9.524 11.580 ( -13.863 -0.984 1.455) 13.974 11.739 ( 5.578 2.605 -1.252) 6.282 11.888 ( -1.512 4.829 0.832) 5.128 12.090 ( 10.254 -11.743 -2.011) 15.719 12.249 ( -8.343 1.226 0.060) 8.432 12.649 ( 6.894 -1.762 -8.530) 11.109 13.275 ( 4.436 2.635 4.113) 6.598 13.767 ( -1.620 -1.181 -1.504) 2.507 14.149 ( 9.819 -2.418 1.957) 10.300 14.494 ( 0.966 -6.832 -7.855) 10.455 14.908 ( -15.327 -4.527 13.092) 20.659 15.859 ( 5.595 3.110 -2.581) 6.902 16.017 ( 4.415 0.757 3.337) 5.586 16.172 ( -0.613 3.546 -3.146) 4.780 17.913 ( 0.639 2.878 12.169) 12.521 18.313 ( -5.559 -5.037 9.276) 11.930 18.718 ( -5.773 7.645 -9.902) 13.778 19.287 ( 5.575 -4.323 -6.272) 9.440 ======================= Grid point 301 (153/260) ======================= q-point: ( 0.20 0.25 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 400 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.853 ( 2.169 10.775 6.766) 12.907 2.328 ( 6.597 5.444 6.387) 10.675 2.932 ( 2.371 -0.048 1.927) 3.055 2.988 ( -1.387 -2.160 3.289) 4.172 3.961 ( -0.846 4.921 6.730) 8.380 4.608 ( -5.887 4.074 -1.462) 7.307 4.965 ( 3.759 2.535 -1.612) 4.812 5.200 ( 0.301 -1.878 -0.182) 1.911 5.773 ( 3.279 -1.917 -4.544) 5.923 5.887 ( 7.389 -6.816 -2.240) 10.299 6.090 ( -10.548 -10.173 9.141) 17.271 6.361 ( 0.257 -3.429 5.366) 6.373 6.498 ( -1.755 6.522 4.295) 8.003 6.825 ( 1.013 4.831 -3.802) 6.231 6.911 ( 3.037 -8.754 -6.426) 11.276 7.055 ( 2.663 7.301 -2.167) 8.068 7.859 ( 4.389 8.430 -4.126) 10.361 7.957 ( 1.698 7.897 3.689) 8.880 8.359 ( -2.574 10.086 -0.588) 10.426 8.465 ( -1.384 7.777 -0.916) 7.952 8.882 ( -4.194 -2.865 -7.924) 9.412 9.009 ( -0.889 5.179 -3.080) 6.091 9.067 ( 2.039 -1.625 -2.958) 3.943 9.408 ( -11.860 -6.268 -5.830) 14.626 9.627 ( 4.496 -4.212 -3.409) 7.041 9.991 ( 3.645 -3.118 -3.512) 5.945 10.227 ( -1.696 1.912 4.142) 4.867 10.407 ( -2.798 -1.395 6.661) 7.359 10.722 ( -9.649 -1.567 -0.635) 9.796 10.942 ( -7.888 1.633 -0.836) 8.099 11.320 ( -11.716 1.477 1.744) 11.937 11.673 ( -7.927 4.516 -5.035) 10.421 11.890 ( -3.533 3.375 1.952) 5.262 12.155 ( 1.747 -3.642 6.324) 7.504 12.383 ( 15.214 -9.794 -0.103) 18.094 12.693 ( 2.931 -4.775 -8.022) 9.785 13.385 ( 3.025 -1.519 4.511) 5.639 13.811 ( 7.494 1.542 -0.639) 7.678 14.276 ( 1.892 -4.771 -0.791) 5.193 14.510 ( 4.841 -2.418 -6.763) 8.661 14.810 ( -2.710 0.203 14.922) 15.168 15.900 ( -1.447 -1.206 -3.671) 4.126 16.091 ( 6.480 5.954 2.013) 9.027 16.259 ( 6.110 0.909 2.955) 6.848 17.905 ( -9.267 -0.345 8.117) 12.324 18.203 ( -9.278 -2.271 4.428) 10.529 18.547 ( -2.866 6.950 -10.721) 13.094 19.339 ( 2.727 -2.422 -5.875) 6.915 ======================= Grid point 302 (154/260) ======================= q-point: ( 0.30 0.25 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 400 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.954 ( 4.240 3.387 4.299) 6.923 2.421 ( -0.020 -0.019 3.842) 3.842 2.921 ( -5.504 -3.111 0.155) 6.325 2.971 ( 0.316 0.998 -2.414) 2.631 3.989 ( -0.842 4.369 7.036) 8.325 4.474 ( -6.325 4.109 -2.527) 7.955 5.032 ( 4.468 1.846 -3.821) 6.162 5.118 ( -5.219 -1.598 -8.020) 9.701 5.844 ( 6.140 -2.521 -0.344) 6.647 5.922 ( -7.627 -9.822 2.370) 12.660 6.030 ( 3.252 -1.632 4.904) 6.106 6.387 ( -0.100 -3.247 5.329) 6.241 6.501 ( -0.618 4.128 0.508) 4.204 6.819 ( 0.411 6.771 -1.084) 6.870 6.939 ( 3.659 -5.426 -7.232) 9.754 7.149 ( 7.920 6.328 -1.190) 10.208 7.894 ( 0.813 9.749 -0.454) 9.793 7.986 ( -0.415 7.130 -0.468) 7.158 8.263 ( -3.287 10.183 -6.592) 12.568 8.447 ( -2.119 9.309 1.654) 9.689 8.691 ( -7.928 -2.241 -13.023) 15.410 8.898 ( -6.571 -0.931 -6.775) 9.484 9.070 ( -0.753 -2.469 -1.705) 3.093 9.196 ( -5.964 -2.563 -1.112) 6.586 9.745 ( 7.524 -4.596 0.159) 8.818 9.989 ( -1.519 -0.509 -4.134) 4.434 10.235 ( -4.025 -2.995 7.389) 8.931 10.342 ( -5.589 -2.690 6.248) 8.804 10.567 ( -5.686 -1.717 1.296) 6.079 10.858 ( -0.321 2.262 -2.769) 3.590 11.184 ( -3.290 -0.481 -0.445) 3.354 11.461 ( -10.568 4.534 -2.105) 11.691 11.798 ( -5.006 2.870 2.649) 6.350 12.289 ( 4.768 -1.324 9.434) 10.653 12.583 ( 0.577 -6.335 -0.641) 6.393 12.741 ( 11.935 -10.770 -7.296) 17.654 13.448 ( 1.379 -3.036 4.553) 5.643 14.015 ( 10.399 1.550 5.173) 11.718 14.254 ( -2.300 -2.155 -0.123) 3.154 14.569 ( 5.669 0.691 -5.508) 7.934 14.953 ( 7.346 1.428 9.528) 12.116 15.810 ( -4.039 -1.625 -4.821) 6.496 16.273 ( 8.886 3.479 3.762) 10.258 16.385 ( 4.225 2.042 5.685) 7.372 17.657 ( -17.587 -3.595 1.036) 17.981 18.050 ( -7.874 -0.979 -0.836) 7.979 18.496 ( 2.270 7.583 -5.883) 9.862 19.308 ( -1.468 -0.568 -7.564) 7.726 ======================= Grid point 303 (155/260) ======================= q-point: ( 0.40 0.25 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 400 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.045 ( 1.902 -3.065 3.731) 5.189 2.399 ( -2.972 -4.778 1.127) 5.739 2.749 ( -11.070 -3.046 -3.506) 12.004 2.938 ( -1.831 0.964 -3.794) 4.322 4.012 ( -1.077 3.966 6.322) 7.540 4.352 ( -4.272 4.422 -2.436) 6.614 4.899 ( -9.209 1.666 -10.839) 14.320 5.099 ( 3.767 -0.287 -6.848) 7.821 5.805 ( -7.252 -6.267 8.578) 12.862 5.978 ( 6.366 -2.315 -0.969) 6.843 6.112 ( 3.433 -0.111 2.824) 4.447 6.432 ( 0.111 -0.371 7.148) 7.159 6.494 ( 1.109 2.680 -0.715) 2.987 6.810 ( -0.524 1.666 -2.281) 2.873 6.961 ( 2.656 1.641 -5.690) 6.490 7.315 ( 9.790 3.037 -2.751) 10.613 7.872 ( -5.125 14.923 2.819) 16.028 7.942 ( -0.609 4.783 -5.200) 7.092 8.188 ( 0.059 7.547 -8.212) 11.153 8.349 ( -7.792 5.327 -2.170) 9.685 8.467 ( -6.520 1.870 -11.836) 13.642 8.727 ( -5.355 -1.109 -8.042) 9.725 9.035 ( -0.980 -3.759 2.289) 4.508 9.178 ( 1.737 1.247 3.811) 4.370 9.855 ( 0.128 -1.620 -2.431) 2.924 9.917 ( 0.302 -3.355 -1.824) 3.831 10.120 ( -9.104 -3.407 6.937) 11.942 10.361 ( 2.182 -5.364 4.136) 7.116 10.514 ( -1.608 -3.358 3.258) 4.948 10.869 ( 3.192 2.062 -4.052) 5.555 11.098 ( -4.904 -0.994 -8.206) 9.611 11.314 ( -4.581 -0.997 5.337) 7.104 11.772 ( 0.171 5.854 5.429) 7.986 12.393 ( -1.613 -0.121 4.205) 4.506 12.529 ( 0.205 -9.512 -1.815) 9.686 12.955 ( 10.891 -7.793 -2.637) 13.649 13.514 ( 2.067 -0.805 6.595) 6.958 14.145 ( -5.073 4.104 9.946) 11.895 14.280 ( 6.776 -5.189 0.399) 8.544 14.682 ( 9.746 4.890 -4.365) 11.745 15.152 ( 8.601 0.080 2.809) 9.048 15.697 ( -4.446 -2.795 -5.303) 7.463 16.418 ( 2.849 2.407 5.222) 6.417 16.534 ( 7.183 2.543 8.523) 11.433 17.308 ( -17.288 -4.663 -2.180) 18.038 17.883 ( -7.441 -1.208 -5.141) 9.125 18.541 ( 5.093 8.545 -3.193) 10.447 19.199 ( -4.032 0.089 -9.350) 10.183 ======================= Grid point 304 (156/260) ======================= q-point: (-0.50 0.25 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 400 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.050 ( -4.635 -6.952 5.196) 9.839 2.357 ( -0.927 -8.930 -0.322) 8.984 2.466 ( -15.045 -1.397 -4.154) 15.670 2.862 ( -3.151 -1.178 -4.179) 5.365 4.025 ( -1.104 3.834 4.508) 6.020 4.290 ( -0.941 4.910 -0.960) 5.091 4.645 ( -10.021 2.882 -9.386) 14.029 5.090 ( 0.235 -0.378 -8.081) 8.094 5.738 ( -6.609 -2.852 9.671) 12.055 6.026 ( 1.694 2.288 -3.871) 4.805 6.232 ( 4.408 -0.998 5.263) 6.937 6.443 ( -1.725 1.629 4.157) 4.786 6.559 ( 3.045 0.639 4.639) 5.586 6.795 ( 1.623 -2.283 -1.956) 3.416 6.972 ( 2.448 5.397 -5.716) 8.234 7.469 ( 7.956 1.530 -4.059) 9.062 7.729 ( -8.797 14.259 -2.241) 16.903 7.903 ( -2.491 4.895 -2.811) 6.170 8.137 ( 0.171 5.950 -10.198) 11.808 8.218 ( -4.072 3.297 0.298) 5.248 8.289 ( -3.481 2.233 -9.971) 10.795 8.595 ( -2.982 2.852 -8.101) 9.091 9.078 ( 1.561 -3.610 5.537) 6.792 9.292 ( 6.830 2.774 6.998) 10.165 9.748 ( -5.466 0.178 -3.245) 6.359 9.956 ( 2.712 -3.978 -4.998) 6.940 10.034 ( -3.286 -1.510 5.305) 6.421 10.437 ( 2.503 -6.286 3.945) 7.832 10.552 ( 3.256 -6.642 4.359) 8.586 10.911 ( 4.451 -1.165 -11.549) 12.432 10.951 ( -4.888 2.298 0.865) 5.470 11.284 ( -1.967 -7.800 1.752) 8.232 11.860 ( 3.660 5.956 8.084) 10.688 12.282 ( -5.747 -4.604 -5.726) 9.328 12.598 ( 2.516 -6.006 5.609) 8.595 13.104 ( 6.669 -3.587 -3.953) 8.542 13.609 ( 2.412 2.796 9.277) 9.985 14.060 ( -7.870 5.182 6.609) 11.510 14.372 ( 1.144 -5.196 1.506) 5.529 14.889 ( 12.587 5.083 -0.224) 13.577 15.299 ( 6.359 -1.400 -3.535) 7.409 15.573 ( -4.694 -4.163 -5.561) 8.384 16.495 ( 1.122 2.775 9.717) 10.168 16.734 ( 7.207 1.362 9.911) 12.330 16.984 ( -14.289 -4.489 -3.122) 15.299 17.702 ( -7.134 -2.232 -7.815) 10.815 18.649 ( 7.688 10.031 -2.125) 12.816 19.052 ( -4.564 0.134 -10.077) 11.063 ======================= Grid point 305 (157/260) ======================= q-point: (-0.40 0.25 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 400 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.912 ( -13.251 -9.399 2.719) 16.472 2.172 ( -13.111 2.996 5.671) 14.595 2.373 ( 2.117 -12.715 0.140) 12.891 2.779 ( -2.762 -4.242 -3.042) 5.906 4.024 ( -1.212 3.575 2.002) 4.273 4.304 ( 2.099 5.348 1.289) 5.888 4.423 ( -7.867 4.354 -4.228) 9.936 5.022 ( -2.071 0.610 -6.921) 7.250 5.644 ( -8.451 1.335 7.168) 11.162 6.038 ( 1.653 2.027 -2.953) 3.945 6.265 ( -3.255 0.983 3.807) 5.104 6.460 ( 0.229 1.389 3.871) 4.119 6.639 ( 0.808 -1.549 8.616) 8.791 6.870 ( 6.932 -0.796 -2.561) 7.433 6.994 ( 3.148 4.218 -4.960) 7.232 7.495 ( -5.547 8.388 -6.795) 12.137 7.613 ( 2.629 4.620 -0.495) 5.338 7.795 ( -5.146 2.287 -5.660) 7.985 8.068 ( -1.945 6.857 -10.687) 12.846 8.113 ( -3.690 1.963 1.700) 4.512 8.318 ( 7.327 5.663 -2.750) 9.660 8.528 ( 1.420 4.969 -7.758) 9.322 9.130 ( 0.019 -3.026 5.977) 6.700 9.492 ( 5.999 2.514 6.398) 9.124 9.658 ( 1.474 0.090 -3.977) 4.242 9.959 ( 2.274 -2.526 -9.105) 9.718 10.063 ( 2.124 -1.004 7.382) 7.747 10.502 ( 2.202 -3.659 3.015) 5.228 10.671 ( 6.007 -8.047 2.471) 10.342 10.834 ( -1.511 1.345 -7.911) 8.165 11.000 ( 4.492 -6.613 1.577) 8.149 11.265 ( 0.292 -7.604 -0.575) 7.631 11.981 ( 3.026 2.149 8.821) 9.570 12.161 ( -2.689 -3.022 -5.144) 6.543 12.646 ( -1.358 -7.437 4.293) 8.694 13.170 ( 3.913 1.499 -6.922) 8.091 13.689 ( -1.921 6.468 9.821) 11.916 13.952 ( -5.599 4.377 4.093) 8.201 14.346 ( -3.494 -3.755 -1.706) 5.405 15.131 ( 10.119 3.300 4.450) 11.537 15.315 ( -1.684 -3.868 -8.688) 9.658 15.485 ( 0.563 -2.959 -5.532) 6.299 16.550 ( -6.909 -3.319 11.514) 13.832 16.761 ( -3.177 -1.360 1.501) 3.768 16.939 ( 7.491 2.609 8.851) 11.886 17.515 ( -6.734 -3.793 -8.386) 11.405 18.788 ( 6.110 9.439 -3.742) 11.850 18.931 ( 0.271 2.727 -7.250) 7.751 ======================= Grid point 306 (158/260) ======================= q-point: (-0.30 0.25 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 400 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.608 ( -17.786 -5.188 4.104) 18.976 2.050 ( -7.867 3.980 15.781) 18.077 2.434 ( 2.844 -13.444 2.906) 14.046 2.732 ( -0.967 -6.489 0.415) 6.574 3.997 ( -2.055 3.360 -0.395) 3.958 4.301 ( -3.366 6.399 4.545) 8.540 4.396 ( 4.896 5.601 2.863) 7.971 4.936 ( -2.634 2.577 -5.474) 6.599 5.526 ( -7.072 3.978 5.363) 9.726 6.039 ( 0.319 -0.245 -3.659) 3.681 6.223 ( -3.320 0.877 5.469) 6.457 6.460 ( -2.845 2.787 4.061) 5.688 6.686 ( -0.739 -1.018 6.427) 6.549 6.992 ( 6.037 -2.054 -4.989) 8.096 7.007 ( 1.398 0.721 -3.599) 3.928 7.346 ( -5.027 5.898 -3.673) 8.576 7.649 ( -2.862 5.013 -4.353) 7.230 7.724 ( 5.443 2.081 -0.900) 5.896 7.951 ( -3.744 5.373 -4.859) 8.155 8.127 ( 3.714 5.935 -0.849) 7.052 8.435 ( 4.716 4.532 -0.852) 6.596 8.566 ( 7.216 8.230 -6.462) 12.711 9.160 ( -0.583 -2.656 6.241) 6.808 9.512 ( -0.076 -1.030 -2.791) 2.976 9.819 ( 10.524 1.543 0.206) 10.638 9.939 ( 2.653 -1.242 -11.815) 12.173 10.179 ( 3.540 -3.505 9.201) 10.463 10.573 ( 4.451 -1.158 1.181) 4.748 10.766 ( -1.174 0.781 -4.433) 4.651 10.804 ( 6.654 -4.942 -0.361) 8.297 11.106 ( 5.411 -12.001 -0.097) 13.165 11.316 ( 4.463 -5.250 3.799) 7.868 12.072 ( 1.661 -1.838 3.480) 4.272 12.133 ( 1.684 -1.273 1.655) 2.682 12.588 ( -6.692 -8.038 2.278) 10.704 13.169 ( 1.509 5.033 -10.708) 11.928 13.611 ( -10.069 6.960 5.891) 13.585 13.924 ( -1.504 4.913 3.666) 6.312 14.232 ( -5.181 -2.968 -5.626) 8.204 15.128 ( -9.297 -8.121 -3.174) 12.746 15.358 ( 8.395 4.239 0.677) 9.429 15.501 ( 3.669 -0.469 -5.145) 6.337 16.348 ( -15.291 -9.855 5.460) 18.993 16.857 ( 4.423 1.145 3.020) 5.477 17.113 ( 3.900 3.299 7.134) 8.775 17.406 ( 1.595 -5.667 2.637) 6.451 18.756 ( -1.469 1.810 -7.198) 7.566 19.051 ( 10.600 12.221 -2.510) 16.371 ======================= Grid point 307 (159/260) ======================= q-point: (-0.20 0.25 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 400 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.364 ( -10.709 3.308 11.458) 16.029 2.025 ( -6.844 6.850 19.242) 21.541 2.509 ( 2.026 -10.610 6.301) 12.505 2.753 ( 1.205 -7.597 5.150) 9.257 3.960 ( -1.378 3.999 0.617) 4.275 4.336 ( 2.398 7.878 9.502) 12.574 4.527 ( 5.405 5.347 5.773) 9.547 4.861 ( -1.846 5.485 -4.112) 7.099 5.464 ( -2.073 2.285 4.199) 5.211 6.003 ( -0.915 -1.863 -5.637) 6.007 6.204 ( -2.623 1.307 6.242) 6.896 6.415 ( -3.904 2.829 3.651) 6.048 6.704 ( -0.998 -1.679 5.675) 6.002 6.958 ( -0.464 -5.300 -7.007) 8.798 7.054 ( 0.527 -0.640 -3.998) 4.083 7.262 ( -1.933 -1.893 -1.547) 3.117 7.560 ( -2.888 8.986 -3.275) 9.991 7.856 ( 2.983 3.319 -3.837) 5.885 7.913 ( 5.526 6.635 4.082) 9.551 8.228 ( 6.790 9.805 -0.484) 11.937 8.511 ( 4.719 1.779 -1.106) 5.163 8.678 ( 6.571 10.521 -3.937) 13.014 9.190 ( -0.430 -2.528 6.372) 6.868 9.523 ( 3.818 -3.756 -4.989) 7.319 9.887 ( 1.586 -0.828 -11.835) 11.969 9.989 ( 5.334 1.174 -3.376) 6.421 10.284 ( 2.319 -6.866 5.426) 9.053 10.693 ( 0.978 0.981 -1.443) 2.000 10.714 ( 4.316 0.986 -0.395) 4.445 10.955 ( 9.667 -2.903 -1.930) 10.276 11.208 ( 5.688 -8.275 0.373) 10.048 11.466 ( 6.324 -5.717 7.281) 11.211 12.101 ( 1.859 -1.135 -2.983) 3.693 12.220 ( 2.476 -5.398 8.435) 10.316 12.433 ( -9.417 -5.272 0.419) 10.800 13.077 ( -3.606 5.411 -14.065) 15.495 13.434 ( -10.130 6.064 2.406) 12.049 13.869 ( -5.795 6.507 1.721) 8.882 14.115 ( -2.632 -2.961 -6.991) 8.036 14.914 ( -9.725 -10.071 -4.871) 14.823 15.487 ( 3.082 4.040 3.655) 6.260 15.554 ( 4.066 0.584 -1.919) 4.534 16.080 ( -14.841 -11.679 3.168) 19.149 16.771 ( -9.095 2.690 -10.023) 13.799 17.285 ( 9.093 2.010 11.326) 14.663 17.645 ( 13.148 -7.736 17.151) 22.954 18.709 ( 0.862 1.872 -5.456) 5.833 19.222 ( 8.569 12.336 -4.836) 15.780 ======================= Grid point 308 (160/260) ======================= q-point: (-0.10 0.25 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 400 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.381 ( 3.827 12.368 14.542) 19.470 2.001 ( -7.589 11.837 17.115) 22.150 2.602 ( 2.081 -6.520 11.571) 13.443 2.824 ( 1.784 -6.773 7.232) 10.068 3.950 ( -0.939 4.594 2.171) 5.167 4.508 ( 8.173 7.730 11.972) 16.429 4.664 ( 4.374 4.490 7.815) 10.018 4.823 ( 0.281 7.636 -2.894) 8.171 5.497 ( 2.831 -2.296 2.874) 4.642 5.943 ( -0.850 -3.521 -7.414) 8.252 6.196 ( -2.229 2.356 6.438) 7.209 6.363 ( -3.594 1.020 2.894) 4.726 6.717 ( -1.933 -1.382 6.394) 6.821 6.914 ( 0.382 -8.542 -7.886) 11.632 6.979 ( -4.652 -1.039 -2.239) 5.266 7.219 ( -2.603 -6.836 -2.149) 7.624 7.535 ( 3.172 11.593 -2.798) 12.341 7.852 ( 0.627 9.851 -1.588) 9.998 8.111 ( 8.616 0.011 5.723) 10.344 8.358 ( 6.221 14.908 0.113) 16.155 8.624 ( 7.865 0.170 -0.951) 7.924 8.761 ( 4.482 10.389 -2.473) 11.581 9.206 ( -2.196 -1.819 5.464) 6.163 9.590 ( 6.353 -6.634 -6.130) 11.043 9.832 ( 0.982 -0.552 -13.059) 13.108 10.010 ( -0.839 -0.023 -2.339) 2.485 10.321 ( -0.464 -7.624 0.075) 7.639 10.601 ( -5.434 1.932 -1.981) 6.098 10.890 ( 8.927 0.979 0.595) 9.000 11.138 ( 9.757 -2.098 -2.836) 10.375 11.343 ( 7.490 -3.262 2.340) 8.498 11.618 ( 5.172 -5.212 4.965) 8.864 12.086 ( -2.717 -3.245 -2.180) 4.761 12.208 ( -9.831 -4.157 6.245) 12.367 12.360 ( 3.914 -2.169 -1.057) 4.598 12.854 ( -9.531 5.012 -14.810) 18.311 13.273 ( -6.953 5.569 1.099) 8.976 13.802 ( -1.167 6.551 3.841) 7.683 14.020 ( -2.977 -3.906 -7.383) 8.867 14.711 ( -7.507 -11.147 -5.668) 14.585 15.453 ( -11.080 -2.011 6.250) 12.879 15.661 ( 6.137 0.021 4.232) 7.455 15.863 ( -5.494 -4.728 -3.552) 8.072 16.510 ( -10.304 4.690 -8.746) 14.306 17.542 ( 8.980 3.531 12.509) 15.798 18.024 ( 12.228 -11.252 19.189) 25.384 18.725 ( 4.202 3.066 -4.919) 7.159 19.296 ( 3.158 8.510 -8.221) 12.246 ======================= Grid point 309 (161/260) ======================= q-point: ( 0.00 0.38 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 400 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.957 ( 10.899 16.527 4.991) 20.417 2.233 ( -1.030 9.951 8.076) 12.857 2.637 ( 6.504 -4.900 12.195) 14.664 2.787 ( 2.093 -6.828 11.588) 13.612 4.065 ( -2.168 6.041 6.153) 8.892 4.777 ( -0.232 1.823 6.926) 7.166 4.921 ( 8.470 4.068 8.633) 12.760 4.978 ( 1.497 5.371 2.788) 6.234 5.470 ( 3.517 -4.763 0.261) 5.927 5.778 ( -3.697 -4.065 -7.315) 9.149 6.234 ( -1.278 1.244 -2.311) 2.919 6.312 ( -6.102 0.966 10.021) 11.772 6.540 ( 0.657 -13.809 -6.995) 15.494 6.761 ( -4.961 4.305 6.621) 9.326 6.975 ( -1.549 -0.511 0.482) 1.701 7.064 ( 0.789 -0.871 -1.756) 2.113 7.789 ( 5.581 5.680 -3.132) 8.557 8.049 ( 3.471 5.629 -2.385) 7.030 8.273 ( 5.505 1.185 7.080) 9.047 8.715 ( 2.775 7.105 -0.965) 7.688 8.836 ( 7.936 7.236 0.548) 10.754 9.017 ( 4.074 8.758 -5.113) 10.929 9.149 ( -2.072 -1.802 3.755) 4.652 9.509 ( 5.632 -8.142 -11.750) 15.365 9.752 ( 0.591 -1.172 -11.378) 11.454 9.802 ( -8.139 -7.991 -6.068) 12.919 10.240 ( -1.268 -0.735 7.319) 7.464 10.547 ( -4.061 2.823 0.275) 4.954 10.992 ( -1.745 0.008 0.470) 1.807 11.235 ( 3.064 1.146 -1.156) 3.469 11.501 ( 13.473 -3.616 0.305) 13.953 11.644 ( 4.755 -1.861 5.107) 7.222 11.818 ( -11.691 -7.979 0.617) 14.168 12.082 ( -5.394 2.020 2.276) 6.193 12.423 ( 3.730 -1.386 1.265) 4.175 12.681 ( -9.427 4.540 -12.819) 16.547 13.354 ( -0.106 9.252 -4.493) 10.286 13.798 ( -2.692 -5.924 -8.857) 10.990 13.947 ( 4.756 1.057 3.109) 5.780 14.368 ( -2.418 -8.260 -4.824) 9.867 15.078 ( -19.882 -3.540 14.627) 24.935 15.830 ( 7.098 1.044 3.355) 7.920 15.864 ( 5.032 0.374 -3.108) 5.926 16.372 ( -6.884 2.851 -7.288) 10.423 17.860 ( 5.090 5.145 14.262) 15.993 18.114 ( 4.739 -7.285 16.336) 18.504 18.894 ( 8.033 4.367 -4.388) 10.142 19.265 ( -5.995 -0.498 -12.605) 13.967 ======================= Grid point 310 (162/260) ======================= q-point: ( 0.10 0.38 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 400 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.104 ( 1.422 14.692 2.215) 14.926 2.313 ( 5.218 8.590 5.298) 11.361 2.811 ( 4.460 -2.974 7.935) 9.576 2.882 ( 1.184 -4.840 8.525) 9.874 4.058 ( -2.798 5.382 7.547) 9.682 4.759 ( -4.676 1.192 4.182) 6.386 5.006 ( 1.014 4.993 0.866) 5.168 5.108 ( 3.432 0.106 7.272) 8.042 5.591 ( 10.013 -4.025 -2.900) 11.174 5.705 ( 0.656 -5.142 -4.143) 6.636 6.124 ( -9.157 -1.508 2.032) 9.500 6.294 ( -1.981 -0.887 5.448) 5.865 6.518 ( 0.488 -9.669 -1.824) 9.852 6.739 ( -0.297 3.967 2.404) 4.648 6.952 ( -0.996 -0.291 0.461) 1.135 7.113 ( 4.508 3.572 -1.408) 5.921 7.880 ( 5.799 3.891 -4.072) 8.084 8.096 ( 2.261 7.301 0.408) 7.654 8.411 ( 4.539 2.562 6.154) 8.065 8.724 ( -0.862 9.156 -3.985) 10.023 8.916 ( 1.011 0.744 -2.959) 3.214 9.044 ( 2.089 4.671 -5.375) 7.421 9.159 ( -0.054 5.306 3.467) 6.338 9.481 ( -0.706 -8.415 -12.339) 14.952 9.553 ( -10.282 -7.909 -6.665) 14.584 9.800 ( 7.985 -4.638 -5.989) 11.006 10.259 ( -2.033 -0.273 8.101) 8.357 10.490 ( -2.228 5.186 0.954) 5.725 10.874 ( -8.790 -1.335 -1.150) 8.965 11.174 ( -8.597 3.367 0.720) 9.261 11.502 ( -13.841 -6.227 -0.227) 15.179 11.788 ( 9.466 1.990 3.537) 10.299 11.864 ( 13.350 -8.697 1.248) 15.981 11.971 ( -6.004 2.134 0.272) 6.378 12.323 ( -11.291 5.894 -3.222) 13.138 12.578 ( 2.093 -5.096 -4.035) 6.829 13.358 ( 1.872 4.860 -2.526) 5.788 13.742 ( 3.276 -1.348 -7.123) 7.956 14.095 ( 7.280 -2.384 1.387) 7.785 14.353 ( 4.071 -6.479 -5.692) 9.537 14.854 ( -12.565 -1.180 17.195) 21.329 15.896 ( 2.762 0.843 -3.679) 4.677 16.035 ( 8.123 0.803 5.378) 9.775 16.240 ( -2.037 2.775 -5.311) 6.329 17.982 ( -1.746 3.883 13.025) 13.703 18.213 ( -3.069 -4.853 11.274) 12.652 18.867 ( -7.136 6.805 -12.554) 15.964 19.199 ( 6.874 -4.329 -5.404) 9.757 ======================= Grid point 311 (163/260) ======================= q-point: ( 0.20 0.38 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 400 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.102 ( -0.800 12.851 -1.021) 12.916 2.423 ( 2.055 3.554 3.152) 5.175 2.878 ( -1.481 -6.134 4.507) 7.755 2.954 ( 2.532 -0.009 2.627) 3.648 4.055 ( -2.225 3.897 7.319) 8.585 4.665 ( -6.597 1.466 1.247) 6.872 5.022 ( 1.256 2.717 -1.012) 3.160 5.151 ( -1.299 -2.389 2.250) 3.529 5.741 ( 4.212 -1.729 -1.857) 4.917 5.778 ( 8.067 -4.672 -4.869) 10.518 5.973 ( -6.994 -0.055 10.229) 12.392 6.279 ( -0.858 -4.671 -0.188) 4.753 6.551 ( 2.607 -1.981 1.555) 3.624 6.747 ( 0.840 -2.909 -2.383) 3.853 6.953 ( 0.660 4.550 0.731) 4.655 7.200 ( 5.107 6.041 -1.004) 7.974 7.950 ( 4.244 2.316 -4.713) 6.752 8.144 ( 1.618 8.264 2.637) 8.824 8.512 ( 1.461 4.961 3.717) 6.369 8.643 ( -3.139 8.986 -4.254) 10.426 8.845 ( -4.859 -1.113 -6.748) 8.390 9.047 ( 1.209 0.197 -5.742) 5.871 9.099 ( -6.963 4.390 -4.923) 9.591 9.256 ( -8.996 -8.553 -7.673) 14.593 9.526 ( 4.976 -5.644 -0.169) 7.527 9.925 ( 7.365 -2.980 -5.547) 9.690 10.249 ( -5.092 -0.677 9.410) 10.721 10.451 ( -3.265 5.933 0.971) 6.841 10.688 ( -9.031 -2.020 -0.989) 9.307 10.987 ( -8.615 3.347 0.294) 9.247 11.251 ( -10.950 -6.994 -0.393) 12.999 11.756 ( -10.098 3.154 -1.656) 10.708 11.998 ( 0.244 5.396 1.852) 5.710 12.092 ( 2.425 -2.440 4.584) 5.732 12.225 ( 12.491 -4.491 0.497) 13.283 12.563 ( -1.872 -7.299 -2.951) 8.092 13.376 ( 1.055 0.238 0.214) 1.102 13.842 ( 9.749 1.425 -4.258) 10.733 14.197 ( 1.837 -2.898 2.541) 4.269 14.434 ( 7.742 -4.099 -6.343) 10.815 14.837 ( 0.132 1.752 15.376) 15.476 15.879 ( -2.461 -0.829 -3.717) 4.535 16.197 ( 6.344 4.282 1.671) 7.834 16.271 ( 6.093 0.161 2.174) 6.471 17.912 ( -13.240 0.812 7.853) 15.416 18.159 ( -6.911 -1.962 5.471) 9.030 18.666 ( -3.025 4.507 -11.380) 12.608 19.298 ( 4.654 -1.551 -4.800) 6.864 ======================= Grid point 312 (164/260) ======================= q-point: ( 0.30 0.38 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 400 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.076 ( -0.330 7.751 -4.037) 8.746 2.418 ( -3.582 -0.549 1.069) 3.778 2.830 ( -5.090 -5.245 0.898) 7.364 2.985 ( 0.039 0.404 -1.670) 1.719 4.064 ( -1.193 2.894 6.175) 6.923 4.534 ( -6.629 1.774 -0.914) 6.923 5.040 ( 0.251 -2.017 -2.815) 3.472 5.111 ( -1.348 2.054 -3.386) 4.183 5.740 ( -7.074 -6.789 8.029) 12.673 5.828 ( 5.245 -0.324 -0.641) 5.294 6.050 ( 5.662 3.704 -0.457) 6.782 6.298 ( 2.834 -5.486 3.441) 7.069 6.585 ( -0.919 4.152 1.058) 4.382 6.796 ( 7.436 -7.233 -3.760) 11.034 6.951 ( -1.494 5.462 -1.457) 5.847 7.295 ( 5.541 6.175 -1.949) 8.523 7.988 ( 2.548 1.872 -3.759) 4.912 8.180 ( 0.145 9.161 2.193) 9.421 8.431 ( -6.816 6.564 -4.456) 10.459 8.629 ( -3.840 6.268 -4.305) 8.518 8.684 ( -1.863 1.691 -3.836) 4.588 8.844 ( -11.869 -2.062 -9.450) 15.311 9.005 ( -1.833 -4.119 -5.859) 7.393 9.156 ( -0.500 -1.322 0.817) 1.632 9.648 ( 6.421 -4.727 1.570) 8.127 9.975 ( 0.722 -0.686 -5.577) 5.665 10.162 ( -9.711 -3.860 9.665) 14.234 10.379 ( -3.628 5.331 -0.178) 6.451 10.537 ( -6.017 -1.572 0.166) 6.222 10.899 ( -0.661 2.121 -1.428) 2.641 11.094 ( -4.595 -6.643 -1.406) 8.199 11.521 ( -12.611 1.704 -1.007) 12.765 11.912 ( -4.149 6.636 1.815) 8.034 12.252 ( 6.001 -1.983 9.161) 11.130 12.456 ( -3.760 -6.137 -1.032) 7.271 12.545 ( 14.371 -7.498 -2.289) 16.370 13.421 ( 2.554 -0.275 4.064) 4.808 14.020 ( 9.193 -0.499 0.275) 9.210 14.216 ( -2.366 -1.455 7.127) 7.649 14.572 ( 11.148 -0.197 -7.486) 13.430 14.995 ( 6.863 2.184 8.608) 11.223 15.775 ( -5.103 -1.626 -4.647) 7.090 16.339 ( 7.123 2.704 1.771) 7.822 16.419 ( 5.494 1.228 6.757) 8.794 17.605 ( -19.105 -1.576 0.140) 19.171 18.036 ( -7.865 -0.450 0.945) 7.934 18.619 ( 2.845 4.471 -5.936) 7.957 19.299 ( -0.649 -0.333 -6.938) 6.976 ======================= Grid point 313 (165/260) ======================= q-point: ( 0.40 0.38 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 400 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.030 ( -1.887 1.067 -4.794) 5.261 2.323 ( -5.558 -2.914 -0.949) 6.347 2.693 ( -8.967 -1.987 -1.484) 9.304 2.928 ( -3.625 -1.505 -5.182) 6.501 4.085 ( -0.412 3.048 5.049) 5.912 4.417 ( -4.268 1.915 -1.545) 4.927 4.924 ( -7.443 0.528 -7.413) 10.518 5.103 ( 1.388 0.820 -4.892) 5.151 5.685 ( -4.972 -4.899 11.911) 13.806 5.943 ( 5.914 -1.073 0.941) 6.083 6.130 ( 4.825 1.280 -1.311) 5.161 6.414 ( 4.157 -1.158 7.721) 8.845 6.562 ( -1.084 3.543 0.796) 3.789 6.858 ( -4.721 1.927 -3.059) 5.946 6.955 ( 9.050 -1.018 -6.054) 10.936 7.387 ( 6.104 3.270 -4.114) 8.054 8.006 ( 1.312 2.157 -3.221) 4.093 8.157 ( -4.317 12.510 0.587) 13.247 8.269 ( -4.974 0.601 -8.737) 10.071 8.431 ( -7.919 3.695 -4.170) 9.683 8.557 ( -10.521 1.994 -8.731) 13.817 8.718 ( 1.204 3.124 -4.678) 5.752 8.955 ( -0.014 -4.427 0.435) 4.448 9.202 ( 2.987 1.339 5.362) 6.282 9.775 ( 6.155 -5.056 -0.640) 7.991 9.893 ( -5.302 0.384 -3.195) 6.202 10.042 ( -7.129 -4.006 6.631) 10.528 10.330 ( -0.978 1.615 -0.309) 1.913 10.454 ( -2.980 -2.880 0.660) 4.197 10.905 ( 2.572 1.749 -5.399) 6.231 11.036 ( -1.038 -4.579 -2.674) 5.403 11.288 ( -10.625 -0.459 0.374) 10.641 11.891 ( -0.806 4.638 5.710) 7.401 12.318 ( -6.236 -6.784 -4.755) 10.369 12.404 ( 3.429 -2.075 9.341) 10.165 12.824 ( 13.847 -4.726 -1.673) 14.727 13.529 ( 4.495 1.584 8.839) 10.042 14.177 ( 4.246 -2.441 5.908) 7.674 14.200 ( -3.472 -0.346 6.747) 7.596 14.765 ( 13.459 3.085 -7.409) 15.670 15.170 ( 7.369 1.351 1.943) 7.740 15.634 ( -6.193 -2.976 -5.215) 8.626 16.470 ( 4.354 2.414 3.991) 6.380 16.570 ( 5.164 1.012 9.628) 10.972 17.237 ( -17.274 -2.290 -3.211) 17.718 17.872 ( -8.584 -0.189 -2.466) 8.934 18.679 ( 6.214 4.967 -3.605) 8.734 19.200 ( -4.059 -0.042 -9.021) 9.893 ======================= Grid point 314 (166/260) ======================= q-point: (-0.50 0.38 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 400 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.934 ( -5.863 -4.520 -2.858) 7.935 2.215 ( -4.194 -4.970 -2.210) 6.869 2.479 ( -11.648 2.734 -0.989) 12.005 2.796 ( -5.704 -4.849 -6.816) 10.124 4.105 ( -0.325 3.798 3.185) 4.967 4.362 ( -0.643 2.082 -0.509) 2.238 4.710 ( -9.126 3.075 -7.429) 12.163 5.074 ( -1.217 -1.106 -4.927) 5.194 5.680 ( -3.603 -2.296 11.286) 12.067 6.028 ( 2.606 -1.083 -0.733) 2.915 6.257 ( 6.892 2.030 3.203) 7.867 6.485 ( -3.087 1.781 6.967) 7.825 6.580 ( 1.226 1.392 3.617) 4.066 6.767 ( 0.704 -0.808 -3.601) 3.757 7.061 ( 5.474 3.613 -6.830) 9.469 7.482 ( 6.783 -0.115 -5.609) 8.802 7.943 ( -5.707 4.996 -10.146) 12.668 7.994 ( -9.270 5.205 -1.156) 10.694 8.202 ( 0.877 2.129 -3.595) 4.269 8.297 ( -7.160 1.532 -3.569) 8.145 8.362 ( -1.033 5.366 -3.478) 6.478 8.676 ( -0.490 4.819 -7.250) 8.719 9.010 ( 2.751 -2.850 4.335) 5.872 9.340 ( 6.927 2.026 8.344) 11.032 9.753 ( -5.921 0.266 -4.924) 7.706 9.871 ( 4.628 -4.140 -3.614) 7.185 9.994 ( -1.670 -2.221 6.033) 6.642 10.345 ( 2.673 -2.176 0.576) 3.494 10.437 ( 0.686 -4.868 1.466) 5.130 10.899 ( 2.299 -0.253 -13.200) 13.401 10.996 ( -2.781 1.800 0.926) 3.439 11.144 ( -4.237 -5.253 0.938) 6.814 11.933 ( 0.229 1.274 7.817) 7.923 12.182 ( -4.607 -4.280 -3.701) 7.296 12.497 ( 0.500 -3.744 7.754) 8.625 13.043 ( 10.853 -2.135 -4.529) 11.953 13.691 ( 5.086 4.387 11.869) 13.637 14.132 ( -8.147 2.220 9.760) 12.906 14.272 ( 2.124 -4.449 1.479) 5.147 14.988 ( 13.282 4.350 -4.499) 14.682 15.289 ( 5.156 0.403 -4.017) 6.548 15.477 ( -6.212 -5.017 -5.444) 9.664 16.562 ( 1.044 3.744 8.385) 9.242 16.723 ( 1.680 -2.418 12.768) 13.103 16.930 ( -9.443 -0.858 -5.320) 10.873 17.680 ( -8.895 -0.395 -4.915) 10.170 18.810 ( 9.279 5.879 -2.795) 11.335 19.050 ( -4.730 -0.284 -9.855) 10.935 ======================= Grid point 315 (167/260) ======================= q-point: (-0.40 0.38 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 400 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.769 ( -9.851 -4.718 -0.478) 10.934 2.148 ( -1.298 -8.884 -1.351) 9.079 2.272 ( -9.930 6.746 4.337) 12.764 2.651 ( -4.938 -8.002 -4.862) 10.585 4.105 ( -0.888 3.953 0.024) 4.051 4.387 ( 2.723 2.637 1.663) 4.140 4.516 ( -6.875 4.317 -2.558) 8.512 5.006 ( -2.588 -1.738 -3.705) 4.842 5.665 ( -4.873 0.962 8.934) 10.222 6.048 ( 0.454 -0.548 -1.507) 1.667 6.320 ( -4.686 3.737 4.078) 7.249 6.475 ( 1.679 -0.794 3.142) 3.650 6.632 ( 1.103 0.930 7.720) 7.853 6.853 ( 7.249 -0.889 -1.862) 7.537 7.075 ( 0.731 3.917 -7.845) 8.799 7.564 ( 4.172 0.401 -6.946) 8.112 7.731 ( -8.885 5.067 -0.833) 10.262 7.832 ( -3.859 1.351 -9.266) 10.128 8.125 ( -8.530 1.408 3.625) 9.374 8.198 ( 1.872 3.215 -7.428) 8.307 8.455 ( 8.786 7.223 -0.839) 11.404 8.643 ( 2.202 5.586 -6.980) 9.207 9.080 ( 1.342 -1.781 4.773) 5.269 9.533 ( 3.958 1.701 4.919) 6.539 9.639 ( 1.051 -2.064 -2.940) 3.743 9.915 ( 3.934 -1.567 -8.360) 9.371 10.041 ( 1.982 -1.122 6.485) 6.873 10.437 ( 5.365 -2.713 1.805) 6.277 10.500 ( 5.219 -7.160 1.505) 8.987 10.842 ( 1.145 -0.617 -13.710) 13.771 10.949 ( -2.537 0.634 1.981) 3.281 11.134 ( 2.068 -5.127 1.476) 5.722 11.983 ( -0.006 -1.341 7.518) 7.636 12.107 ( -1.572 -2.102 -1.390) 2.970 12.515 ( -2.929 -4.975 5.366) 7.882 13.186 ( 7.675 0.370 -7.496) 10.735 13.835 ( 0.208 6.955 11.900) 13.786 14.019 ( -7.075 2.327 5.949) 9.532 14.274 ( -1.982 -3.365 -1.467) 4.171 15.175 ( -1.201 0.548 3.006) 3.284 15.271 ( 5.452 0.085 -11.206) 12.463 15.418 ( 3.682 -3.334 -4.732) 6.861 16.488 ( -16.498 -2.426 9.532) 19.208 16.750 ( 3.583 -0.075 4.472) 5.731 16.983 ( 7.915 1.616 7.824) 11.246 17.472 ( -8.841 -0.955 -6.103) 10.786 18.882 ( -2.823 1.472 -8.974) 9.522 19.025 ( 10.990 4.953 -2.881) 12.394 ======================= Grid point 316 (168/260) ======================= q-point: (-0.30 0.38 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 400 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.587 ( -8.487 2.847 3.534) 9.625 2.152 ( 0.424 -8.711 2.137) 8.980 2.177 ( -3.772 3.445 10.877) 12.016 2.565 ( -2.160 -9.694 0.310) 9.936 4.074 ( -1.178 3.793 -2.069) 4.478 4.432 ( -1.882 5.795 4.726) 7.711 4.485 ( 4.813 2.998 3.907) 6.886 4.944 ( -1.523 -1.283 -2.497) 3.194 5.600 ( -6.773 3.174 6.713) 10.051 6.032 ( -0.761 -0.279 -2.416) 2.548 6.248 ( -4.681 1.182 6.931) 8.447 6.502 ( -1.105 0.895 1.199) 1.860 6.699 ( 0.125 2.188 6.087) 6.469 6.914 ( -0.377 -3.993 -8.918) 9.779 7.045 ( 2.823 1.604 -2.916) 4.364 7.429 ( -10.535 2.966 -3.585) 11.516 7.740 ( 5.826 0.576 -2.434) 6.341 7.767 ( 1.551 4.679 -3.125) 5.836 8.005 ( -5.983 1.171 4.888) 7.814 8.232 ( 6.489 2.976 -6.032) 9.346 8.579 ( 3.765 9.311 -2.415) 10.330 8.719 ( 9.809 5.572 -5.171) 12.410 9.123 ( 0.076 -0.863 5.004) 5.079 9.486 ( -1.864 -1.599 -5.268) 5.812 9.799 ( 8.156 -2.971 1.914) 8.889 9.928 ( 4.385 0.094 -12.118) 12.888 10.124 ( 1.392 -1.828 7.787) 8.119 10.560 ( 7.137 -0.126 0.912) 7.196 10.664 ( 9.790 -7.200 2.662) 12.441 10.787 ( -0.037 0.489 -7.742) 7.758 10.942 ( 2.084 -4.193 -1.153) 4.823 11.231 ( 5.513 -3.096 5.205) 8.189 12.034 ( 1.368 -1.682 5.116) 5.557 12.091 ( -0.339 -2.370 1.106) 2.637 12.455 ( -5.603 -4.871 2.586) 7.862 13.236 ( 3.010 1.968 -10.446) 11.048 13.760 ( -10.718 6.777 5.275) 13.734 14.013 ( -0.147 3.613 5.698) 6.749 14.182 ( -4.931 -2.104 -5.524) 7.698 14.981 ( -11.757 -5.897 -3.569) 13.629 15.424 ( 6.427 1.909 0.562) 6.728 15.497 ( 8.486 0.412 -5.954) 10.375 16.182 ( -19.661 -6.160 8.230) 22.186 16.877 ( 4.387 0.763 2.719) 5.217 17.183 ( 3.918 3.508 7.394) 9.074 17.321 ( 0.100 -3.324 2.781) 4.335 18.780 ( -1.545 0.749 -7.389) 7.586 19.238 ( 11.916 6.324 -3.855) 14.030 ======================= Grid point 317 (169/260) ======================= q-point: (-0.20 0.38 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 400 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.540 ( 0.668 13.010 8.084) 15.331 2.168 ( -2.212 5.158 12.350) 13.565 2.263 ( 4.549 -11.002 8.000) 14.343 2.576 ( 0.827 -9.840 6.894) 12.043 4.053 ( -0.237 4.508 0.202) 4.519 4.489 ( 3.589 6.623 8.265) 11.183 4.612 ( 4.475 2.850 6.394) 8.308 4.925 ( 0.779 0.948 -1.244) 1.747 5.505 ( -6.305 1.864 5.429) 8.526 5.987 ( -1.931 0.247 -4.340) 4.756 6.231 ( -2.524 0.877 8.619) 9.024 6.458 ( -3.485 1.058 0.306) 3.655 6.671 ( -2.851 -1.561 -6.068) 6.883 6.838 ( -2.153 -4.365 0.178) 4.870 7.081 ( 0.210 1.296 -2.229) 2.587 7.225 ( -7.733 -0.753 -1.912) 8.001 7.734 ( -1.360 6.846 -1.696) 7.182 7.886 ( 7.350 0.523 -2.051) 7.648 7.993 ( 1.528 1.847 6.394) 6.828 8.384 ( 11.455 3.684 -1.671) 12.148 8.620 ( 2.789 9.120 -2.544) 9.870 8.873 ( 8.418 7.829 -5.415) 12.707 9.149 ( -0.462 -1.128 4.811) 4.963 9.446 ( 1.719 -4.245 -7.156) 8.496 9.873 ( 2.080 -0.362 -8.943) 9.189 9.964 ( 4.797 -3.415 -7.604) 9.617 10.183 ( -0.260 -2.746 8.067) 8.525 10.716 ( 0.637 1.162 -2.004) 2.402 10.737 ( 5.686 1.060 1.014) 5.872 10.889 ( 11.481 -3.241 0.355) 11.935 11.039 ( 8.865 -7.153 -0.846) 11.422 11.390 ( 5.871 -2.031 8.515) 10.541 12.065 ( -0.556 -2.299 -1.593) 2.852 12.124 ( 1.402 -3.533 7.048) 8.007 12.351 ( -5.140 -2.765 0.086) 5.837 13.160 ( -3.552 2.837 -12.573) 13.369 13.581 ( -8.715 7.526 -0.384) 11.521 13.983 ( -5.758 3.981 0.159) 7.002 14.055 ( -3.466 -2.509 -4.926) 6.525 14.727 ( -11.646 -7.650 -4.105) 14.526 15.527 ( 4.342 0.133 3.722) 5.721 15.606 ( 1.157 4.573 -1.340) 4.904 15.872 ( -14.362 -8.908 5.640) 17.817 16.813 ( -7.785 1.459 -8.848) 11.875 17.328 ( 9.520 2.053 12.553) 15.888 17.539 ( 10.426 -3.409 14.803) 18.424 18.740 ( 1.599 1.205 -5.258) 5.627 19.399 ( 7.452 5.683 -7.031) 11.716 ======================= Grid point 318 (170/260) ======================= q-point: (-0.10 0.38 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 400 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.701 ( 9.703 18.153 8.016) 22.090 2.206 ( -1.817 7.051 10.964) 13.162 2.432 ( 6.319 -8.603 11.987) 16.052 2.669 ( 2.386 -8.663 11.399) 14.515 4.061 ( -0.556 5.512 3.591) 6.602 4.659 ( 7.290 6.513 9.234) 13.447 4.731 ( 3.676 1.935 8.298) 9.280 4.947 ( 1.403 4.248 0.126) 4.475 5.447 ( -2.303 -2.194 3.658) 4.848 5.899 ( -3.555 -0.716 -6.923) 7.816 6.241 ( -1.817 1.831 6.868) 7.337 6.385 ( -4.414 1.040 1.298) 4.717 6.582 ( -0.310 -10.338 -9.302) 13.911 6.811 ( -3.711 0.097 6.257) 7.275 7.019 ( -3.448 2.092 -1.053) 4.168 7.114 ( -3.945 -3.669 -1.360) 5.557 7.724 ( 2.166 6.602 -1.852) 7.191 7.986 ( 5.209 3.042 -3.837) 7.149 8.117 ( 5.619 1.401 7.549) 9.515 8.620 ( 11.279 2.635 2.304) 11.809 8.666 ( 3.793 11.469 -1.181) 12.137 8.966 ( 5.334 9.245 -6.461) 12.477 9.162 ( -1.304 -2.522 4.203) 5.073 9.461 ( 5.073 -6.558 -9.500) 12.609 9.826 ( 0.378 0.165 -12.483) 12.490 9.948 ( -2.372 -5.503 -6.066) 8.527 10.218 ( -0.946 -2.263 7.173) 7.581 10.634 ( -4.717 1.094 -0.419) 4.860 10.917 ( 7.793 1.548 1.448) 8.076 11.100 ( 10.878 -1.110 -2.872) 11.305 11.249 ( 11.806 -5.810 1.582) 13.253 11.535 ( 3.285 -2.250 8.437) 9.329 11.998 ( -5.981 -4.934 -0.833) 7.798 12.151 ( -3.679 -1.189 4.884) 6.229 12.325 ( 3.594 -1.396 -0.135) 3.858 12.954 ( -8.903 4.243 -13.535) 16.747 13.432 ( -5.030 9.325 -3.986) 11.320 13.878 ( -1.081 -2.228 -6.781) 7.219 13.954 ( -5.663 0.520 0.310) 5.695 14.503 ( -8.375 -8.662 -4.371) 12.816 15.399 ( -20.757 -2.748 11.755) 24.012 15.660 ( 6.546 -0.076 4.706) 8.062 15.814 ( 3.737 -0.818 -4.990) 6.288 16.580 ( -9.202 2.385 -9.036) 13.115 17.621 ( 10.080 4.281 14.642) 18.284 17.847 ( 10.552 -6.857 17.590) 21.628 18.779 ( 5.549 2.090 -4.281) 7.314 19.414 ( -0.437 3.650 -10.661) 11.277 ======================= Grid point 319 (171/260) ======================= q-point: ( 0.00 -0.50 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 250 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.213 ( 7.859 0.000 -2.118) 8.139 2.267 ( 6.686 -0.000 3.533) 7.562 2.626 ( 5.667 -0.000 16.482) 17.429 2.661 ( 1.102 0.000 16.927) 16.963 4.135 ( -2.220 -0.000 6.238) 6.622 4.789 ( -1.619 0.000 8.286) 8.443 4.967 ( 8.121 -0.000 7.215) 10.863 5.036 ( 1.055 0.000 3.749) 3.895 5.420 ( 3.415 0.000 -0.127) 3.418 5.735 ( -5.867 -0.000 -7.267) 9.340 6.298 ( -2.006 0.000 -9.182) 9.399 6.326 ( -4.314 -0.000 13.646) 14.312 6.337 ( -1.379 0.000 -4.457) 4.665 6.820 ( -3.235 0.000 8.038) 8.665 6.945 ( -2.989 -0.000 -0.713) 3.073 7.069 ( 2.685 -0.000 -0.172) 2.690 7.845 ( 4.569 -0.000 -2.177) 5.061 8.097 ( 5.445 -0.000 -3.951) 6.728 8.296 ( 5.528 0.000 7.406) 9.242 8.757 ( 4.299 0.000 0.027) 4.299 9.032 ( -2.097 0.000 -1.811) 2.771 9.036 ( 10.016 -0.000 5.193) 11.282 9.158 ( 0.817 0.000 -5.582) 5.642 9.387 ( 5.881 -0.000 -13.977) 15.164 9.707 ( -9.675 0.000 -5.146) 10.959 9.739 ( -0.242 -0.000 -13.164) 13.167 10.239 ( -1.640 0.000 9.693) 9.831 10.573 ( -2.915 0.000 1.317) 3.199 10.996 ( -2.458 0.000 -0.384) 2.487 11.257 ( 4.848 0.000 -1.550) 5.089 11.449 ( 15.342 0.000 -0.105) 15.342 11.631 ( 4.479 -0.000 9.547) 10.545 11.725 ( -14.282 0.000 -0.927) 14.312 12.108 ( -4.964 0.000 2.151) 5.410 12.400 ( 4.746 0.000 2.582) 5.403 12.734 ( -10.972 -0.000 -13.184) 17.152 13.494 ( -1.598 0.000 -6.435) 6.630 13.692 ( 1.735 -0.000 -12.315) 12.437 13.963 ( 1.597 0.000 3.544) 3.887 14.278 ( -2.122 -0.000 -3.791) 4.344 15.043 ( -19.609 0.000 16.108) 25.377 15.838 ( 8.306 -0.000 5.777) 10.117 15.871 ( 4.056 0.000 -5.183) 6.581 16.401 ( -6.589 0.000 -7.698) 10.133 17.950 ( 3.147 -0.000 14.870) 15.200 18.003 ( 7.040 0.000 16.402) 17.849 18.942 ( 10.724 0.000 -3.353) 11.236 19.258 ( -9.463 -0.000 -14.255) 17.110 ======================= Grid point 321 (172/260) ======================= q-point: ( 0.10 -0.50 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 250 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.287 ( 2.149 0.000 -3.487) 4.096 2.401 ( 4.628 0.000 2.767) 5.392 2.755 ( -0.835 -0.000 12.405) 12.433 2.827 ( 5.769 0.000 9.971) 11.520 4.118 ( -3.660 0.000 7.504) 8.349 4.766 ( -5.276 0.000 6.320) 8.233 5.083 ( 0.398 0.000 1.584) 1.634 5.088 ( 0.840 -0.000 5.706) 5.767 5.551 ( 11.192 0.000 -4.147) 11.935 5.650 ( 1.460 -0.000 -2.913) 3.258 6.128 ( -11.437 0.000 5.166) 12.550 6.280 ( -1.313 -0.000 -6.060) 6.201 6.393 ( 3.353 0.000 3.999) 5.219 6.795 ( -3.627 0.000 4.792) 6.010 6.941 ( 1.979 0.000 1.371) 2.408 7.153 ( 5.557 -0.000 -0.109) 5.558 7.918 ( 4.674 0.000 -3.940) 6.113 8.170 ( 3.941 0.000 -1.242) 4.132 8.441 ( 4.820 0.000 7.063) 8.551 8.810 ( 2.324 0.000 -4.197) 4.797 8.944 ( -5.419 0.000 -2.641) 6.028 9.133 ( 0.233 0.000 -5.461) 5.466 9.227 ( 4.728 -0.000 2.083) 5.167 9.347 ( -0.101 -0.000 -10.676) 10.676 9.447 ( -12.672 0.000 -7.397) 14.673 9.751 ( 8.697 -0.000 -8.449) 12.125 10.258 ( -2.831 0.000 9.962) 10.356 10.548 ( -0.630 0.000 0.994) 1.177 10.860 ( -9.545 0.000 -1.810) 9.715 11.243 ( -4.869 0.000 -0.618) 4.908 11.396 ( -18.558 0.000 1.244) 18.600 11.763 ( 16.934 0.000 -0.386) 16.939 11.821 ( 8.438 0.000 8.598) 12.047 11.989 ( -7.701 0.000 -0.672) 7.730 12.435 ( -12.006 0.000 -9.555) 15.344 12.478 ( 0.930 -0.000 2.849) 2.997 13.418 ( -1.853 0.000 -5.212) 5.532 13.724 ( 8.307 -0.000 -10.023) 13.018 14.071 ( 6.043 0.000 2.244) 6.446 14.279 ( 4.631 0.000 -4.611) 6.535 14.845 ( -11.105 -0.000 18.186) 21.309 15.903 ( 1.799 0.000 -3.782) 4.188 16.043 ( 9.069 0.000 5.841) 10.787 16.269 ( -2.131 0.000 -5.979) 6.348 18.039 ( -4.097 -0.000 14.073) 14.657 18.147 ( -0.682 0.000 11.115) 11.136 18.951 ( -11.104 0.000 -15.636) 19.178 19.141 ( 10.780 -0.000 -2.916) 11.167 ======================= Grid point 323 (173/260) ======================= q-point: ( 0.20 -0.50 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 250 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.266 ( -1.061 0.000 -5.992) 6.085 2.456 ( -0.521 -0.000 1.247) 1.351 2.787 ( -2.177 0.000 7.608) 7.913 2.956 ( 3.174 0.000 3.610) 4.807 4.097 ( -2.952 0.000 6.782) 7.397 4.676 ( -6.841 -0.000 2.935) 7.444 5.051 ( -2.006 0.000 -1.168) 2.321 5.126 ( 0.472 -0.000 2.801) 2.840 5.722 ( 5.248 -0.000 0.277) 5.255 5.722 ( 4.186 0.000 -3.434) 5.415 6.010 ( -1.414 -0.000 11.105) 11.195 6.208 ( -1.654 0.000 -7.414) 7.596 6.507 ( 7.171 0.000 0.903) 7.227 6.736 ( -4.346 -0.000 1.338) 4.547 7.002 ( 2.072 0.000 2.072) 2.931 7.265 ( 5.796 0.000 -0.391) 5.809 7.971 ( 3.582 0.000 -4.667) 5.883 8.234 ( 2.802 0.000 0.703) 2.889 8.558 ( 2.490 -0.000 5.449) 5.991 8.779 ( -2.181 0.000 -7.392) 7.707 8.803 ( -6.720 -0.000 -2.583) 7.199 9.091 ( -4.498 0.000 -4.171) 6.134 9.107 ( -6.479 -0.000 -12.315) 13.916 9.170 ( -6.973 -0.000 -8.594) 11.067 9.447 ( 6.504 0.000 4.733) 8.043 9.892 ( 9.012 -0.000 -6.780) 11.277 10.236 ( -6.836 0.000 10.619) 12.629 10.543 ( -0.467 0.000 -1.228) 1.313 10.651 ( -10.215 -0.000 -1.418) 10.312 11.083 ( -13.540 -0.000 2.733) 13.813 11.107 ( -7.122 0.000 -1.913) 7.375 11.789 ( -11.688 0.000 -0.222) 11.690 12.039 ( 8.060 0.000 8.972) 12.060 12.065 ( 7.941 0.000 -1.993) 8.187 12.216 ( 0.161 -0.000 -3.306) 3.310 12.466 ( -3.303 0.000 1.367) 3.575 13.380 ( 0.402 0.000 -1.587) 1.637 13.858 ( 10.098 -0.000 -6.176) 11.837 14.168 ( 1.387 0.000 4.875) 5.068 14.386 ( 9.808 -0.000 -6.335) 11.676 14.858 ( 1.059 -0.000 15.173) 15.210 15.870 ( -2.945 -0.000 -3.790) 4.800 16.250 ( 8.296 -0.000 6.059) 10.273 16.264 ( 4.178 0.000 -2.553) 4.896 17.924 ( -15.417 -0.000 7.911) 17.328 18.137 ( -5.259 0.000 5.738) 7.783 18.713 ( -3.338 0.000 -11.810) 12.272 19.282 ( 5.530 -0.000 -4.283) 6.994 ======================= Grid point 325 (174/260) ======================= q-point: ( 0.30 -0.50 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 250 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.181 ( -2.962 0.000 -8.426) 8.932 2.403 ( -4.639 -0.000 -0.859) 4.718 2.765 ( -3.997 0.000 3.882) 5.572 2.989 ( -0.655 0.000 -1.639) 1.765 4.095 ( -1.106 0.000 5.326) 5.439 4.550 ( -6.841 -0.000 0.136) 6.842 5.013 ( -1.692 -0.000 -1.757) 2.440 5.140 ( 0.665 0.000 -2.564) 2.648 5.669 ( -6.757 0.000 8.708) 11.022 5.825 ( 5.171 0.000 0.579) 5.203 6.140 ( -0.185 -0.000 -6.736) 6.739 6.195 ( 9.852 0.000 6.611) 11.865 6.658 ( -3.977 0.000 0.699) 4.038 6.688 ( 11.695 -0.000 -1.463) 11.786 7.010 ( -2.262 0.000 -0.575) 2.334 7.360 ( 4.829 0.000 -2.447) 5.414 8.002 ( 2.651 0.000 -3.964) 4.769 8.277 ( 1.286 0.000 -0.560) 1.403 8.532 ( -7.070 -0.000 -0.846) 7.120 8.627 ( -9.221 -0.000 -5.163) 10.568 8.719 ( -1.671 0.000 -2.535) 3.036 8.876 ( -6.552 0.000 -6.753) 9.409 8.929 ( -3.835 -0.000 -11.758) 12.367 9.148 ( 1.710 -0.000 1.694) 2.408 9.590 ( 5.744 0.000 3.254) 6.602 9.968 ( 2.521 0.000 -6.711) 7.169 10.118 ( -11.109 0.000 10.021) 14.961 10.475 ( -7.282 0.000 0.045) 7.282 10.495 ( -2.856 -0.000 -4.171) 5.055 10.946 ( -3.511 -0.000 5.062) 6.161 10.988 ( -2.271 0.000 -5.419) 5.876 11.538 ( -13.388 0.000 -0.787) 13.411 11.992 ( -4.970 0.000 0.655) 5.013 12.228 ( 5.700 0.000 7.920) 9.758 12.380 ( -5.512 0.000 0.328) 5.522 12.471 ( 16.742 0.000 -0.072) 16.742 13.420 ( 3.090 0.000 4.034) 5.081 14.013 ( 8.252 0.000 -2.211) 8.543 14.201 ( -2.295 0.000 10.070) 10.328 14.569 ( 13.486 -0.000 -7.896) 15.628 15.019 ( 6.817 -0.000 8.225) 10.683 15.757 ( -5.689 -0.000 -4.679) 7.366 16.368 ( 6.325 0.000 0.883) 6.386 16.431 ( 6.109 -0.000 7.322) 9.536 17.590 ( -19.767 -0.000 -0.080) 19.767 18.032 ( -7.666 0.000 1.496) 7.811 18.665 ( 2.996 0.000 -5.929) 6.644 19.295 ( -0.359 0.000 -6.732) 6.741 ======================= Grid point 327 (175/260) ======================= q-point: ( 0.40 -0.50 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 250 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.050 ( -5.021 0.000 -8.645) 9.998 2.289 ( -5.650 0.000 -2.423) 6.147 2.676 ( -6.877 0.000 1.445) 7.027 2.906 ( -5.250 0.000 -6.380) 8.262 4.119 ( 0.369 0.000 4.169) 4.186 4.434 ( -4.448 0.000 -0.992) 4.557 4.926 ( -5.591 -0.000 -5.385) 7.763 5.116 ( -0.623 0.000 -4.818) 4.858 5.633 ( -3.992 0.000 12.947) 13.549 5.932 ( 5.155 0.000 1.156) 5.283 6.146 ( 4.330 -0.000 -2.289) 4.898 6.400 ( 6.655 0.000 7.255) 9.845 6.604 ( -2.241 0.000 1.888) 2.930 6.866 ( -1.188 0.000 -2.860) 3.097 6.952 ( 7.136 0.000 -5.549) 9.039 7.422 ( 4.352 0.000 -5.223) 6.799 8.025 ( 1.827 0.000 -4.081) 4.471 8.254 ( -2.639 0.000 -6.912) 7.399 8.369 ( -6.506 0.000 -4.910) 8.151 8.403 ( -11.034 -0.000 1.709) 11.165 8.560 ( -7.732 -0.000 -7.906) 11.059 8.809 ( -1.645 -0.000 -10.317) 10.447 8.877 ( 3.479 0.000 3.920) 5.241 9.222 ( 3.377 -0.000 6.521) 7.343 9.713 ( 5.820 0.000 0.738) 5.866 9.906 ( -4.149 0.000 -6.527) 7.734 9.990 ( -7.045 -0.000 8.660) 11.164 10.380 ( -3.001 -0.000 1.384) 3.305 10.400 ( -3.196 0.000 -5.178) 6.085 10.942 ( 1.825 -0.000 -10.973) 11.124 10.963 ( 0.685 0.000 5.385) 5.429 11.287 ( -11.514 0.000 -1.088) 11.565 11.937 ( -2.841 0.000 5.270) 5.987 12.241 ( -5.105 0.000 -2.462) 5.668 12.385 ( 2.233 0.000 9.302) 9.567 12.777 ( 15.298 0.000 -2.175) 15.451 13.549 ( 5.580 0.000 10.147) 11.580 14.140 ( 5.504 0.000 0.108) 5.505 14.204 ( -4.994 0.000 12.667) 13.616 14.797 ( 15.041 0.000 -8.194) 17.128 15.187 ( 6.930 0.000 1.785) 7.156 15.600 ( -7.253 -0.000 -5.341) 9.007 16.498 ( 5.680 0.000 2.990) 6.419 16.578 ( 3.485 0.000 10.600) 11.159 17.215 ( -17.223 -0.000 -3.495) 17.574 17.870 ( -8.811 0.000 -1.687) 8.971 18.730 ( 6.587 0.000 -3.608) 7.510 19.199 ( -4.129 0.000 -8.956) 9.862 ======================= Grid point 329 (176/260) ======================= q-point: (-0.50 -0.50 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 250 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.886 ( -7.074 0.000 -5.953) 9.245 2.165 ( -5.376 0.000 -2.925) 6.120 2.530 ( -8.670 0.000 1.540) 8.806 2.724 ( -8.057 0.000 -8.838) 11.959 4.149 ( 0.383 0.000 2.317) 2.348 4.379 ( -0.571 0.000 -0.270) 0.632 4.744 ( -8.310 0.000 -6.956) 10.838 5.060 ( -2.499 0.000 -3.557) 4.347 5.657 ( -2.207 -0.000 12.069) 12.269 6.014 ( 2.549 0.000 0.288) 2.565 6.280 ( 8.563 0.000 2.427) 8.900 6.502 ( -3.799 -0.000 7.794) 8.671 6.599 ( -0.229 0.000 4.261) 4.267 6.758 ( 0.378 0.000 -4.748) 4.763 7.102 ( 7.654 -0.000 -6.878) 10.290 7.477 ( 5.610 0.000 -6.716) 8.751 7.975 ( -2.697 0.000 -11.366) 11.682 8.054 ( -12.237 0.000 -4.892) 13.178 8.255 ( -4.166 -0.000 -1.109) 4.311 8.279 ( -3.298 0.000 -1.882) 3.797 8.429 ( -0.770 0.000 -0.634) 0.997 8.737 ( -0.025 -0.000 -8.023) 8.023 8.978 ( 3.816 0.000 4.032) 5.552 9.364 ( 6.306 0.000 9.340) 11.270 9.755 ( -6.658 0.000 -5.884) 8.885 9.823 ( 6.071 0.000 -3.241) 6.882 9.967 ( -0.720 0.000 6.894) 6.932 10.341 ( 0.663 -0.000 -3.598) 3.659 10.372 ( 1.018 0.000 1.809) 2.076 10.897 ( 1.557 0.000 -14.516) 14.599 11.013 ( 1.442 -0.000 3.700) 3.971 11.093 ( -7.914 0.000 -1.013) 7.978 11.937 ( -1.615 0.000 7.533) 7.704 12.138 ( -3.832 -0.000 -1.040) 3.970 12.459 ( -0.366 0.000 7.729) 7.738 13.022 ( 12.479 0.000 -5.176) 13.510 13.743 ( 6.175 0.000 13.355) 14.713 14.155 ( -8.245 0.000 11.879) 14.460 14.220 ( 2.583 0.000 0.022) 2.584 15.037 ( 14.571 0.000 -6.817) 16.087 15.303 ( 5.472 0.000 -2.690) 6.097 15.412 ( -8.648 0.000 -6.111) 10.589 16.622 ( 4.968 -0.000 4.329) 6.589 16.673 ( -5.709 0.000 16.319) 17.289 16.926 ( -6.390 0.000 -5.033) 8.135 17.677 ( -9.341 0.000 -4.032) 10.174 18.871 ( 10.095 0.000 -2.679) 10.444 19.045 ( -5.166 0.000 -10.008) 11.263 ======================= Grid point 331 (177/260) ======================= q-point: (-0.40 -0.50 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 250 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.724 ( -6.635 0.000 -1.407) 6.783 2.054 ( -4.270 0.000 -2.011) 4.720 2.388 ( -7.484 0.000 5.123) 9.070 2.521 ( -7.152 -0.000 -6.582) 9.720 4.151 ( -0.662 0.000 -1.313) 1.470 4.410 ( 3.103 0.000 2.016) 3.700 4.565 ( -6.230 -0.000 -2.438) 6.690 4.983 ( -3.324 0.000 -2.131) 3.948 5.677 ( -3.293 -0.000 9.664) 10.209 6.039 ( 0.370 0.000 -0.597) 0.702 6.375 ( -9.634 -0.000 5.030) 10.868 6.447 ( 6.068 0.000 1.477) 6.245 6.649 ( 1.310 0.000 8.247) 8.350 6.842 ( 6.854 0.000 -2.105) 7.169 7.123 ( -0.378 -0.000 -9.129) 9.137 7.561 ( 6.752 0.000 -6.687) 9.503 7.781 ( -12.989 0.000 -0.754) 13.011 7.846 ( -1.140 0.000 -11.532) 11.588 8.141 ( -8.613 -0.000 5.634) 10.292 8.227 ( 0.931 0.000 -6.318) 6.386 8.538 ( 10.203 0.000 -0.203) 10.205 8.707 ( 1.706 -0.000 -7.036) 7.240 9.062 ( 2.246 0.000 4.134) 4.705 9.566 ( 8.204 -0.000 8.348) 11.705 9.594 ( -5.719 0.000 -6.403) 8.585 9.900 ( 5.451 0.000 -8.103) 9.766 10.028 ( 2.232 0.000 6.144) 6.537 10.398 ( 6.409 -0.000 0.337) 6.418 10.434 ( 4.414 0.000 1.199) 4.574 10.832 ( 1.493 0.000 -14.257) 14.335 10.968 ( -4.693 -0.000 -0.348) 4.706 11.077 ( 3.373 0.000 3.570) 4.911 11.963 ( -0.407 0.000 7.371) 7.383 12.084 ( -1.806 -0.000 0.526) 1.881 12.464 ( -3.295 0.000 5.407) 6.332 13.189 ( 8.860 0.000 -7.872) 11.852 13.915 ( 1.219 -0.000 13.519) 13.574 14.043 ( -8.093 0.000 7.274) 10.881 14.232 ( -0.729 -0.000 -2.508) 2.612 15.172 ( -10.104 0.000 -1.367) 10.196 15.289 ( 13.123 0.000 -9.583) 16.250 15.375 ( 4.296 0.000 -3.498) 5.540 16.463 ( -19.392 -0.000 9.079) 21.412 16.750 ( 5.423 0.000 5.208) 7.519 17.000 ( 8.012 0.000 7.442) 10.935 17.464 ( -9.528 0.000 -5.336) 10.921 18.893 ( -3.985 -0.000 -9.369) 10.181 19.077 ( 12.615 0.000 -2.637) 12.887 ======================= Grid point 333 (178/260) ======================= q-point: (-0.30 -0.50 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 250 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.650 ( -0.663 0.000 3.457) 3.520 1.991 ( -1.480 -0.000 0.904) 1.734 2.327 ( -3.597 0.000 10.570) 11.166 2.391 ( -3.910 -0.000 -0.076) 3.911 4.118 ( -0.686 0.000 -3.257) 3.328 4.497 ( -1.177 0.000 3.911) 4.084 4.513 ( 4.904 -0.000 4.890) 6.925 4.923 ( -1.451 0.000 -0.954) 1.736 5.635 ( -6.526 -0.000 7.011) 9.578 6.029 ( -0.607 0.000 -1.389) 1.516 6.261 ( -5.760 -0.000 7.410) 9.385 6.505 ( 0.053 0.000 -0.838) 0.840 6.736 ( 1.192 0.000 9.754) 9.827 6.864 ( -3.284 -0.000 -12.494) 12.919 7.061 ( 2.034 0.000 -3.907) 4.404 7.461 ( -12.002 0.000 -3.186) 12.417 7.744 ( 7.559 0.000 -0.849) 7.606 7.816 ( 2.514 -0.000 -5.185) 5.763 8.017 ( -7.723 -0.000 7.927) 11.067 8.256 ( 6.580 0.000 -6.142) 9.001 8.712 ( 3.243 0.000 -6.803) 7.536 8.755 ( 11.671 -0.000 -1.259) 11.738 9.119 ( 1.152 0.000 4.007) 4.169 9.464 ( -3.225 -0.000 -7.360) 8.036 9.757 ( 7.059 0.000 4.131) 8.179 9.931 ( 4.469 0.000 -12.688) 13.452 10.106 ( 1.264 0.000 6.994) 7.107 10.561 ( 8.098 0.000 1.146) 8.179 10.582 ( 10.862 0.000 3.652) 11.460 10.789 ( 1.504 0.000 -9.839) 9.954 10.909 ( -0.499 -0.000 -1.237) 1.334 11.199 ( 6.070 0.000 6.323) 8.765 12.015 ( 1.422 0.000 6.316) 6.474 12.063 ( -1.094 0.000 0.562) 1.230 12.405 ( -5.026 0.000 2.564) 5.642 13.255 ( 3.569 0.000 -10.404) 10.999 13.835 ( -10.939 0.000 5.993) 12.473 14.053 ( 0.085 0.000 6.678) 6.678 14.156 ( -4.211 -0.000 -6.593) 7.823 14.919 ( -12.955 0.000 -3.683) 13.468 15.438 ( 4.001 -0.000 -1.013) 4.127 15.508 ( 12.637 0.000 -5.157) 13.649 16.119 ( -21.913 0.000 9.274) 23.795 16.885 ( 4.368 0.000 2.597) 5.082 17.236 ( 9.693 0.000 11.869) 15.324 17.272 ( -6.065 -0.000 -1.521) 6.253 18.787 ( -1.423 0.000 -7.321) 7.458 19.301 ( 12.037 0.000 -4.247) 12.764 ======================= Grid point 335 (179/260) ======================= q-point: (-0.20 -0.50 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 250 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.759 ( 8.532 0.000 5.883) 10.363 2.016 ( 2.523 -0.000 3.515) 4.327 2.370 ( -0.913 0.000 7.757) 7.811 2.380 ( 0.286 -0.000 15.877) 15.880 4.104 ( 0.606 -0.000 -0.538) 0.810 4.563 ( 4.302 0.000 7.172) 8.363 4.639 ( 3.826 -0.000 6.818) 7.818 4.926 ( 2.034 0.000 0.370) 2.067 5.527 ( -8.085 -0.000 5.717) 9.903 5.994 ( -2.061 0.000 -2.766) 3.449 6.238 ( -2.394 -0.000 8.953) 9.267 6.463 ( -2.662 0.000 -2.568) 3.698 6.654 ( -6.873 -0.000 -14.947) 16.452 6.798 ( -0.892 0.000 9.138) 9.182 7.090 ( 0.973 -0.000 -2.832) 2.995 7.225 ( -10.276 0.000 -0.867) 10.313 7.806 ( -2.400 -0.000 0.314) 2.421 7.888 ( 7.903 -0.000 -3.126) 8.498 8.009 ( 2.490 -0.000 7.037) 7.465 8.411 ( 11.169 0.000 -0.472) 11.179 8.746 ( 4.447 0.000 -5.882) 7.373 8.942 ( 8.442 -0.000 -2.493) 8.802 9.156 ( 0.550 0.000 2.295) 2.360 9.383 ( 0.154 -0.000 -9.148) 9.149 9.873 ( 3.478 0.000 -0.766) 3.561 9.914 ( 2.620 -0.000 -15.066) 15.292 10.160 ( -0.590 0.000 8.958) 8.977 10.726 ( -3.015 0.000 -1.226) 3.255 10.750 ( 9.981 0.000 1.862) 10.153 10.852 ( 12.955 -0.000 1.840) 13.085 10.965 ( 8.288 -0.000 -3.542) 9.013 11.372 ( 6.040 0.000 9.217) 11.020 12.034 ( -2.562 0.000 -0.137) 2.566 12.091 ( 2.247 0.000 5.419) 5.866 12.324 ( -3.511 0.000 0.124) 3.513 13.189 ( -3.031 -0.000 -12.349) 12.716 13.671 ( -7.400 0.000 0.034) 7.400 13.996 ( -6.495 -0.000 -10.436) 12.292 14.050 ( -3.835 -0.000 4.302) 5.763 14.645 ( -12.632 0.000 -3.696) 13.161 15.526 ( 4.894 0.000 2.443) 5.470 15.693 ( 9.434 -0.000 -4.712) 10.545 15.743 ( -23.441 0.000 11.285) 26.016 16.827 ( -7.393 0.000 -8.478) 11.249 17.352 ( 9.828 -0.000 13.187) 16.447 17.503 ( 9.400 -0.000 13.699) 16.614 18.753 ( 1.918 0.000 -5.130) 5.476 19.455 ( 6.910 0.000 -7.585) 10.261 ======================= Grid point 337 (180/260) ======================= q-point: (-0.10 -0.50 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 250 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.006 ( 12.687 0.000 2.444) 12.920 2.121 ( 5.615 -0.000 3.959) 6.870 2.449 ( 1.843 0.000 15.125) 15.237 2.516 ( 1.969 -0.000 18.593) 18.697 4.124 ( 0.104 -0.000 3.264) 3.266 4.735 ( 1.590 0.000 7.665) 7.829 4.742 ( 8.706 -0.000 8.518) 12.180 4.987 ( 2.732 0.000 1.679) 3.207 5.424 ( -4.883 -0.000 4.188) 6.433 5.897 ( -5.423 -0.000 -5.823) 7.957 6.265 ( -0.418 -0.000 7.907) 7.918 6.394 ( -2.184 0.000 -3.466) 4.096 6.458 ( -5.370 -0.000 -9.639) 11.034 6.821 ( -2.330 0.000 8.836) 9.138 7.038 ( -4.339 -0.000 -2.024) 4.787 7.079 ( -4.134 0.000 0.001) 4.134 7.789 ( 1.254 -0.000 0.145) 1.262 8.005 ( 6.920 -0.000 -4.812) 8.428 8.141 ( 5.622 0.000 7.112) 9.065 8.630 ( 8.624 0.000 3.508) 9.310 8.833 ( 8.207 0.000 -1.813) 8.405 9.038 ( 3.053 0.000 -2.451) 3.915 9.168 ( 0.555 0.000 -1.708) 1.796 9.360 ( 4.167 -0.000 -11.645) 12.368 9.844 ( -0.044 0.000 -15.359) 15.359 9.863 ( -3.253 -0.000 -3.753) 4.967 10.203 ( -1.078 0.000 10.061) 10.118 10.643 ( -4.622 0.000 0.550) 4.655 10.938 ( 7.227 0.000 1.596) 7.401 11.093 ( 12.418 -0.000 -3.999) 13.046 11.176 ( 12.592 -0.000 2.356) 12.811 11.516 ( 2.691 -0.000 9.444) 9.820 11.940 ( -7.542 0.000 -0.470) 7.557 12.143 ( -0.648 0.000 4.357) 4.405 12.309 ( 2.380 0.000 0.423) 2.417 13.000 ( -7.668 -0.000 -13.840) 15.822 13.561 ( -2.756 0.000 -4.130) 4.965 13.806 ( -4.857 -0.000 -12.513) 13.422 13.982 ( -4.699 0.000 3.356) 5.775 14.409 ( -8.853 -0.000 -3.667) 9.582 15.368 ( -23.076 0.000 13.524) 26.747 15.660 ( 6.602 0.000 4.925) 8.237 15.809 ( 6.066 0.000 -5.416) 8.132 16.604 ( -8.799 0.000 -9.051) 12.623 17.691 ( 13.093 0.000 17.648) 21.974 17.755 ( 7.244 -0.000 14.557) 16.259 18.801 ( 6.112 0.000 -4.003) 7.306 19.450 ( -1.618 -0.000 -11.358) 11.473 ======================= Grid point 369 (181/260) ======================= q-point: ( 0.00 0.00 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 260 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.701 ( -6.272 0.000 14.857) 16.127 1.818 ( 4.301 0.000 11.220) 12.017 2.956 ( -2.023 0.000 -2.669) 3.349 2.970 ( 2.506 0.000 -0.718) 2.607 3.956 ( -3.046 0.000 11.572) 11.966 4.431 ( 2.951 0.000 -9.479) 9.928 4.816 ( 1.292 0.000 7.580) 7.689 4.922 ( 10.577 0.000 6.063) 12.191 5.817 ( 9.650 0.000 3.528) 10.275 5.917 ( -3.346 0.000 -1.113) 3.526 6.210 ( 1.183 0.000 3.488) 3.683 6.519 ( 0.523 0.000 -0.358) 0.634 6.581 ( -4.872 0.000 -1.090) 4.993 6.768 ( -2.014 0.000 0.489) 2.072 7.195 ( -0.439 0.000 -2.546) 2.583 7.212 ( -5.613 0.000 -3.266) 6.494 7.370 ( -1.380 0.000 6.456) 6.602 7.659 ( 4.169 0.000 -6.728) 7.915 8.045 ( 1.292 0.000 9.399) 9.487 8.379 ( 13.073 0.000 -4.229) 13.740 8.589 ( -3.944 0.000 5.704) 6.935 8.807 ( 8.896 0.000 -1.450) 9.013 9.270 ( -6.670 0.000 3.015) 7.319 9.514 ( 1.661 0.000 -12.294) 12.406 9.814 ( -3.059 0.000 1.830) 3.565 9.927 ( 6.453 0.000 -4.030) 7.608 10.299 ( -1.983 0.000 -1.264) 2.352 10.369 ( -5.000 0.000 -5.215) 7.224 11.048 ( 2.169 0.000 2.031) 2.971 11.177 ( 0.382 0.000 -3.590) 3.610 11.522 ( -1.132 0.000 -1.312) 1.733 11.635 ( 7.393 0.000 -5.937) 9.482 11.983 ( -15.490 0.000 4.537) 16.140 12.236 ( 3.850 0.000 -3.921) 5.495 12.260 ( -4.805 0.000 3.992) 6.247 12.426 ( 3.456 0.000 -9.075) 9.711 13.412 ( -3.293 0.000 11.681) 12.136 13.875 ( -1.600 0.000 -7.878) 8.039 14.049 ( 11.592 0.000 13.326) 17.662 14.604 ( -6.937 0.000 -12.135) 13.977 15.495 ( -19.037 0.000 0.181) 19.037 15.547 ( 9.117 0.000 -1.265) 9.204 15.960 ( 7.737 0.000 3.350) 8.431 16.096 ( -6.551 0.000 -2.924) 7.173 17.923 ( 6.310 0.000 12.658) 14.143 18.402 ( -3.454 0.000 -10.595) 11.144 18.821 ( -8.894 0.000 9.521) 13.029 19.121 ( 13.599 0.000 -5.442) 14.647 ======================= Grid point 370 (182/260) ======================= q-point: ( 0.10 0.00 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 250 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.771 ( 3.568 0.000 15.165) 15.579 2.031 ( 11.474 0.000 4.911) 12.481 2.911 ( -0.332 0.000 -4.742) 4.754 3.017 ( 2.268 0.000 0.228) 2.279 3.980 ( -2.230 0.000 12.219) 12.421 4.413 ( 1.104 0.000 -9.820) 9.882 4.858 ( 0.098 0.000 2.347) 2.349 5.071 ( 3.855 0.000 -5.016) 6.326 5.848 ( -1.776 0.000 -4.154) 4.518 6.005 ( 8.093 0.000 0.828) 8.135 6.282 ( 2.422 0.000 7.741) 8.111 6.417 ( -4.766 0.000 -10.656) 11.673 6.564 ( -1.426 0.000 6.206) 6.367 6.722 ( -4.639 0.000 5.681) 7.335 7.093 ( -3.575 0.000 -4.015) 5.376 7.174 ( -1.367 0.000 1.991) 2.415 7.400 ( 1.089 0.000 3.476) 3.643 7.702 ( 4.482 0.000 -6.837) 8.175 8.057 ( -3.980 0.000 2.510) 4.705 8.521 ( -6.381 0.000 5.433) 8.381 8.567 ( 10.256 0.000 -9.724) 14.133 8.878 ( 0.389 0.000 -8.885) 8.893 9.185 ( -3.996 0.000 4.155) 5.765 9.521 ( 6.000 0.000 -4.959) 7.784 9.729 ( -7.925 0.000 -0.487) 7.940 9.960 ( 1.393 0.000 -4.280) 4.501 10.299 ( 1.368 0.000 0.724) 1.548 10.350 ( 4.976 0.000 1.809) 5.295 10.975 ( -9.061 0.000 1.096) 9.127 11.037 ( -9.799 0.000 -4.042) 10.600 11.519 ( -0.062 0.000 -3.625) 3.626 11.577 ( -13.090 0.000 0.760) 13.112 11.896 ( 3.307 0.000 6.101) 6.940 12.278 ( 2.840 0.000 -1.552) 3.236 12.318 ( 8.408 0.000 -0.476) 8.422 12.518 ( 9.076 0.000 -2.580) 9.436 13.461 ( 1.582 0.000 10.781) 10.896 13.804 ( -1.014 0.000 -5.040) 5.141 14.350 ( 11.018 0.000 10.664) 15.334 14.395 ( -6.301 0.000 -13.731) 15.108 15.195 ( -13.560 0.000 6.506) 15.040 15.759 ( 12.222 0.000 2.172) 12.413 15.959 ( -5.347 0.000 -3.716) 6.512 16.134 ( 7.859 0.000 2.947) 8.393 18.090 ( 3.027 0.000 11.511) 11.902 18.238 ( -5.843 0.000 -12.964) 14.220 18.638 ( -15.145 0.000 6.551) 16.501 19.253 ( 4.971 0.000 -8.151) 9.547 ======================= Grid point 371 (183/260) ======================= q-point: ( 0.20 0.00 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 260 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.997 ( 9.498 0.000 13.755) 16.715 2.281 ( 12.149 0.000 0.279) 12.152 2.873 ( -0.524 0.000 -6.284) 6.306 3.039 ( -0.961 0.000 0.612) 1.139 4.019 ( -1.687 0.000 12.176) 12.293 4.347 ( -1.971 0.000 -8.498) 8.724 4.863 ( 1.421 0.000 -4.416) 4.639 5.015 ( -3.414 0.000 -11.808) 12.292 5.810 ( 1.839 0.000 -8.098) 8.304 6.125 ( 4.498 0.000 -2.625) 5.208 6.260 ( -4.781 0.000 -7.774) 9.127 6.374 ( 0.886 0.000 9.837) 9.877 6.561 ( -1.989 0.000 3.869) 4.350 6.680 ( -3.436 0.000 8.538) 9.203 7.047 ( 1.675 0.000 -3.975) 4.313 7.170 ( -1.584 0.000 5.336) 5.567 7.444 ( 1.313 0.000 1.821) 2.245 7.742 ( 3.977 0.000 -6.928) 7.988 7.934 ( -7.867 0.000 -3.106) 8.458 8.426 ( -6.091 0.000 3.503) 7.027 8.593 ( 0.134 0.000 -21.502) 21.503 8.777 ( -2.235 0.000 -6.128) 6.523 9.169 ( -1.328 0.000 6.689) 6.820 9.505 ( -12.570 0.000 -2.616) 12.839 9.665 ( 9.292 0.000 -1.508) 9.414 9.954 ( 0.387 0.000 -4.007) 4.026 10.433 ( 7.856 0.000 7.001) 10.523 10.468 ( 6.099 0.000 2.040) 6.431 10.790 ( -9.550 0.000 2.035) 9.764 10.827 ( -8.133 0.000 -4.590) 9.338 11.310 ( -16.087 0.000 9.313) 18.588 11.430 ( -6.371 0.000 -4.452) 7.773 11.963 ( -1.256 0.000 3.900) 4.097 12.338 ( 2.777 0.000 3.222) 4.254 12.542 ( 15.736 0.000 -5.770) 16.761 12.686 ( 6.795 0.000 2.315) 7.178 13.620 ( 8.926 0.000 6.488) 11.034 13.783 ( 1.251 0.000 -2.634) 2.915 14.208 ( -3.732 0.000 -12.226) 12.783 14.572 ( 4.887 0.000 8.574) 9.869 15.077 ( -3.833 0.000 10.800) 11.460 15.827 ( -4.155 0.000 -5.370) 6.790 16.046 ( 13.218 0.000 6.032) 14.529 16.289 ( 6.238 0.000 3.023) 6.931 18.027 ( -6.644 0.000 -15.141) 16.535 18.151 ( -6.711 0.000 9.240) 11.420 18.363 ( -12.710 0.000 3.567) 13.201 19.233 ( -0.713 0.000 -9.865) 9.891 ======================= Grid point 372 (184/260) ======================= q-point: ( 0.30 0.00 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 250 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.266 ( 9.420 0.000 11.399) 14.788 2.491 ( 9.905 0.000 -1.218) 9.979 2.799 ( -2.890 0.000 -7.016) 7.588 2.962 ( -7.169 0.000 -1.141) 7.260 4.060 ( -2.089 0.000 12.126) 12.304 4.243 ( -3.643 0.000 -6.192) 7.184 4.827 ( -7.075 0.000 -13.709) 15.427 4.864 ( 3.349 0.000 -10.376) 10.903 5.799 ( 2.742 0.000 -12.105) 12.412 6.125 ( -2.575 0.000 -3.287) 4.176 6.185 ( 1.125 0.000 -0.859) 1.415 6.453 ( 1.323 0.000 11.076) 11.155 6.550 ( -1.180 0.000 3.649) 3.835 6.699 ( 0.002 0.000 5.400) 5.400 7.109 ( 6.399 0.000 -2.045) 6.718 7.166 ( -2.869 0.000 5.890) 6.552 7.437 ( -3.990 0.000 -0.350) 4.006 7.764 ( -5.160 0.000 -5.172) 7.306 7.767 ( 3.306 0.000 -7.612) 8.299 8.331 ( -5.391 0.000 1.115) 5.505 8.371 ( -5.900 0.000 -22.632) 23.388 8.699 ( -3.565 0.000 -6.654) 7.548 9.208 ( 0.151 0.000 8.647) 8.649 9.282 ( -8.496 0.000 0.985) 8.553 9.805 ( 6.166 0.000 -5.045) 7.967 9.920 ( -1.262 0.000 -3.289) 3.523 10.511 ( -7.556 0.000 5.612) 9.412 10.610 ( 7.943 0.000 -2.375) 8.291 10.691 ( -2.741 0.000 -3.672) 4.582 10.726 ( 0.708 0.000 5.146) 5.194 11.149 ( -5.067 0.000 14.027) 14.914 11.251 ( -9.195 0.000 -0.636) 9.217 11.907 ( -5.587 0.000 1.893) 5.899 12.409 ( 1.141 0.000 5.178) 5.303 12.769 ( 0.341 0.000 2.292) 2.317 12.803 ( 14.827 0.000 -7.965) 16.831 13.794 ( 3.905 0.000 -1.348) 4.131 13.810 ( 2.130 0.000 -0.573) 2.206 14.191 ( 9.889 0.000 -2.867) 10.296 14.646 ( -1.878 0.000 9.251) 9.440 15.158 ( 4.052 0.000 9.346) 10.186 15.717 ( -3.471 0.000 -6.097) 7.016 16.338 ( 12.046 0.000 7.774) 14.337 16.411 ( 4.191 0.000 4.234) 5.957 17.810 ( -5.250 0.000 -16.519) 17.333 17.860 ( -21.101 0.000 1.662) 21.167 18.314 ( -0.590 0.000 6.691) 6.717 19.123 ( -3.535 0.000 -11.195) 11.740 ======================= Grid point 373 (185/260) ======================= q-point: ( 0.40 0.00 -0.60) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 260 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.475 ( 5.065 0.000 9.580) 10.837 2.641 ( 5.080 0.000 -0.987) 5.175 2.685 ( -3.696 0.000 -6.961) 7.881 2.765 ( -10.300 0.000 -2.097) 10.512 4.085 ( -2.882 0.000 11.357) 11.717 4.149 ( -2.570 0.000 -3.258) 4.150 4.600 ( -7.693 0.000 -11.683) 13.988 4.850 ( 2.901 0.000 -14.643) 14.927 5.777 ( 2.727 0.000 -8.104) 8.551 6.008 ( -7.574 0.000 -1.333) 7.690 6.293 ( 8.392 0.000 2.282) 8.697 6.560 ( 2.154 0.000 9.181) 9.430 6.572 ( 1.066 0.000 4.440) 4.566 6.709 ( -1.588 0.000 2.405) 2.882 7.119 ( -5.146 0.000 3.503) 6.226 7.215 ( 1.005 0.000 -6.146) 6.227 7.311 ( -1.881 0.000 1.198) 2.230 7.705 ( 0.363 0.000 -2.386) 2.414 7.775 ( 2.770 0.000 -8.704) 9.134 8.137 ( -4.562 0.000 -18.888) 19.431 8.239 ( -4.069 0.000 0.322) 4.081 8.550 ( -6.683 0.000 -7.694) 10.191 9.229 ( 0.975 0.000 6.116) 6.193 9.276 ( 0.663 0.000 10.095) 10.117 9.797 ( -3.323 0.000 -4.588) 5.665 9.891 ( 1.370 0.000 -8.372) 8.483 10.345 ( -11.597 0.000 7.721) 13.932 10.638 ( 3.122 0.000 -10.612) 11.062 10.715 ( -3.709 0.000 4.248) 5.639 10.735 ( 3.706 0.000 -2.836) 4.666 11.146 ( -1.954 0.000 7.907) 8.144 11.306 ( 8.594 0.000 12.923) 15.520 11.805 ( -4.878 0.000 1.234) 5.031 12.403 ( -4.306 0.000 -0.697) 4.362 12.762 ( -1.358 0.000 2.753) 3.070 12.992 ( 9.804 0.000 -8.635) 13.064 13.787 ( -1.558 0.000 -0.413) 1.612 13.844 ( 1.217 0.000 0.704) 1.405 14.482 ( 17.265 0.000 0.928) 17.290 14.643 ( -4.321 0.000 9.275) 10.232 15.292 ( 4.358 0.000 5.202) 6.787 15.618 ( -2.875 0.000 -6.209) 6.842 16.516 ( 3.661 0.000 6.621) 7.566 16.591 ( 9.048 0.000 7.402) 11.689 17.468 ( -19.047 0.000 -0.172) 19.048 17.631 ( -2.489 0.000 -16.648) 16.834 18.355 ( 0.493 0.000 7.047) 7.064 18.972 ( -4.304 0.000 -11.862) 12.619 ======================= Grid point 374 (186/260) ======================= q-point: (-0.50 0.00 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 250 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.479 ( -13.626 0.000 0.814) 13.651 2.525 ( -6.489 0.000 8.289) 10.527 2.646 ( 4.751 0.000 -4.552) 6.580 2.771 ( 4.443 0.000 -0.508) 4.472 4.087 ( -3.421 0.000 8.433) 9.101 4.119 ( 0.672 0.000 0.261) 0.721 4.407 ( -6.432 0.000 -5.201) 8.272 4.787 ( 0.423 0.000 -15.344) 15.349 5.825 ( 5.325 0.000 -2.341) 5.817 5.829 ( -10.339 0.000 -0.032) 10.339 6.475 ( 6.681 0.000 3.495) 7.539 6.536 ( -8.077 0.000 1.822) 8.280 6.663 ( 6.200 0.000 5.528) 8.307 6.762 ( 4.680 0.000 5.716) 7.387 7.016 ( -6.139 0.000 -0.350) 6.149 7.078 ( -4.459 0.000 -6.917) 8.230 7.411 ( 4.575 0.000 3.161) 5.561 7.709 ( 0.593 0.000 -0.985) 1.150 7.755 ( 0.685 0.000 -10.384) 10.406 7.967 ( -2.436 0.000 -13.870) 14.082 8.206 ( 0.214 0.000 2.638) 2.647 8.384 ( -4.703 0.000 -7.106) 8.521 9.350 ( 0.214 0.000 11.203) 11.205 9.373 ( 7.748 0.000 8.494) 11.497 9.663 ( -6.775 0.000 -5.230) 8.558 9.844 ( 0.664 0.000 -11.884) 11.902 10.216 ( -5.948 0.000 8.609) 10.464 10.642 ( 4.565 0.000 -12.239) 13.062 10.682 ( -2.242 0.000 3.908) 4.505 10.762 ( 1.733 0.000 -0.571) 1.824 11.261 ( 6.393 0.000 8.640) 10.748 11.472 ( 0.877 0.000 1.483) 1.723 11.823 ( 5.989 0.000 8.920) 10.744 12.243 ( -7.872 0.000 -8.697) 11.731 12.771 ( -0.451 0.000 4.315) 4.339 13.068 ( 3.469 0.000 -8.086) 8.799 13.755 ( -2.860 0.000 3.095) 4.214 13.861 ( -0.045 0.000 0.881) 0.882 14.582 ( -7.422 0.000 6.279) 9.722 14.798 ( 14.742 0.000 -0.701) 14.759 15.380 ( 2.710 0.000 1.896) 3.307 15.524 ( -3.320 0.000 -5.374) 6.317 16.650 ( 5.483 0.000 8.462) 10.083 16.763 ( 4.394 0.000 2.982) 5.310 17.159 ( -12.651 0.000 3.345) 13.086 17.511 ( 0.336 0.000 -14.926) 14.930 18.425 ( 2.087 0.000 7.909) 8.180 18.821 ( -3.703 0.000 -11.422) 12.007 ======================= Grid point 375 (187/260) ======================= q-point: (-0.40 0.00 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 260 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.244 ( -13.082 0.000 7.429) 15.044 2.420 ( -9.362 0.000 8.022) 12.329 2.736 ( 5.990 0.000 -0.393) 6.002 2.838 ( 2.911 0.000 -0.558) 2.964 4.052 ( -4.137 0.000 3.901) 5.686 4.182 ( 4.446 0.000 3.780) 5.836 4.304 ( -4.157 0.000 5.173) 6.636 4.689 ( -1.309 0.000 -12.833) 12.900 5.625 ( -10.754 0.000 1.842) 10.911 5.927 ( 5.268 0.000 0.248) 5.274 6.375 ( -7.526 0.000 -0.897) 7.579 6.557 ( -0.617 0.000 5.856) 5.888 6.850 ( 2.275 0.000 -6.193) 6.598 6.878 ( 8.911 0.000 -0.323) 8.917 6.903 ( -1.881 0.000 2.709) 3.298 7.041 ( 1.810 0.000 8.755) 8.940 7.488 ( 1.653 0.000 2.531) 3.023 7.655 ( -2.833 0.000 -12.668) 12.981 7.701 ( -1.128 0.000 -0.493) 1.231 7.878 ( 0.400 0.000 -9.400) 9.408 8.282 ( 4.485 0.000 5.952) 7.452 8.308 ( 0.890 0.000 -5.239) 5.314 9.406 ( -1.691 0.000 11.499) 11.623 9.510 ( -4.093 0.000 -6.642) 7.802 9.593 ( 8.921 0.000 7.471) 11.636 9.780 ( 0.716 0.000 -13.071) 13.091 10.245 ( 3.510 0.000 7.419) 8.208 10.666 ( 4.201 0.000 -8.005) 9.040 10.668 ( -1.807 0.000 3.305) 3.767 10.807 ( 3.052 0.000 -0.419) 3.080 11.423 ( -2.342 0.000 -4.467) 5.044 11.440 ( 6.835 0.000 5.037) 8.491 12.048 ( -4.809 0.000 -10.516) 11.564 12.079 ( 11.158 0.000 12.492) 16.750 12.777 ( -0.891 0.000 0.733) 1.154 13.025 ( -3.186 0.000 -6.382) 7.133 13.704 ( -5.255 0.000 5.026) 7.271 13.852 ( -1.210 0.000 -0.226) 1.231 14.424 ( -11.215 0.000 0.974) 11.258 15.027 ( 10.501 0.000 -4.678) 11.496 15.419 ( -4.720 0.000 -3.158) 5.679 15.435 ( 2.384 0.000 1.525) 2.830 16.732 ( -6.198 0.000 -4.377) 7.588 16.793 ( 3.264 0.000 2.371) 4.034 17.099 ( 1.065 0.000 11.190) 11.241 17.494 ( 7.077 0.000 -6.604) 9.679 18.535 ( 3.601 0.000 9.276) 9.950 18.697 ( -2.150 0.000 -9.883) 10.114 ======================= Grid point 376 (188/260) ======================= q-point: (-0.30 0.00 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 250 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.058 ( -13.565 0.000 13.733) 19.303 2.255 ( -13.242 0.000 8.905) 15.958 2.868 ( 6.397 0.000 2.754) 6.965 2.879 ( 1.829 0.000 -0.879) 2.029 3.996 ( -3.891 0.000 4.765) 6.152 4.303 ( -1.601 0.000 12.158) 12.263 4.327 ( 6.950 0.000 6.040) 9.208 4.585 ( -2.022 0.000 -9.291) 9.508 5.474 ( -5.898 0.000 4.211) 7.247 6.009 ( 2.362 0.000 1.037) 2.580 6.257 ( -3.409 0.000 -2.784) 4.402 6.544 ( -4.569 0.000 7.564) 8.837 6.806 ( -1.946 0.000 -5.255) 5.604 6.822 ( 1.491 0.000 -9.541) 9.657 7.125 ( 8.840 0.000 2.807) 9.275 7.190 ( 3.565 0.000 15.298) 15.708 7.506 ( -1.216 0.000 1.436) 1.881 7.556 ( 1.438 0.000 -9.508) 9.617 7.679 ( -0.781 0.000 2.629) 2.743 7.848 ( 2.319 0.000 -8.002) 8.331 8.343 ( 4.940 0.000 -2.622) 5.593 8.423 ( 5.070 0.000 7.126) 8.746 9.429 ( -3.033 0.000 10.801) 11.218 9.458 ( 3.336 0.000 -6.219) 7.057 9.709 ( 0.788 0.000 -14.168) 14.190 9.787 ( 7.026 0.000 3.985) 8.078 10.403 ( 7.506 0.000 4.574) 8.790 10.650 ( -1.249 0.000 1.801) 2.192 10.689 ( 1.317 0.000 -3.507) 3.746 10.860 ( 3.126 0.000 -1.922) 3.670 11.375 ( 0.524 0.000 -3.620) 3.657 11.556 ( 3.932 0.000 -1.938) 4.384 11.974 ( 2.772 0.000 -5.190) 5.884 12.357 ( 9.259 0.000 10.199) 13.775 12.735 ( -2.134 0.000 -5.667) 6.056 12.873 ( -9.319 0.000 -2.812) 9.734 13.615 ( -7.540 0.000 6.710) 10.093 13.796 ( -4.436 0.000 -2.134) 4.923 14.197 ( -10.008 0.000 -3.233) 10.518 15.118 ( 2.503 0.000 -10.775) 11.062 15.331 ( -1.975 0.000 0.498) 2.037 15.504 ( 3.414 0.000 3.218) 4.692 16.565 ( -7.751 0.000 -3.208) 8.388 16.715 ( -8.664 0.000 -10.198) 13.381 17.248 ( 5.989 0.000 11.722) 13.163 17.767 ( 20.720 0.000 5.449) 21.424 18.617 ( -0.396 0.000 -8.149) 8.159 18.671 ( 3.825 0.000 10.593) 11.263 ======================= Grid point 377 (189/260) ======================= q-point: (-0.20 0.00 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 260 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.883 ( -14.012 0.000 16.429) 21.593 2.033 ( -15.518 0.000 10.368) 18.664 2.903 ( 1.421 0.000 -0.657) 1.566 2.984 ( 2.925 0.000 2.997) 4.188 3.967 ( -3.375 0.000 7.667) 8.378 4.406 ( 3.727 0.000 15.973) 16.402 4.459 ( 2.274 0.000 -6.431) 6.821 4.553 ( 3.815 0.000 6.958) 7.935 5.469 ( 2.224 0.000 5.604) 6.029 6.024 ( -1.367 0.000 1.228) 1.838 6.203 ( -0.565 0.000 -3.087) 3.139 6.502 ( -4.031 0.000 7.799) 8.779 6.747 ( -1.148 0.000 -5.463) 5.583 6.803 ( 1.918 0.000 -7.579) 7.817 7.219 ( 3.063 0.000 -6.318) 7.022 7.312 ( 0.129 0.000 9.990) 9.991 7.459 ( -4.702 0.000 2.902) 5.526 7.593 ( 3.963 0.000 -3.201) 5.094 7.742 ( 3.718 0.000 9.377) 10.087 7.912 ( 9.545 0.000 -4.425) 10.521 8.455 ( 7.489 0.000 -0.350) 7.497 8.542 ( 2.680 0.000 6.275) 6.824 9.423 ( -4.083 0.000 8.864) 9.759 9.556 ( 9.645 0.000 -4.974) 10.852 9.638 ( 1.393 0.000 -14.360) 14.427 9.889 ( 1.658 0.000 0.439) 1.715 10.514 ( 1.263 0.000 -0.175) 1.275 10.628 ( -6.406 0.000 -2.555) 6.897 10.704 ( 7.326 0.000 1.023) 7.397 10.932 ( 7.138 0.000 -4.051) 8.208 11.406 ( 3.999 0.000 -0.583) 4.042 11.591 ( 2.223 0.000 -4.163) 4.719 12.058 ( 6.228 0.000 -0.560) 6.253 12.473 ( -3.474 0.000 -1.103) 3.645 12.625 ( -3.294 0.000 -11.772) 12.224 12.669 ( -11.135 0.000 5.195) 12.287 13.511 ( -7.861 0.000 8.684) 11.713 13.686 ( -3.498 0.000 1.073) 3.658 14.045 ( -3.548 0.000 -4.950) 6.090 15.002 ( -5.762 0.000 -10.154) 11.675 15.353 ( 3.519 0.000 -2.482) 4.306 15.610 ( 5.032 0.000 4.748) 6.918 16.384 ( -17.249 0.000 -11.997) 21.011 16.401 ( -7.549 0.000 -2.184) 7.859 17.461 ( 8.069 0.000 12.476) 14.858 18.272 ( 25.898 0.000 4.550) 26.294 18.573 ( 0.749 0.000 -7.100) 7.139 18.798 ( 1.868 0.000 11.331) 11.484 ======================= Grid point 378 (190/260) ======================= q-point: (-0.10 0.00 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 250 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.763 ( -7.478 0.000 15.669) 17.362 1.815 ( -13.652 0.000 12.763) 18.689 2.931 ( 1.927 0.000 -0.565) 2.008 3.005 ( -1.486 0.000 0.255) 1.507 3.954 ( -3.540 0.000 9.803) 10.423 4.434 ( 2.128 0.000 -8.810) 9.064 4.642 ( 10.111 0.000 14.585) 17.747 4.708 ( 4.233 0.000 10.053) 10.908 5.611 ( 8.141 0.000 5.326) 9.729 5.983 ( -3.262 0.000 0.754) 3.348 6.190 ( 0.377 0.000 -0.959) 1.031 6.496 ( -1.338 0.000 6.646) 6.779 6.680 ( -2.490 0.000 -5.533) 6.068 6.793 ( 0.587 0.000 -4.202) 4.242 7.216 ( 1.287 0.000 -6.458) 6.585 7.316 ( -2.353 0.000 -2.007) 3.093 7.385 ( -5.819 0.000 9.387) 11.045 7.628 ( 3.071 0.000 -5.396) 6.209 7.908 ( 4.880 0.000 13.111) 13.990 8.134 ( 13.717 0.000 -1.575) 13.807 8.598 ( -0.561 0.000 5.338) 5.367 8.622 ( 9.529 0.000 0.563) 9.546 9.372 ( -5.995 0.000 5.573) 8.186 9.568 ( 1.502 0.000 -14.076) 14.156 9.758 ( 11.986 0.000 -3.553) 12.501 9.867 ( -2.946 0.000 0.023) 2.946 10.442 ( -9.146 0.000 -4.154) 10.045 10.482 ( -2.616 0.000 -4.585) 5.279 10.895 ( 10.103 0.000 1.848) 10.271 11.077 ( 9.433 0.000 -3.665) 10.120 11.512 ( 6.957 0.000 -0.995) 7.027 11.580 ( -1.974 0.000 -1.473) 2.463 12.166 ( 5.274 0.000 -1.725) 5.549 12.263 ( -13.496 0.000 -1.669) 13.599 12.454 ( -14.591 0.000 2.965) 14.889 12.488 ( -1.765 0.000 -13.650) 13.764 13.434 ( -6.048 0.000 10.534) 12.147 13.768 ( 8.400 0.000 8.235) 11.763 13.962 ( -2.431 0.000 -4.966) 5.529 14.810 ( -7.191 0.000 -10.318) 12.577 15.421 ( 5.768 0.000 -3.510) 6.752 15.741 ( 3.274 0.000 4.296) 5.401 15.961 ( -17.288 0.000 -6.810) 18.581 16.245 ( -7.245 0.000 -2.203) 7.573 17.700 ( 8.181 0.000 13.023) 15.380 18.500 ( -0.347 0.000 -8.594) 8.601 18.792 ( 22.026 0.000 -0.611) 22.034 18.865 ( -2.570 0.000 11.076) 11.371 ======================= Grid point 379 (191/260) ======================= q-point: ( 0.00 0.12 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 400 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.730 ( 1.409 4.133 15.089) 15.708 1.929 ( -1.923 9.350 7.925) 12.407 2.923 ( -0.565 -2.317 0.329) 2.408 2.979 ( 2.243 0.110 -1.785) 2.868 4.001 ( -3.051 4.450 12.334) 13.462 4.493 ( 2.633 5.909 -9.570) 11.551 4.851 ( 1.009 3.135 7.472) 8.166 4.954 ( 9.913 2.977 6.032) 11.979 5.745 ( 5.095 -5.650 2.456) 7.994 5.872 ( 0.729 -5.543 -4.253) 7.024 6.264 ( -0.040 5.882 7.415) 9.465 6.506 ( -1.901 -3.879 8.514) 9.547 6.655 ( -1.121 7.973 -9.221) 12.241 6.765 ( -2.006 -0.429 0.391) 2.088 7.023 ( -2.087 -11.694 -2.517) 12.142 7.087 ( -4.145 -8.145 -7.259) 11.670 7.544 ( -0.236 10.552 7.013) 12.672 7.737 ( 3.027 6.284 0.417) 6.988 8.161 ( 1.447 10.650 3.695) 11.365 8.381 ( 9.110 0.307 -0.457) 9.127 8.631 ( 1.450 3.814 1.337) 4.294 8.808 ( 6.855 0.372 -1.551) 7.038 9.253 ( -6.922 -1.431 3.111) 7.722 9.490 ( 1.802 -2.352 -12.321) 12.673 9.792 ( 1.592 -2.703 1.511) 3.482 9.913 ( 1.520 -1.741 -4.364) 4.938 10.329 ( 0.277 1.541 -1.376) 2.085 10.355 ( -6.478 0.469 -3.274) 7.274 11.038 ( 1.207 -0.738 2.016) 2.463 11.176 ( 0.881 -0.228 -4.103) 4.203 11.534 ( 3.956 1.564 0.670) 4.307 11.675 ( 2.246 2.673 -5.471) 6.490 11.995 ( -12.245 0.914 4.466) 13.066 12.218 ( -3.236 -2.529 0.992) 4.225 12.268 ( -1.821 1.885 -1.714) 3.132 12.398 ( 4.995 -2.079 -8.817) 10.345 13.379 ( -2.330 -2.944 11.055) 11.675 13.837 ( -1.579 -3.672 -8.963) 9.814 14.049 ( 9.950 -0.067 12.056) 15.632 14.549 ( -6.023 -5.289 -11.140) 13.724 15.435 ( -13.861 -3.403 4.441) 14.948 15.614 ( 3.953 4.114 -4.269) 7.126 15.954 ( 7.378 -0.315 4.159) 8.475 16.123 ( -6.255 2.388 -3.945) 7.772 17.952 ( 5.908 2.883 12.925) 14.501 18.426 ( -3.161 2.058 -9.376) 10.106 18.781 ( -4.334 -3.319 9.674) 11.108 19.115 ( 8.952 -0.764 -6.659) 11.183 ======================= Grid point 380 (192/260) ======================= q-point: ( 0.10 0.12 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 400 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.817 ( 1.063 4.731 12.028) 12.968 2.088 ( 11.107 5.276 4.500) 13.094 2.899 ( -0.293 -0.754 -3.225) 3.325 3.024 ( 2.322 0.401 -0.563) 2.422 4.029 ( -2.287 4.777 13.059) 14.092 4.469 ( 0.869 5.248 -9.968) 11.298 4.881 ( -0.584 2.211 2.334) 3.267 5.099 ( 3.735 2.579 -4.191) 6.178 5.773 ( -0.270 -5.449 -2.213) 5.887 5.922 ( 5.027 -8.832 -3.856) 10.869 6.330 ( 1.324 7.168 8.167) 10.947 6.506 ( -3.058 -3.967 6.798) 8.444 6.576 ( -2.088 8.774 -6.263) 10.981 6.722 ( -3.971 0.011 5.380) 6.687 6.948 ( -1.036 -12.210 -6.149) 13.710 7.021 ( -1.144 -7.137 -0.458) 7.243 7.588 ( 1.402 11.513 3.747) 12.188 7.792 ( 3.106 7.321 -1.902) 8.177 8.154 ( -3.419 9.412 -0.252) 10.017 8.470 ( -0.420 -1.609 1.790) 2.444 8.678 ( 4.658 7.191 -7.752) 11.554 8.861 ( 0.942 -1.467 -7.938) 8.127 9.163 ( -3.999 -1.977 4.009) 5.998 9.501 ( 5.523 -1.991 -4.693) 7.516 9.696 ( -9.356 -3.168 -2.264) 10.134 9.950 ( 2.810 -2.020 -3.185) 4.703 10.262 ( -0.908 -0.729 1.168) 1.649 10.401 ( 5.742 2.893 2.216) 6.801 10.943 ( -9.425 -2.294 0.207) 9.703 11.064 ( -8.923 2.030 -3.093) 9.659 11.553 ( -5.886 2.109 -3.115) 6.986 11.613 ( -5.866 3.895 -0.065) 7.042 11.910 ( 1.064 1.712 6.347) 6.659 12.226 ( 4.168 -4.998 -0.627) 6.538 12.297 ( 5.632 -2.162 0.169) 6.036 12.515 ( 9.050 0.001 -3.506) 9.706 13.441 ( 2.147 -1.881 10.205) 10.597 13.761 ( -0.666 -4.036 -6.110) 7.353 14.307 ( 6.386 -3.631 5.763) 9.337 14.389 ( -0.461 -1.240 -8.750) 8.849 15.183 ( -13.081 -0.842 8.861) 15.822 15.779 ( 11.036 1.699 0.356) 11.172 15.976 ( -4.619 1.774 -3.373) 5.988 16.141 ( 7.816 0.687 2.868) 8.354 18.095 ( 0.185 0.903 9.641) 9.685 18.288 ( -3.583 4.349 -10.275) 11.719 18.621 ( -14.977 -1.500 5.442) 16.006 19.226 ( 5.605 -2.586 -7.451) 9.675 ======================= Grid point 381 (193/260) ======================= q-point: ( 0.20 0.12 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 400 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.962 ( 6.698 -2.129 9.527) 11.839 2.319 ( 9.999 2.964 1.127) 10.490 2.873 ( 0.165 0.399 -5.510) 5.527 3.036 ( -1.314 -0.709 -0.747) 1.670 4.070 ( -1.958 4.790 13.059) 14.047 4.397 ( -2.290 4.564 -8.677) 10.068 4.876 ( 0.941 1.376 -4.058) 4.387 5.047 ( -3.500 2.673 -11.237) 12.069 5.774 ( 2.979 -2.885 -4.645) 6.226 5.962 ( 2.302 -10.298 -5.890) 12.085 6.363 ( -2.134 5.415 1.672) 6.056 6.496 ( -2.126 8.252 3.565) 9.237 6.507 ( -3.515 -3.750 7.584) 9.162 6.705 ( -0.749 1.231 5.241) 5.435 6.945 ( 4.245 -10.268 -6.599) 12.923 7.011 ( -0.742 -5.289 3.713) 6.505 7.642 ( 2.145 12.057 1.984) 12.406 7.827 ( 1.943 7.314 -3.200) 8.216 8.033 ( -6.970 9.632 -4.685) 12.779 8.431 ( -3.915 1.053 1.970) 4.507 8.608 ( -3.428 0.882 -20.616) 20.918 8.812 ( -0.588 3.443 -5.585) 6.587 9.153 ( -0.712 -1.902 6.307) 6.626 9.446 ( -11.701 -5.212 -2.563) 13.063 9.647 ( 8.427 -1.783 -1.563) 8.754 9.952 ( 0.084 -0.630 -3.946) 3.997 10.331 ( 4.627 -4.623 4.804) 8.115 10.538 ( 5.130 1.896 4.379) 7.006 10.757 ( -8.911 -2.130 0.529) 9.177 10.860 ( -8.713 2.251 -2.990) 9.483 11.326 ( -13.295 1.292 3.907) 13.917 11.499 ( -7.409 6.254 -0.529) 9.710 11.939 ( -2.685 -1.809 3.394) 4.691 12.332 ( 4.621 -0.726 5.445) 7.178 12.501 ( 15.159 -4.309 -5.169) 16.585 12.648 ( 5.041 -3.185 0.777) 6.013 13.566 ( 3.688 -4.407 5.014) 7.626 13.784 ( 7.840 -0.320 -1.894) 8.072 14.224 ( -2.472 1.159 -10.094) 10.457 14.540 ( 5.123 -3.053 7.013) 9.205 15.079 ( -4.126 0.441 11.886) 12.589 15.829 ( -3.882 -0.004 -5.127) 6.431 16.063 ( 12.435 1.757 4.421) 13.314 16.303 ( 6.669 1.255 3.429) 7.603 17.988 ( -9.677 -2.199 -7.945) 12.712 18.216 ( -8.261 4.085 2.294) 9.496 18.361 ( -8.541 0.536 2.497) 8.914 19.227 ( -0.025 -0.536 -8.600) 8.617 ======================= Grid point 382 (194/260) ======================= q-point: ( 0.30 0.12 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 400 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.167 ( 8.291 -7.875 7.627) 13.745 2.468 ( 5.082 -2.360 -0.422) 5.619 2.829 ( -0.628 2.537 -7.161) 7.624 2.945 ( -7.282 -2.086 -2.460) 7.965 4.109 ( -2.493 4.368 12.688) 13.648 4.287 ( -3.742 4.003 -6.330) 8.372 4.842 ( -4.782 1.724 -11.809) 12.857 4.890 ( 0.638 2.163 -11.108) 11.334 5.805 ( 3.617 0.646 -9.440) 10.130 5.974 ( 2.558 -8.360 -1.589) 8.886 6.299 ( -3.822 4.203 0.688) 5.723 6.499 ( -1.027 0.327 11.239) 11.291 6.513 ( -1.220 1.543 5.061) 5.430 6.746 ( 1.916 2.534 2.007) 3.758 6.959 ( -1.273 -11.415 -0.871) 11.519 7.085 ( 7.176 -0.955 0.322) 7.247 7.674 ( -1.517 14.850 1.736) 15.028 7.798 ( -3.024 4.796 -4.928) 7.513 7.891 ( -1.289 9.871 -7.203) 12.287 8.344 ( -5.139 0.880 -8.535) 10.001 8.380 ( -5.930 1.831 -12.158) 13.650 8.724 ( -4.699 2.009 -7.449) 9.034 9.194 ( -0.368 -2.350 7.739) 8.096 9.252 ( -6.346 -1.899 1.998) 6.919 9.782 ( 6.333 -2.302 -4.775) 8.258 9.915 ( -1.333 -0.627 -3.702) 3.984 10.443 ( 0.608 -6.212 4.638) 7.776 10.554 ( -3.675 -3.918 2.988) 6.147 10.655 ( -2.501 -2.435 0.324) 3.505 10.752 ( -1.500 1.519 -0.582) 2.213 11.150 ( -6.915 0.685 2.201) 7.289 11.371 ( -5.109 8.706 6.281) 11.889 11.869 ( -5.589 -2.794 2.400) 6.693 12.434 ( 1.302 2.036 5.154) 5.692 12.670 ( 2.747 -7.606 -3.046) 8.642 12.790 ( 12.057 -3.176 -2.184) 12.658 13.623 ( 1.632 -6.759 1.584) 7.132 14.009 ( 9.642 8.905 -0.438) 13.132 14.176 ( 6.069 -0.877 -4.046) 7.347 14.623 ( -0.739 -2.268 8.424) 8.755 15.148 ( 3.000 -0.682 9.298) 9.794 15.719 ( -3.666 0.018 -5.890) 6.938 16.331 ( 10.700 -0.289 5.664) 12.110 16.445 ( 5.870 2.833 5.559) 8.566 17.703 ( -14.184 -6.008 -8.065) 17.387 17.940 ( -13.315 3.594 -5.606) 14.887 18.357 ( 0.613 4.136 4.950) 6.480 19.132 ( -3.464 0.864 -9.985) 10.604 ======================= Grid point 383 (195/260) ======================= q-point: ( 0.40 0.12 -0.60) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 400 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.351 ( 5.330 -10.696 7.536) 14.128 2.507 ( 0.152 -7.928 -1.762) 8.123 2.728 ( -11.611 -1.773 -3.966) 12.397 2.785 ( -0.003 2.642 -6.385) 6.910 4.121 ( -3.690 2.974 9.401) 10.528 4.200 ( -2.201 4.617 -1.407) 5.305 4.625 ( -7.832 2.493 -10.706) 13.497 4.871 ( 3.060 1.851 -13.669) 14.129 5.810 ( 3.194 2.826 -6.277) 7.589 5.989 ( -2.913 -1.831 -0.360) 3.460 6.294 ( 3.425 0.113 3.069) 4.601 6.507 ( -1.846 -2.304 3.627) 4.676 6.602 ( 2.967 1.381 12.957) 13.364 6.777 ( 0.545 4.557 -0.748) 4.650 6.903 ( -3.106 -10.428 -1.591) 10.996 7.244 ( 8.122 0.618 -0.460) 8.158 7.547 ( -8.250 15.137 -3.259) 17.545 7.767 ( 0.962 5.744 -1.547) 6.026 7.855 ( 0.815 7.540 -7.604) 10.739 8.136 ( -4.211 0.177 -17.077) 17.589 8.267 ( -4.514 3.015 -0.406) 5.443 8.558 ( -6.858 0.655 -7.986) 10.547 9.214 ( 1.354 -2.092 7.227) 7.645 9.270 ( 1.033 0.110 8.652) 8.714 9.789 ( -2.352 -0.971 -5.601) 6.152 9.874 ( 0.727 -1.490 -7.345) 7.530 10.326 ( -10.923 -1.860 7.759) 13.527 10.596 ( 3.178 -6.145 -4.342) 8.168 10.661 ( 2.698 -4.469 2.256) 5.687 10.709 ( -1.610 -0.643 -3.243) 3.677 11.069 ( -2.622 -2.535 5.480) 6.583 11.416 ( 2.321 3.953 6.939) 8.316 11.797 ( -2.056 1.024 3.648) 4.311 12.395 ( -5.833 -1.457 -3.510) 6.962 12.708 ( 1.683 -4.151 4.542) 6.379 12.975 ( 9.015 -2.279 -6.291) 11.227 13.676 ( 1.985 -3.971 4.294) 6.176 14.021 ( -1.994 10.170 -3.132) 10.826 14.449 ( 14.887 -2.858 3.212) 15.495 14.645 ( -0.841 -0.030 6.771) 6.823 15.263 ( 3.729 -2.443 4.707) 6.483 15.616 ( -3.296 -0.529 -6.060) 6.918 16.505 ( 4.880 -0.412 5.738) 7.543 16.632 ( 8.247 3.311 7.698) 11.758 17.373 ( -15.393 -6.827 -3.392) 17.178 17.690 ( -7.241 3.632 -11.526) 14.088 18.410 ( 1.859 5.071 5.101) 7.429 18.986 ( -4.624 1.224 -10.859) 11.865 ======================= Grid point 384 (196/260) ======================= q-point: (-0.50 0.12 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 400 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.403 ( -7.380 -10.721 6.980) 14.769 2.464 ( -11.926 -1.323 2.152) 12.190 2.531 ( 5.431 -9.940 -2.613) 11.624 2.773 ( 1.957 -0.784 -5.565) 5.951 4.100 ( -3.237 1.695 6.584) 7.530 4.178 ( -0.108 4.733 1.002) 4.839 4.439 ( -6.468 3.232 -3.315) 7.954 4.826 ( 1.296 3.245 -14.139) 14.564 5.849 ( -3.800 1.793 0.661) 4.253 5.880 ( -0.471 4.494 -1.801) 4.864 6.407 ( 1.214 -5.193 4.507) 6.982 6.477 ( -0.557 -1.615 1.607) 2.346 6.756 ( 4.857 -0.036 8.657) 9.927 6.782 ( 1.825 5.482 -1.202) 5.901 6.851 ( -1.036 -6.303 1.523) 6.567 7.284 ( -3.935 9.667 -7.848) 13.058 7.461 ( 2.480 5.355 2.113) 6.269 7.756 ( -1.777 3.602 -3.836) 5.554 7.810 ( -0.705 6.245 -6.887) 9.324 8.008 ( 0.315 4.126 -11.167) 11.909 8.216 ( -0.722 1.150 2.498) 2.843 8.395 ( -4.319 1.302 -7.073) 8.389 9.315 ( 0.647 -3.385 10.490) 11.042 9.389 ( 7.373 1.691 8.021) 11.025 9.664 ( -6.318 -0.145 -5.156) 8.156 9.829 ( 0.738 -1.462 -11.491) 11.607 10.209 ( -5.500 -0.696 8.697) 10.313 10.623 ( 2.647 -3.282 -3.994) 5.808 10.659 ( 0.175 -0.936 -4.573) 4.671 10.728 ( 2.580 -3.778 -0.186) 4.579 11.151 ( 5.124 -7.549 9.556) 13.212 11.425 ( -2.831 -5.780 -1.989) 6.736 11.890 ( 6.885 5.756 8.560) 12.402 12.221 ( -7.210 -2.066 -7.693) 10.744 12.769 ( 0.861 -0.715 5.176) 5.296 13.050 ( 3.110 -1.816 -7.365) 8.198 13.739 ( 0.497 0.296 6.407) 6.433 13.949 ( -3.403 6.835 -2.056) 7.907 14.549 ( -6.356 -2.948 7.300) 10.119 14.815 ( 14.454 1.362 -2.188) 14.682 15.343 ( 2.548 -3.209 2.051) 4.582 15.513 ( -3.671 -1.486 -5.710) 6.949 16.642 ( 5.490 -0.286 7.635) 9.408 16.791 ( 2.868 2.221 1.737) 4.022 17.119 ( -9.239 -3.462 5.354) 11.226 17.512 ( -3.313 0.349 -12.657) 13.088 18.498 ( 3.849 6.493 5.520) 9.351 18.833 ( -3.957 1.154 -10.632) 11.403 ======================= Grid point 385 (197/260) ======================= q-point: (-0.40 0.12 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 400 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.172 ( -14.836 -7.729 5.241) 17.530 2.373 ( -6.623 -2.733 11.189) 13.286 2.639 ( 5.820 -9.822 0.959) 11.457 2.785 ( 2.593 -4.340 -4.408) 6.707 4.062 ( -4.224 1.099 4.240) 6.085 4.230 ( 4.517 4.329 2.723) 6.824 4.346 ( -4.228 4.163 6.585) 8.864 4.751 ( -0.451 5.110 -12.205) 13.239 5.675 ( -10.341 4.359 2.499) 11.497 5.953 ( 3.939 2.060 -0.345) 4.458 6.335 ( -5.492 -2.096 0.786) 5.931 6.543 ( 0.793 -1.221 5.037) 5.243 6.774 ( 0.124 -3.692 -5.344) 6.497 6.871 ( 6.712 -1.692 -0.329) 6.930 6.952 ( 1.701 3.368 9.209) 9.952 7.162 ( -0.714 8.822 -2.834) 9.293 7.539 ( 2.445 4.395 2.481) 5.608 7.639 ( -3.946 -0.140 -9.812) 10.576 7.755 ( -2.132 5.642 -2.637) 6.582 7.984 ( 1.670 8.714 -6.021) 10.722 8.286 ( 5.015 0.569 5.511) 7.473 8.323 ( 0.839 1.818 -5.058) 5.439 9.363 ( -1.870 -3.636 9.415) 10.264 9.517 ( -3.920 0.446 -3.530) 5.294 9.610 ( 9.140 1.281 4.796) 10.401 9.768 ( 0.736 -1.103 -12.593) 12.662 10.241 ( 3.164 -0.412 7.822) 8.448 10.639 ( -0.928 -2.870 2.432) 3.875 10.659 ( 3.643 -0.769 -7.870) 8.706 10.780 ( 3.377 -2.843 -0.929) 4.511 11.292 ( 1.192 -10.672 0.581) 10.755 11.384 ( 4.100 -5.468 1.912) 7.096 12.058 ( -3.792 0.594 -7.884) 8.768 12.105 ( 8.506 2.000 9.206) 12.693 12.792 ( -0.988 -0.019 1.933) 2.171 13.006 ( -2.728 -1.076 -7.402) 7.962 13.738 ( -5.334 3.568 5.339) 8.348 13.890 ( -1.354 3.596 -0.298) 3.854 14.404 ( -10.999 -1.893 1.654) 11.283 15.038 ( 10.560 0.873 -6.723) 12.549 15.371 ( -2.855 -3.704 0.862) 4.755 15.436 ( 1.047 -0.902 -1.487) 2.030 16.700 ( -7.564 -3.016 -3.656) 8.926 16.798 ( 3.977 0.498 2.900) 4.947 17.124 ( 0.871 2.333 10.662) 10.949 17.448 ( 4.787 -3.662 -4.208) 7.351 18.616 ( 3.728 6.362 4.396) 8.585 18.721 ( -0.274 2.992 -7.583) 8.156 ======================= Grid point 386 (198/260) ======================= q-point: (-0.30 0.12 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 400 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.929 ( -15.681 -9.645 11.280) 21.591 2.306 ( -8.545 2.946 12.581) 15.491 2.747 ( 3.916 -10.682 1.326) 11.454 2.838 ( 4.980 -4.200 -0.221) 6.518 4.012 ( -3.585 1.596 5.414) 6.687 4.347 ( -1.003 4.249 11.831) 12.611 4.377 ( 6.695 4.555 6.021) 10.090 4.663 ( -1.498 6.451 -9.473) 11.558 5.526 ( -6.524 4.768 4.508) 9.253 5.995 ( 0.677 -1.565 -1.355) 2.178 6.258 ( -2.461 1.134 0.026) 2.710 6.546 ( -3.874 0.282 6.971) 7.980 6.756 ( 1.412 -2.170 -5.079) 5.701 6.908 ( -2.729 5.322 -5.945) 8.433 7.008 ( 6.403 -8.070 -0.964) 10.347 7.264 ( 3.898 2.643 8.328) 9.567 7.497 ( -3.110 1.441 -3.386) 4.818 7.640 ( 4.331 8.510 2.097) 9.776 7.704 ( -0.480 2.707 -1.319) 3.049 7.986 ( 1.970 10.613 -3.835) 11.455 8.356 ( 4.548 1.522 -2.325) 5.330 8.440 ( 6.226 1.821 6.193) 8.968 9.373 ( -0.867 -3.937 5.332) 6.684 9.470 ( 0.163 -0.166 -0.630) 0.672 9.697 ( 0.986 -1.151 -14.296) 14.376 9.803 ( 7.431 1.275 2.539) 7.956 10.384 ( 5.713 -1.971 5.034) 7.866 10.629 ( -0.161 -1.761 0.812) 1.946 10.681 ( 1.916 -0.864 -3.689) 4.246 10.841 ( 3.668 -1.993 -1.899) 4.586 11.284 ( 2.199 -7.413 -3.551) 8.509 11.529 ( 5.877 -3.763 3.077) 7.626 11.991 ( 1.803 1.590 -5.680) 6.168 12.315 ( 6.841 -3.369 7.932) 11.004 12.747 ( -4.290 -1.838 -0.461) 4.689 12.863 ( -6.654 1.486 -8.119) 10.602 13.619 ( -8.838 1.045 3.704) 9.640 13.859 ( -3.560 5.644 1.074) 6.759 14.183 ( -9.859 -1.376 -3.076) 10.419 15.087 ( -0.533 -3.489 -11.374) 11.909 15.333 ( 1.118 0.618 0.388) 1.336 15.502 ( 3.741 -0.260 3.469) 5.108 16.507 ( -9.845 -4.989 -2.853) 11.400 16.749 ( -7.451 2.603 -8.639) 11.702 17.252 ( 6.381 0.501 10.918) 12.656 17.693 ( 17.350 -5.768 8.982) 20.371 18.607 ( -0.719 0.551 -5.742) 5.813 18.808 ( 6.451 10.360 4.197) 12.906 ======================= Grid point 387 (199/260) ======================= q-point: (-0.20 0.12 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 400 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.723 ( -13.539 -8.526 15.510) 22.283 2.187 ( -11.516 8.732 11.551) 18.501 2.818 ( 3.213 -7.674 1.130) 8.395 2.938 ( 3.283 -4.290 2.648) 6.017 3.994 ( -2.989 2.719 8.542) 9.450 4.441 ( 2.995 3.885 11.955) 12.923 4.541 ( 5.039 6.339 0.352) 8.105 4.611 ( 1.896 5.598 2.555) 6.439 5.500 ( 0.545 2.820 5.580) 6.276 5.967 ( -1.582 -4.915 -3.406) 6.186 6.236 ( -0.861 3.163 1.896) 3.787 6.506 ( -4.268 0.262 7.547) 8.675 6.757 ( 1.292 0.345 -4.541) 4.734 6.830 ( -0.795 2.674 -7.278) 7.795 7.082 ( 2.832 -10.427 -5.272) 12.023 7.314 ( 0.775 -5.187 -7.182) 8.893 7.462 ( -3.869 6.135 14.359) 16.087 7.654 ( -0.904 6.953 2.293) 7.377 7.864 ( 11.562 7.251 4.606) 14.404 8.023 ( 4.352 10.516 -2.506) 11.654 8.456 ( 6.321 0.523 -0.286) 6.349 8.578 ( 4.109 3.250 5.562) 7.641 9.396 ( -2.510 -2.633 8.235) 9.002 9.513 ( 6.634 -4.063 -4.230) 8.855 9.625 ( 1.053 -0.768 -14.696) 14.754 9.915 ( 3.269 1.808 -0.825) 3.826 10.450 ( -0.438 -5.200 -0.585) 5.251 10.646 ( -4.472 0.979 -1.681) 4.877 10.706 ( 7.684 0.286 1.009) 7.756 10.925 ( 7.850 -0.783 -3.935) 8.816 11.348 ( 4.981 -4.330 0.323) 6.608 11.625 ( 3.553 1.132 -0.631) 3.782 12.045 ( 5.167 -0.876 -2.022) 5.617 12.411 ( -1.117 -5.045 -0.247) 5.173 12.614 ( -10.603 -5.230 5.015) 12.842 12.680 ( -5.332 4.839 -12.597) 14.510 13.475 ( -8.341 -1.937 5.533) 10.195 13.766 ( -4.615 6.206 2.129) 8.022 14.035 ( -3.620 -0.876 -4.383) 5.752 14.938 ( -6.578 -6.177 -9.603) 13.177 15.384 ( 4.087 2.934 -3.098) 5.909 15.613 ( 5.062 0.229 4.960) 7.091 16.261 ( -14.570 -7.134 -4.226) 16.764 16.499 ( -10.438 4.721 -8.114) 14.038 17.479 ( 8.836 1.727 12.560) 15.454 18.149 ( 21.910 -9.677 10.299) 26.072 18.565 ( 0.007 0.753 -6.155) 6.201 18.948 ( 4.858 10.750 3.776) 12.387 ======================= Grid point 388 (200/260) ======================= q-point: (-0.10 0.12 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 400 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.640 ( -4.746 -2.988 16.843) 17.752 2.025 ( -11.438 11.846 10.199) 19.370 2.887 ( 2.864 -4.120 1.431) 5.218 2.977 ( -0.110 -2.595 0.561) 2.657 3.993 ( -3.402 3.864 10.684) 11.860 4.499 ( 2.185 6.027 -7.677) 10.002 4.690 ( 8.918 4.431 12.188) 15.739 4.751 ( 4.436 3.951 9.873) 11.523 5.601 ( 5.843 -0.997 4.916) 7.701 5.912 ( -1.458 -6.015 -3.922) 7.327 6.239 ( -0.900 4.408 4.413) 6.302 6.491 ( -2.220 -1.303 7.748) 8.165 6.727 ( -1.088 4.462 -6.083) 7.623 6.792 ( 0.396 -0.318 -4.766) 4.793 7.068 ( -0.029 -10.569 -5.813) 12.062 7.225 ( -4.030 -7.485 -8.365) 11.926 7.503 ( -1.587 8.405 12.412) 15.074 7.678 ( 1.586 5.678 2.961) 6.598 8.070 ( 5.102 13.162 4.836) 14.922 8.167 ( 11.747 3.031 0.152) 12.133 8.574 ( 4.727 -0.580 0.869) 4.841 8.680 ( 4.524 4.073 3.537) 7.041 9.356 ( -5.928 -1.454 5.639) 8.310 9.549 ( 1.265 -2.563 -14.537) 14.815 9.666 ( 9.437 -5.858 -2.584) 11.403 9.928 ( -0.220 3.145 -1.726) 3.595 10.394 ( -3.357 -3.854 -3.984) 6.480 10.509 ( -7.121 2.143 -2.953) 8.001 10.895 ( 9.872 0.136 1.634) 10.008 11.081 ( 9.653 0.033 -3.818) 10.381 11.452 ( 4.447 -2.790 1.633) 5.498 11.666 ( 1.372 4.480 -1.357) 4.878 12.113 ( 1.329 -3.576 -1.658) 4.160 12.295 ( -7.220 0.561 -0.513) 7.260 12.433 ( -11.145 -2.703 2.277) 11.692 12.476 ( -5.574 1.337 -14.004) 15.132 13.389 ( -5.368 -3.518 9.492) 11.459 13.801 ( 6.472 2.059 3.148) 7.486 13.950 ( -3.395 -0.758 -1.947) 3.987 14.742 ( -7.176 -6.516 -9.639) 13.670 15.447 ( 4.559 2.451 -3.001) 5.983 15.744 ( 2.950 0.174 3.988) 4.963 15.913 ( -14.911 -4.050 -3.474) 15.837 16.287 ( -8.023 3.415 -4.350) 9.744 17.729 ( 8.428 2.819 13.271) 15.972 18.515 ( -1.000 -0.423 -5.533) 5.639 18.597 ( 16.081 -8.920 7.335) 19.798 19.031 ( 2.967 8.149 -0.147) 8.674 ======================= Grid point 389 (201/260) ======================= q-point: ( 0.00 0.25 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 404 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.873 ( 6.225 9.659 12.313) 16.842 2.136 ( -3.798 10.339 2.830) 11.372 2.877 ( 1.029 -2.090 4.156) 4.764 2.973 ( 2.833 -0.649 0.455) 2.942 4.126 ( -2.968 7.624 13.496) 15.782 4.646 ( 1.687 8.749 -9.161) 12.779 4.924 ( 0.948 3.831 6.921) 7.967 5.023 ( 8.523 3.467 5.200) 10.569 5.615 ( 2.182 -7.244 1.490) 7.711 5.738 ( 0.168 -6.556 -6.135) 8.980 6.338 ( -2.958 -4.910 7.014) 9.058 6.447 ( -0.293 3.667 8.817) 9.553 6.672 ( 1.420 -11.084 -7.558) 13.491 6.799 ( -3.132 2.117 0.938) 3.895 6.874 ( -2.610 4.426 -2.513) 5.720 7.005 ( -2.277 -1.042 -6.893) 7.334 7.703 ( 0.672 5.719 8.171) 9.997 7.893 ( 3.394 8.225 0.990) 8.952 8.373 ( 3.429 4.325 3.455) 6.512 8.440 ( 2.694 10.823 -0.325) 11.158 8.712 ( 7.639 3.617 -2.745) 8.886 8.845 ( 2.429 3.836 -2.525) 5.195 9.230 ( -6.484 -0.528 2.966) 7.150 9.419 ( 2.782 -4.914 -11.105) 12.459 9.698 ( 6.476 -6.436 -0.900) 9.174 9.832 ( -5.463 -6.761 -6.066) 10.599 10.333 ( 0.060 1.246 2.602) 2.886 10.435 ( -4.292 5.324 -2.032) 7.134 11.025 ( -1.449 -0.547 2.010) 2.537 11.166 ( 3.640 -0.640 -4.427) 5.767 11.571 ( 8.631 1.114 2.570) 9.074 11.694 ( -2.363 -0.979 -2.424) 3.524 12.000 ( -5.078 -1.538 4.818) 7.167 12.149 ( -9.087 -2.677 2.991) 9.934 12.343 ( -4.874 5.062 -4.688) 8.448 12.380 ( 6.984 0.708 -8.695) 11.175 13.320 ( -0.685 -2.279 7.961) 8.309 13.735 ( -1.179 -6.382 -10.636) 12.460 14.045 ( 6.192 -0.357 8.761) 10.734 14.411 ( -4.086 -7.986 -8.575) 12.410 15.380 ( -15.329 -2.081 9.302) 18.051 15.688 ( 5.633 3.179 -6.180) 8.946 15.953 ( 7.323 0.134 5.396) 9.098 16.178 ( -6.100 2.822 -5.799) 8.877 18.032 ( 5.023 4.958 13.461) 15.199 18.448 ( -1.989 -0.992 -1.263) 2.557 18.737 ( 2.366 0.169 3.953) 4.610 19.086 ( 1.537 -2.147 -8.930) 9.312 ======================= Grid point 390 (202/260) ======================= q-point: ( 0.10 0.25 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 400 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.956 ( -2.365 8.841 6.051) 10.971 2.218 ( 8.935 7.117 2.086) 11.612 2.896 ( 0.324 0.606 -0.295) 0.748 3.019 ( 1.352 -1.091 -0.546) 1.821 4.155 ( -2.984 7.296 14.282) 16.313 4.601 ( -0.480 7.312 -9.554) 12.040 4.939 ( -1.515 3.445 1.846) 4.192 5.152 ( 2.811 2.032 -2.744) 4.423 5.661 ( 2.498 -5.891 -1.702) 6.621 5.738 ( 3.513 -7.856 -3.603) 9.330 6.315 ( -3.424 -9.621 6.612) 12.166 6.511 ( -1.183 4.480 11.202) 12.122 6.656 ( -0.142 -12.428 -5.395) 13.550 6.702 ( -4.973 3.687 4.290) 7.532 6.817 ( 0.456 6.554 -7.716) 10.134 6.986 ( 1.855 2.788 -1.427) 3.641 7.764 ( 2.157 6.013 2.671) 6.924 7.962 ( 2.779 8.879 1.277) 9.391 8.386 ( -2.443 12.232 -2.085) 12.647 8.476 ( 0.906 2.514 1.295) 2.970 8.800 ( -1.881 2.635 -12.198) 12.620 8.845 ( 6.871 2.121 -3.920) 8.190 9.130 ( -5.188 -0.443 2.647) 5.841 9.441 ( 3.633 -4.166 -3.971) 6.806 9.598 ( -9.167 -6.668 -4.494) 12.194 9.856 ( 5.609 -7.126 -1.934) 9.273 10.307 ( -2.791 4.731 1.944) 5.827 10.449 ( 3.818 2.125 3.060) 5.334 10.899 ( -9.616 -2.029 0.045) 9.828 11.106 ( -7.826 2.083 -2.565) 8.495 11.553 ( -9.705 -2.506 -3.186) 10.518 11.721 ( 1.954 5.909 0.103) 6.225 11.972 ( -3.342 4.079 4.983) 7.255 12.091 ( 6.469 -7.484 2.894) 10.307 12.254 ( -0.676 -1.567 0.708) 1.847 12.520 ( 7.835 0.283 -4.505) 9.043 13.396 ( 2.973 -2.331 7.807) 8.673 13.665 ( 1.468 -5.027 -7.901) 9.479 14.224 ( 4.671 -4.274 3.930) 7.452 14.335 ( 3.332 -4.138 -6.370) 8.294 15.174 ( -11.863 0.107 12.981) 17.585 15.809 ( 7.593 1.107 -2.422) 8.047 16.030 ( -1.896 3.388 -3.303) 5.097 16.157 ( 7.707 0.707 2.752) 8.214 18.135 ( -3.302 3.113 8.673) 9.788 18.374 ( -2.165 3.164 -4.294) 5.757 18.593 ( -14.131 -0.590 -0.456) 14.151 19.162 ( 7.303 -3.423 -5.784) 9.925 ======================= Grid point 391 (203/260) ======================= q-point: ( 0.20 0.25 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 404 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.964 ( 1.054 2.992 2.945) 4.329 2.375 ( 5.599 2.405 -0.641) 6.127 2.897 ( 0.898 1.819 -3.517) 4.060 2.999 ( -2.715 -3.021 -2.680) 4.866 4.184 ( -3.267 5.824 14.022) 15.531 4.506 ( -3.432 5.766 -8.468) 10.804 4.919 ( 0.507 2.859 -3.696) 4.700 5.094 ( -4.086 1.455 -9.276) 10.240 5.714 ( 4.865 -2.811 -1.518) 5.820 5.799 ( 4.193 -5.218 -4.566) 8.103 6.289 ( -4.177 -9.863 8.406) 13.616 6.510 ( -3.772 0.357 7.954) 8.810 6.589 ( -3.839 -1.432 5.235) 6.648 6.737 ( 4.455 -1.239 -3.654) 5.894 6.797 ( 1.645 4.107 -5.002) 6.678 7.035 ( 3.477 5.661 0.712) 6.682 7.819 ( 2.861 5.761 -0.719) 6.472 8.007 ( 1.139 9.578 0.400) 9.653 8.271 ( -6.366 12.803 -5.841) 15.445 8.485 ( -0.649 4.371 -0.569) 4.455 8.623 ( -6.170 1.171 -15.128) 16.380 8.891 ( -0.617 3.606 -7.136) 8.019 9.085 ( -1.299 -4.765 4.204) 6.486 9.326 ( -8.913 -6.445 -1.382) 11.086 9.599 ( 7.084 -2.795 -1.247) 7.717 9.908 ( 1.666 -4.073 -3.755) 5.785 10.302 ( 0.354 2.101 3.193) 3.839 10.532 ( 0.270 -1.935 5.435) 5.776 10.717 ( -8.547 -1.900 0.252) 8.759 10.907 ( -8.858 2.553 -2.425) 9.532 11.326 ( -11.001 -2.305 -0.918) 11.277 11.639 ( -7.845 6.838 1.013) 10.456 11.928 ( -4.397 1.553 2.095) 5.112 12.304 ( 7.350 -2.119 8.390) 11.354 12.375 ( 13.660 -7.597 -1.492) 15.701 12.583 ( 0.899 -3.171 -2.180) 3.952 13.478 ( 1.308 -3.885 3.975) 5.710 13.769 ( 13.008 -0.971 -2.269) 13.240 14.238 ( 1.110 0.129 -5.365) 5.480 14.458 ( 5.751 -4.926 3.691) 8.424 15.101 ( -4.444 1.797 13.632) 14.450 15.820 ( -3.433 -0.918 -4.493) 5.729 16.114 ( 10.649 3.106 0.577) 11.108 16.333 ( 7.639 1.565 4.412) 8.959 17.965 ( -14.521 -0.065 -4.091) 15.086 18.245 ( -13.394 -1.057 0.006) 13.435 18.420 ( 0.542 4.939 -0.750) 5.025 19.214 ( 1.504 -0.680 -5.956) 6.180 ======================= Grid point 392 (204/260) ======================= q-point: ( 0.30 0.25 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 400 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.033 ( 4.030 -4.215 2.315) 6.275 2.414 ( -0.114 -2.735 -2.798) 3.915 2.870 ( -3.561 -1.648 -4.595) 6.042 2.883 ( -3.931 -0.872 -6.714) 7.828 4.201 ( -3.793 4.138 12.750) 13.931 4.381 ( -4.050 4.901 -6.120) 8.825 4.897 ( -3.185 3.589 -10.312) 11.374 4.931 ( -1.379 1.598 -9.630) 9.859 5.822 ( 4.671 0.895 -4.261) 6.386 5.841 ( 5.149 -4.509 -0.475) 6.860 6.266 ( -3.922 -6.987 9.794) 12.654 6.499 ( -1.207 2.417 3.349) 4.303 6.581 ( -2.174 0.309 10.925) 11.144 6.772 ( 0.909 2.132 -2.858) 3.679 6.823 ( 4.214 -2.530 -5.129) 7.104 7.130 ( 6.061 5.061 0.082) 7.896 7.861 ( 2.400 4.843 -2.727) 6.054 7.993 ( -3.830 12.121 -0.101) 12.712 8.103 ( -4.420 10.201 -9.415) 14.569 8.368 ( -6.381 2.780 -14.075) 15.703 8.473 ( -3.724 7.146 -2.240) 8.364 8.748 ( -7.227 -0.500 -8.225) 10.960 9.099 ( -0.760 -6.220 4.835) 7.915 9.236 ( -1.594 -0.158 5.201) 5.442 9.719 ( 6.069 -3.763 -4.100) 8.234 9.890 ( -0.554 -1.984 -4.593) 5.034 10.337 ( 0.525 -2.962 3.496) 4.612 10.467 ( -9.248 -4.813 5.567) 11.819 10.604 ( -3.837 -2.588 2.038) 5.057 10.784 ( -2.685 1.786 -4.017) 5.151 11.149 ( -6.491 -1.647 -1.351) 6.832 11.499 ( -7.542 3.066 3.210) 8.751 11.860 ( -3.088 3.121 3.607) 5.682 12.466 ( -0.138 0.239 2.204) 2.221 12.504 ( 2.684 -7.908 -0.142) 8.353 12.682 ( 12.368 -6.892 0.538) 14.169 13.541 ( 3.168 -1.576 4.659) 5.850 14.069 ( 16.443 -2.218 1.215) 16.637 14.232 ( 1.571 5.906 -4.449) 7.559 14.561 ( 1.941 -3.771 6.282) 7.580 15.146 ( 0.846 0.742 9.038) 9.108 15.708 ( -4.423 -1.257 -5.457) 7.136 16.336 ( 9.994 0.847 2.637) 10.370 16.507 ( 7.232 3.056 6.609) 10.262 17.604 ( -17.869 -3.797 -6.045) 19.243 17.986 ( -11.159 1.282 -5.437) 12.479 18.460 ( 2.301 5.581 1.685) 6.268 19.152 ( -3.284 1.012 -7.425) 8.181 ======================= Grid point 393 (205/260) ======================= q-point: ( 0.40 0.25 -0.60) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 404 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.129 ( 3.430 -10.002 3.708) 11.205 2.359 ( -2.864 -6.861 -3.491) 8.214 2.668 ( -10.900 -3.061 -4.298) 12.110 2.811 ( -1.341 -0.308 -8.927) 9.032 4.185 ( -4.431 3.289 8.063) 9.771 4.300 ( -2.082 4.626 -0.733) 5.126 4.694 ( -7.767 4.118 -8.792) 12.433 4.913 ( 3.017 2.149 -11.640) 12.215 5.857 ( 2.266 1.048 -0.605) 2.569 5.950 ( 3.420 -1.377 -0.570) 3.730 6.275 ( -0.294 -2.605 8.642) 9.031 6.499 ( -0.584 2.064 1.112) 2.416 6.637 ( 0.266 1.716 12.774) 12.891 6.758 ( -0.061 -1.434 -2.608) 2.976 6.861 ( 2.300 1.154 -3.454) 4.307 7.265 ( 8.096 1.416 -1.458) 8.347 7.798 ( -7.254 8.361 -8.676) 14.064 7.910 ( -0.622 8.649 -3.242) 9.258 8.021 ( 0.146 6.636 -6.640) 9.389 8.185 ( -4.509 6.777 -7.896) 11.340 8.362 ( -6.165 6.290 -1.738) 8.977 8.570 ( -5.484 0.476 -7.873) 9.606 9.142 ( 1.467 -4.769 8.080) 9.496 9.291 ( 2.736 1.819 7.223) 7.936 9.749 ( 0.290 -3.011 -7.992) 8.545 9.841 ( -0.926 -1.771 -4.925) 5.315 10.275 ( -9.446 -3.211 8.127) 12.868 10.428 ( 2.835 -8.040 1.880) 8.730 10.579 ( -0.522 -4.473 2.920) 5.367 10.708 ( -1.136 0.286 -8.749) 8.827 11.055 ( -3.279 0.007 1.440) 3.581 11.383 ( -6.196 -5.260 0.761) 8.164 11.885 ( 2.613 6.416 5.668) 8.951 12.329 ( -6.916 -4.692 -5.728) 10.132 12.637 ( 3.619 -2.724 8.460) 9.596 12.891 ( 9.470 -5.842 -3.595) 11.693 13.657 ( 4.560 1.821 7.630) 9.074 14.183 ( -1.552 4.530 -4.055) 6.274 14.402 ( 10.201 -0.522 7.194) 12.493 14.636 ( 4.877 -0.822 2.046) 5.352 15.219 ( 2.355 -1.489 3.389) 4.387 15.586 ( -4.638 -2.503 -5.815) 7.848 16.510 ( 6.232 0.823 3.993) 7.447 16.702 ( 7.904 3.389 8.003) 11.748 17.249 ( -15.247 -5.092 -3.067) 16.364 17.747 ( -9.171 2.133 -8.599) 12.751 18.530 ( 4.137 6.264 1.761) 7.711 19.014 ( -5.341 1.444 -8.612) 10.236 ======================= Grid point 394 (206/260) ======================= q-point: (-0.50 0.25 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 400 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.157 ( -6.060 -12.655 5.219) 14.970 2.313 ( 2.234 -10.651 -3.004) 11.290 2.445 ( -9.775 -0.156 1.783) 9.938 2.730 ( -0.923 -3.419 -8.737) 9.428 4.148 ( -4.087 2.945 6.359) 8.112 4.277 ( 0.318 4.617 -0.639) 4.672 4.526 ( -6.089 5.020 -0.807) 7.933 4.889 ( 1.991 2.611 -11.812) 12.260 5.868 ( -4.103 -0.054 4.012) 5.739 5.969 ( 1.596 3.438 -2.171) 4.368 6.346 ( 0.829 -0.584 6.005) 6.090 6.489 ( 0.135 2.998 0.620) 3.064 6.724 ( 0.573 -2.772 4.624) 5.421 6.759 ( 2.711 -1.186 -0.314) 2.976 6.899 ( 2.806 3.936 3.381) 5.899 7.384 ( 4.133 1.214 -5.677) 7.126 7.612 ( -3.932 7.639 -6.184) 10.586 7.815 ( -4.942 2.277 -9.790) 11.200 8.001 ( -2.811 11.197 -0.001) 11.545 8.133 ( 4.108 8.372 -4.865) 10.518 8.256 ( -3.724 2.905 2.392) 5.294 8.446 ( -2.501 3.976 -6.804) 8.268 9.230 ( 0.997 -4.724 9.624) 10.767 9.435 ( 7.627 2.737 6.803) 10.580 9.646 ( -5.149 -1.744 -6.487) 8.464 9.794 ( 0.474 -1.866 -9.635) 9.826 10.187 ( -4.295 -1.555 8.845) 9.955 10.507 ( 3.495 -7.540 1.663) 8.476 10.606 ( 2.042 -7.146 -0.211) 7.435 10.653 ( 1.577 -0.693 -8.999) 9.162 11.049 ( 0.149 -2.332 5.914) 6.359 11.271 ( -3.904 -8.357 -3.188) 9.759 12.003 ( 4.955 4.717 5.994) 9.095 12.173 ( -5.541 -2.388 -4.473) 7.511 12.726 ( 0.469 -3.499 6.719) 7.590 12.997 ( 4.853 -3.374 -6.419) 8.726 13.793 ( 3.547 4.938 9.068) 10.918 14.089 ( -5.259 6.511 -3.794) 9.189 14.482 ( -5.912 -3.481 9.469) 11.694 14.841 ( 15.148 1.160 -5.222) 16.065 15.277 ( 2.066 -2.859 1.578) 3.864 15.458 ( -4.514 -3.883 -5.913) 8.391 16.650 ( 5.315 1.032 6.071) 8.135 16.828 ( -2.015 1.119 -2.316) 3.268 17.052 ( -2.806 -2.652 11.462) 12.095 17.527 ( -7.517 1.067 -9.936) 12.505 18.645 ( 6.442 7.439 1.725) 9.991 18.860 ( -4.398 1.363 -8.770) 9.905 ======================= Grid point 395 (207/260) ======================= q-point: (-0.40 0.25 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 404 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.978 ( -13.385 -9.801 5.106) 17.358 2.348 ( -4.402 -0.768 10.468) 11.382 2.389 ( 4.489 -12.808 0.993) 13.608 2.686 ( 1.471 -5.456 -5.431) 7.838 4.096 ( -4.427 2.268 4.467) 6.685 4.332 ( 5.141 5.403 1.814) 7.676 4.452 ( -3.906 5.771 7.191) 10.014 4.843 ( 0.511 3.278 -10.720) 11.222 5.760 ( -8.435 3.542 4.476) 10.185 5.990 ( 0.905 1.534 -1.943) 2.636 6.342 ( -2.869 2.641 3.531) 5.260 6.536 ( 1.896 1.161 3.332) 4.006 6.719 ( -0.347 -2.394 -2.332) 3.360 6.824 ( 4.142 -2.432 -4.389) 6.506 7.005 ( 1.736 1.833 9.726) 10.049 7.321 ( -1.266 6.475 -9.840) 11.847 7.631 ( 2.524 4.380 1.859) 5.386 7.652 ( -3.066 0.786 -7.696) 8.322 7.922 ( -3.605 9.939 -1.744) 10.715 8.166 ( -0.557 8.240 1.614) 8.415 8.321 ( 7.641 3.730 2.782) 8.946 8.395 ( 1.213 5.488 -5.077) 7.574 9.285 ( -1.297 -3.808 8.898) 9.765 9.511 ( -4.211 -1.431 -4.793) 6.538 9.636 ( 9.015 1.325 1.787) 9.286 9.742 ( 1.098 -1.267 -10.446) 10.579 10.226 ( 2.291 -1.201 8.254) 8.650 10.560 ( 0.750 -4.617 2.080) 5.119 10.635 ( 3.691 -1.720 -9.621) 10.447 10.682 ( 4.949 -7.183 -0.995) 8.779 11.085 ( -0.536 -8.291 3.231) 8.914 11.264 ( 5.024 -5.773 1.676) 7.835 12.064 ( -2.469 0.121 -3.278) 4.105 12.136 ( 4.383 0.825 5.257) 6.894 12.730 ( -3.725 -5.701 4.075) 7.936 13.006 ( 1.322 0.557 -9.115) 9.228 13.850 ( -5.612 7.497 4.819) 10.532 13.982 ( -1.396 5.160 0.260) 5.352 14.354 ( -10.576 -2.999 2.811) 11.347 15.048 ( 8.615 -0.197 -10.921) 13.911 15.292 ( -1.363 -3.741 2.877) 4.912 15.402 ( 2.705 -2.239 -1.319) 3.751 16.629 ( -10.762 -3.544 -1.409) 11.417 16.811 ( 4.797 0.815 3.201) 5.824 17.181 ( 1.736 3.077 10.756) 11.321 17.383 ( 0.899 -2.484 -2.332) 3.524 18.701 ( -2.179 2.304 -5.289) 6.167 18.842 ( 8.277 7.752 -1.117) 11.395 ======================= Grid point 396 (208/260) ======================= q-point: (-0.30 0.25 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 400 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.763 ( -13.087 -5.543 10.669) 17.771 2.347 ( -3.946 0.534 11.740) 12.397 2.498 ( 5.311 -12.491 3.962) 14.139 2.730 ( 4.358 -6.207 0.618) 7.609 4.057 ( -2.690 2.842 6.205) 7.336 4.455 ( -0.027 6.019 10.179) 11.826 4.486 ( 6.491 5.828 5.886) 10.523 4.782 ( -0.047 4.505 -9.302) 10.336 5.634 ( -7.168 5.328 5.302) 10.386 5.962 ( -1.934 -1.011 -4.146) 4.685 6.318 ( -1.790 4.329 3.879) 6.082 6.558 ( -2.799 0.906 5.422) 6.168 6.697 ( 0.609 -5.371 -4.731) 7.183 6.855 ( 2.443 -4.147 -6.487) 8.077 7.024 ( -1.800 4.663 0.069) 4.999 7.270 ( -1.072 -0.624 -4.378) 4.551 7.594 ( 0.502 6.469 2.456) 6.937 7.735 ( 4.174 2.661 1.244) 5.104 7.880 ( 1.287 11.592 1.283) 11.734 8.179 ( 0.998 7.299 2.825) 7.891 8.416 ( 3.528 4.824 -1.329) 6.123 8.507 ( 8.703 5.396 1.483) 10.346 9.296 ( -1.297 -3.459 4.728) 6.000 9.443 ( -1.144 -2.546 -1.298) 3.079 9.671 ( 1.623 -1.177 -14.217) 14.358 9.821 ( 7.252 0.215 0.201) 7.258 10.326 ( 2.097 -3.486 5.137) 6.553 10.596 ( 3.322 -1.239 0.983) 3.679 10.657 ( 3.377 -1.490 -5.441) 6.575 10.782 ( 5.668 -3.939 -1.692) 7.107 11.119 ( 3.966 -8.598 0.866) 9.508 11.427 ( 7.751 -5.065 6.220) 11.154 12.023 ( 0.709 1.371 -3.927) 4.219 12.247 ( 3.390 -3.288 5.406) 7.178 12.635 ( -7.866 -7.594 2.303) 11.174 12.938 ( -1.576 4.162 -12.017) 12.814 13.677 ( -11.061 4.910 0.211) 12.104 13.992 ( -2.506 6.994 4.050) 8.462 14.143 ( -9.638 -2.706 -3.190) 10.507 14.980 ( -5.733 -6.580 -10.232) 13.449 15.362 ( 6.379 2.046 -2.131) 7.030 15.492 ( 4.689 -0.746 4.149) 6.305 16.393 ( -13.218 -5.853 0.196) 14.457 16.801 ( -6.128 2.405 -6.820) 9.479 17.270 ( 6.953 1.229 8.628) 11.149 17.592 ( 12.761 -3.860 12.925) 18.569 18.631 ( -0.836 1.520 -5.611) 5.873 19.014 ( 8.833 9.318 -0.721) 12.859 ======================= Grid point 397 (209/260) ======================= q-point: (-0.20 0.25 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 404 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.639 ( -7.315 0.909 14.967) 16.683 2.317 ( -5.772 3.504 8.444) 10.811 2.643 ( 5.653 -8.553 7.592) 12.757 2.832 ( 4.129 -5.809 3.507) 7.943 4.068 ( -1.567 4.446 9.554) 10.654 4.548 ( 3.336 6.278 10.334) 12.543 4.663 ( 6.944 5.629 6.074) 10.807 4.741 ( 1.117 6.075 -5.130) 8.029 5.565 ( -3.380 3.190 5.584) 7.265 5.878 ( -2.768 -2.869 -6.562) 7.678 6.318 ( -1.300 4.527 5.254) 7.056 6.508 ( -5.252 -0.159 5.351) 7.500 6.688 ( 1.936 -10.448 -6.125) 12.265 6.846 ( 0.517 -0.066 -4.503) 4.533 6.978 ( -1.144 3.248 -4.959) 6.037 7.219 ( -1.353 -4.354 -5.119) 6.855 7.615 ( -3.066 8.345 11.347) 14.415 7.782 ( 2.185 4.788 -1.509) 5.475 8.030 ( 9.137 8.742 6.659) 14.291 8.249 ( 4.794 10.968 1.386) 12.050 8.493 ( 4.724 3.555 -0.194) 5.915 8.663 ( 6.036 5.241 2.464) 8.365 9.319 ( 0.954 -5.029 3.368) 6.127 9.424 ( -0.085 -4.340 -2.083) 4.814 9.612 ( 1.797 -0.515 -14.266) 14.388 9.928 ( 4.255 -1.180 -2.951) 5.310 10.351 ( -0.907 -3.774 1.385) 4.121 10.654 ( -1.889 -0.050 -1.952) 2.717 10.721 ( 8.150 1.258 0.713) 8.277 10.899 ( 8.840 -1.852 -2.890) 9.484 11.247 ( 7.349 -6.240 2.677) 10.005 11.602 ( 5.928 -2.559 5.536) 8.505 12.037 ( 2.549 -0.074 -3.307) 4.176 12.312 ( 0.465 -4.257 0.853) 4.366 12.479 ( -9.374 -7.646 3.911) 12.713 12.794 ( -5.201 5.841 -13.734) 15.805 13.471 ( -10.107 2.064 1.627) 10.443 13.873 ( -6.950 2.911 -2.515) 7.944 14.025 ( -3.333 0.867 -0.266) 3.454 14.780 ( -8.355 -8.913 -8.275) 14.756 15.458 ( 5.328 4.079 -4.240) 7.937 15.617 ( 5.211 0.067 5.203) 7.364 16.116 ( -15.944 -7.061 0.783) 17.456 16.581 ( -9.653 3.488 -8.590) 13.384 17.526 ( 10.898 2.840 12.756) 17.016 17.967 ( 16.587 -7.812 14.288) 23.245 18.599 ( 1.005 2.210 -5.722) 6.216 19.142 ( 4.974 8.140 -2.704) 9.915 ======================= Grid point 398 (210/260) ======================= q-point: (-0.10 0.25 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 400 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.685 ( 2.206 7.241 15.250) 17.025 2.232 ( -7.334 8.081 5.814) 12.365 2.789 ( 4.196 -4.994 7.260) 9.760 2.915 ( 2.568 -3.251 2.445) 4.811 4.100 ( -2.350 6.456 11.880) 13.724 4.649 ( 3.050 8.289 -4.453) 9.891 4.795 ( 6.756 5.352 5.982) 10.491 4.840 ( 4.916 4.268 9.405) 11.439 5.570 ( 0.379 -2.173 4.097) 4.654 5.792 ( -1.488 -4.867 -6.929) 8.598 6.332 ( -1.386 2.938 7.214) 7.911 6.447 ( -3.875 -1.603 5.158) 6.648 6.687 ( 1.924 -11.876 -7.034) 13.936 6.827 ( -0.065 3.884 -2.845) 4.815 6.926 ( -1.431 0.895 -3.290) 3.697 7.129 ( -4.222 -3.005 -6.943) 8.664 7.643 ( -1.663 6.451 13.041) 14.644 7.827 ( 3.130 7.166 -0.488) 7.835 8.234 ( 7.362 3.459 5.895) 10.045 8.361 ( 5.410 15.190 0.443) 16.131 8.592 ( 6.007 2.587 -1.127) 6.637 8.775 ( 4.100 5.419 2.494) 7.239 9.320 ( -4.749 -2.300 5.290) 7.472 9.431 ( 4.173 -8.519 -10.407) 14.082 9.592 ( 4.950 -2.022 -8.638) 10.159 9.937 ( -1.080 -2.990 -4.337) 5.377 10.332 ( -1.196 -1.199 0.626) 1.806 10.559 ( -5.817 2.673 -2.258) 6.788 10.906 ( 9.734 1.087 0.901) 9.836 11.067 ( 9.056 -1.514 -2.984) 9.655 11.405 ( 6.806 -2.777 3.535) 8.157 11.704 ( 1.475 -0.487 3.111) 3.477 12.052 ( -0.281 -2.658 -1.391) 3.013 12.275 ( -2.914 -1.254 -1.407) 3.470 12.347 ( -5.720 -4.576 1.290) 7.438 12.573 ( -8.697 6.419 -12.322) 16.391 13.336 ( -5.667 -0.882 5.369) 7.856 13.791 ( 1.306 -3.494 -8.379) 9.172 13.966 ( -3.205 2.527 5.552) 6.890 14.575 ( -7.356 -9.513 -7.885) 14.379 15.508 ( 0.870 3.293 -1.099) 3.579 15.739 ( 0.079 -0.971 1.670) 1.933 15.833 ( -7.540 -3.205 2.566) 8.586 16.357 ( -8.406 3.364 -6.679) 11.250 17.807 ( 9.117 4.822 13.908) 17.315 18.352 ( 11.410 -9.852 13.337) 20.128 18.605 ( 5.037 3.518 -6.988) 9.305 19.157 ( -0.801 4.519 -5.543) 7.196 ======================= Grid point 399 (211/260) ======================= q-point: ( 0.00 0.38 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 400 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.081 ( 6.183 10.307 7.148) 13.984 2.293 ( -0.080 4.187 -1.101) 4.330 2.856 ( 2.101 0.423 8.777) 9.035 2.950 ( 2.086 -1.763 4.532) 5.292 4.274 ( -2.873 6.280 13.949) 15.565 4.808 ( 0.030 6.613 -7.074) 9.684 4.993 ( 2.916 3.009 4.946) 6.482 5.074 ( 6.760 1.267 3.674) 7.797 5.481 ( -0.523 -5.334 1.083) 5.468 5.632 ( -1.300 -3.968 -6.814) 7.992 6.215 ( -3.261 -4.542 1.184) 5.716 6.377 ( 1.619 -10.335 -5.716) 11.921 6.593 ( -2.911 2.947 12.495) 13.164 6.849 ( -4.177 3.723 2.532) 6.142 6.976 ( -2.420 1.507 -1.694) 3.316 7.012 ( 2.524 2.456 -3.095) 4.688 7.797 ( 0.790 3.762 4.724) 6.090 8.005 ( 5.737 2.589 -2.178) 6.660 8.430 ( 3.781 2.794 7.907) 9.199 8.666 ( 0.232 7.968 -4.000) 8.918 8.795 ( 5.625 6.534 -2.579) 8.999 8.960 ( 0.985 7.365 -4.610) 8.744 9.226 ( -3.463 -0.777 2.355) 4.259 9.290 ( 6.038 -7.765 -5.460) 11.250 9.564 ( 5.014 -6.029 -6.574) 10.233 9.670 ( -8.270 -8.028 -7.140) 13.558 10.379 ( -0.446 2.694 6.269) 6.838 10.534 ( -2.593 3.942 -1.616) 4.988 11.013 ( -4.395 -0.708 1.840) 4.817 11.161 ( 7.377 0.241 -4.947) 8.885 11.542 ( 9.763 -3.328 3.295) 10.828 11.668 ( -3.876 -1.493 -1.874) 4.557 11.927 ( -3.459 -3.702 9.088) 10.405 12.157 ( -8.311 2.264 4.171) 9.570 12.409 ( 8.333 1.721 -3.996) 9.400 12.438 ( -8.695 3.456 -9.502) 13.336 13.317 ( -0.127 2.443 1.231) 2.739 13.591 ( -0.088 -7.720 -10.653) 13.157 14.038 ( 2.629 -0.290 5.250) 5.879 14.262 ( -2.501 -6.111 -5.659) 8.696 15.352 ( -15.624 -0.854 12.701) 20.153 15.737 ( 6.295 1.694 -6.788) 9.412 15.957 ( 7.575 0.246 6.208) 9.797 16.226 ( -5.881 1.860 -7.263) 9.528 18.141 ( 4.098 5.782 13.691) 15.416 18.381 ( 0.891 -4.952 9.075) 10.376 18.791 ( 6.981 4.108 -4.338) 9.188 19.032 ( -5.403 -3.063 -10.928) 12.570 ======================= Grid point 400 (212/260) ======================= q-point: ( 0.10 0.38 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 400 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.139 ( -2.441 8.386 0.801) 8.771 2.343 ( 5.567 4.857 -1.667) 7.574 2.916 ( 0.485 0.907 3.021) 3.192 2.984 ( -0.601 -1.948 1.347) 2.443 4.288 ( -4.722 5.263 14.529) 16.158 4.731 ( -3.049 5.101 -7.575) 9.628 5.014 ( -1.672 4.014 0.268) 4.357 5.161 ( 0.680 -1.280 -1.948) 2.428 5.547 ( 7.191 -4.653 -0.361) 8.572 5.633 ( 4.278 -3.220 -2.893) 6.086 6.161 ( -3.444 -4.043 2.304) 5.789 6.375 ( 0.195 -11.695 -1.227) 11.761 6.578 ( -5.138 0.310 10.353) 11.562 6.793 ( -3.358 4.263 2.008) 5.787 6.942 ( 0.665 4.765 -1.227) 4.965 7.076 ( 4.849 4.819 -2.300) 7.213 7.845 ( 2.215 2.432 0.828) 3.392 8.097 ( 4.798 4.160 -1.522) 6.530 8.534 ( 2.605 4.245 5.444) 7.378 8.616 ( -2.102 7.671 -6.266) 10.125 8.815 ( -2.515 1.676 -6.664) 7.318 8.929 ( 2.314 4.829 -6.842) 8.688 9.159 ( -4.366 2.196 -0.804) 4.953 9.329 ( -4.765 -6.573 -4.513) 9.288 9.458 ( -1.181 -6.199 -1.955) 6.606 9.697 ( 8.100 -7.751 -3.060) 11.621 10.402 ( -1.456 3.529 5.562) 6.746 10.502 ( -0.303 3.392 0.578) 3.454 10.862 ( -10.012 -1.639 0.242) 10.148 11.150 ( -6.088 2.458 -3.009) 7.222 11.465 ( -11.643 -5.445 -2.763) 13.147 11.791 ( 11.073 -0.599 -0.625) 11.107 11.977 ( -3.758 0.155 5.348) 6.539 12.057 ( 1.929 1.393 8.092) 8.435 12.247 ( -6.487 1.020 -2.794) 7.137 12.519 ( 4.057 -0.449 -2.467) 4.769 13.361 ( 2.169 -1.061 2.658) 3.591 13.579 ( 6.470 -3.258 -8.104) 10.870 14.154 ( 4.854 -2.394 3.541) 6.467 14.242 ( 4.299 -4.483 -4.677) 7.775 15.184 ( -10.415 0.681 15.589) 18.760 15.823 ( 4.468 0.333 -3.820) 5.888 16.097 ( 0.763 3.032 -4.191) 5.229 16.165 ( 7.583 0.015 2.930) 8.129 18.213 ( -5.514 4.498 8.602) 11.164 18.379 ( -5.017 -2.442 5.363) 7.739 18.617 ( -10.957 2.374 -11.521) 16.075 19.101 ( 9.590 -2.446 -3.770) 10.591 ======================= Grid point 401 (213/260) ======================= q-point: ( 0.20 0.38 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 400 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.074 ( -2.890 7.008 -2.143) 7.878 2.404 ( 1.726 0.256 -4.325) 4.664 2.903 ( -2.909 -2.976 -1.494) 4.422 2.957 ( -1.071 0.806 -2.834) 3.135 4.277 ( -5.361 3.251 13.998) 15.338 4.604 ( -5.089 3.656 -7.436) 9.724 4.981 ( -0.073 3.098 -3.506) 4.679 5.094 ( -3.695 -1.191 -6.747) 7.784 5.685 ( 6.803 0.081 -2.074) 7.113 5.739 ( 6.348 -1.859 -0.234) 6.619 6.120 ( -2.604 -5.422 3.927) 7.184 6.392 ( 0.272 -8.850 9.423) 12.930 6.568 ( 0.056 -0.010 2.927) 2.928 6.734 ( -2.930 1.015 0.124) 3.104 6.959 ( 0.394 7.616 -0.840) 7.673 7.157 ( 4.914 5.223 -2.620) 7.635 7.888 ( 2.629 1.497 -2.112) 3.690 8.159 ( 2.656 5.179 -2.494) 6.333 8.499 ( -6.083 9.193 -6.028) 12.563 8.594 ( 1.033 6.135 -0.816) 6.275 8.671 ( -5.285 3.361 -8.010) 10.168 8.930 ( -1.771 -0.176 -6.250) 6.498 8.983 ( -9.010 -4.911 -4.201) 11.088 9.208 ( -2.238 -4.541 3.557) 6.188 9.546 ( 6.204 -2.280 -0.352) 6.619 9.808 ( 5.288 -4.984 -4.414) 8.502 10.386 ( -3.024 4.609 3.165) 6.357 10.492 ( -3.701 -0.964 3.916) 5.474 10.678 ( -8.610 -2.169 0.302) 8.885 10.966 ( -8.697 3.561 -2.566) 9.742 11.229 ( -10.402 -6.680 -1.624) 12.469 11.750 ( -10.104 4.079 0.010) 10.896 11.994 ( -1.666 3.762 -0.310) 4.126 12.232 ( 12.359 -5.049 0.556) 13.362 12.261 ( 5.648 -2.629 9.336) 11.224 12.523 ( -2.154 -2.696 -0.295) 3.463 13.423 ( 2.957 -1.658 4.083) 5.307 13.752 ( 13.913 -0.624 -3.811) 14.439 14.240 ( 4.687 0.559 -1.538) 4.965 14.356 ( 6.511 -4.953 1.713) 8.359 15.142 ( -4.215 1.863 14.489) 15.204 15.799 ( -3.635 -1.004 -4.444) 5.829 16.173 ( 9.315 2.408 -2.784) 10.016 16.359 ( 8.574 0.974 5.535) 10.252 17.979 ( -19.709 1.125 -2.492) 19.897 18.210 ( -10.419 -1.875 -0.956) 10.629 18.513 ( 1.973 3.690 -2.729) 4.996 19.203 ( 2.874 -0.437 -3.795) 4.780 ======================= Grid point 402 (214/260) ======================= q-point: ( 0.30 0.38 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 400 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.018 ( -1.393 2.289 -2.095) 3.402 2.353 ( -3.016 -3.596 -6.483) 8.003 2.796 ( -5.813 -2.939 -4.378) 7.848 2.898 ( -2.330 0.256 -7.067) 7.446 4.263 ( -4.757 2.061 12.738) 13.753 4.461 ( -4.795 2.738 -6.159) 8.272 4.948 ( -4.676 0.467 -7.019) 8.447 4.971 ( 0.591 3.090 -9.369) 9.883 5.798 ( 4.359 -0.296 1.111) 4.509 5.832 ( 4.784 -0.056 0.005) 4.784 6.123 ( 0.047 -5.505 6.409) 8.448 6.509 ( 1.664 -2.609 16.932) 17.212 6.591 ( 1.042 2.970 -1.404) 3.446 6.726 ( 4.406 -3.573 -2.767) 6.311 6.921 ( -3.527 6.925 -1.830) 7.984 7.225 ( 4.264 3.342 -4.254) 6.889 7.917 ( 2.173 0.958 -4.364) 4.969 8.159 ( -0.077 3.939 -6.284) 7.417 8.300 ( -9.668 10.450 -7.187) 15.947 8.488 ( -5.417 8.345 -5.712) 11.472 8.621 ( 0.048 5.033 -4.688) 6.879 8.692 ( -10.507 -3.718 -6.024) 12.670 8.969 ( 1.063 -6.550 3.577) 7.539 9.240 ( 1.351 0.582 6.899) 7.054 9.647 ( 5.123 -3.046 -3.363) 6.843 9.841 ( 1.380 -2.529 -5.678) 6.367 10.325 ( -6.242 -0.125 4.973) 7.982 10.389 ( -7.320 -1.204 2.489) 7.824 10.548 ( -5.382 -3.167 1.364) 6.392 10.823 ( -4.258 2.056 -5.692) 7.400 11.078 ( -4.151 -4.665 -0.450) 6.260 11.526 ( -12.441 0.723 -0.115) 12.463 11.960 ( -0.814 5.275 2.816) 6.035 12.354 ( -1.992 -5.571 -3.273) 6.762 12.466 ( 6.525 -1.040 6.018) 8.938 12.550 ( 9.078 -5.502 3.771) 11.265 13.543 ( 5.684 1.167 7.701) 9.642 14.010 ( 12.796 -2.876 -0.376) 13.121 14.336 ( 6.078 4.246 -0.938) 7.474 14.482 ( 4.889 -3.872 3.643) 7.223 15.174 ( -0.624 1.641 8.658) 8.834 15.675 ( -5.521 -1.713 -5.377) 7.895 16.358 ( 9.697 1.054 0.157) 9.755 16.558 ( 7.979 1.893 7.209) 10.919 17.552 ( -20.158 -1.532 -5.075) 20.843 18.001 ( -9.604 0.369 -5.035) 10.851 18.557 ( 3.251 3.704 -0.520) 4.956 19.168 ( -3.131 0.577 -5.275) 6.161 ======================= Grid point 403 (215/260) ======================= q-point: ( 0.40 0.38 -0.60) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 400 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.989 ( -1.424 -3.868 0.307) 4.133 2.236 ( -4.168 -5.249 -6.667) 9.453 2.635 ( -7.711 0.002 -4.343) 8.850 2.780 ( -4.176 -2.401 -9.447) 10.604 4.245 ( -4.377 2.548 9.334) 10.620 4.365 ( -2.031 1.788 -2.638) 3.779 4.771 ( -7.227 3.122 -7.197) 10.666 4.950 ( 2.222 1.420 -10.188) 10.524 5.849 ( -0.173 -1.107 5.528) 5.641 5.941 ( 5.254 -0.033 -1.111) 5.370 6.214 ( 4.401 -2.516 8.892) 10.236 6.573 ( 0.442 4.265 0.258) 4.295 6.647 ( 1.018 -0.289 12.098) 12.144 6.804 ( -5.875 4.061 -2.221) 7.479 6.852 ( 7.293 -1.423 -1.705) 7.624 7.282 ( 5.406 -0.015 -5.506) 7.716 7.876 ( -3.439 0.985 -10.264) 10.870 8.037 ( -5.422 2.673 -12.804) 14.159 8.161 ( -0.265 8.604 -0.429) 8.619 8.373 ( -4.789 9.353 -0.903) 10.547 8.469 ( -9.249 2.194 -1.390) 9.606 8.589 ( -0.184 2.259 -7.281) 7.625 9.042 ( 2.526 -4.701 7.801) 9.452 9.337 ( 4.118 2.552 7.482) 8.913 9.684 ( 2.002 -3.020 -8.966) 9.670 9.802 ( -1.526 -1.952 -3.835) 4.566 10.207 ( -8.504 -3.183 8.921) 12.729 10.325 ( -0.331 -2.016 -0.162) 2.050 10.483 ( -2.603 -4.921 2.100) 5.950 10.714 ( -1.730 0.222 -10.109) 10.259 11.040 ( -0.692 -1.510 0.170) 1.670 11.295 ( -10.588 -2.565 -0.974) 10.937 11.997 ( 1.716 4.126 4.571) 6.393 12.242 ( -5.391 -3.291 -2.751) 6.889 12.594 ( 1.829 -1.571 9.633) 9.930 12.769 ( 11.293 -5.560 -3.200) 12.988 13.723 ( 6.784 3.894 10.040) 12.727 14.183 ( 4.575 -2.650 -0.553) 5.316 14.441 ( -0.136 2.734 10.430) 10.783 14.620 ( 11.527 -0.520 -5.003) 12.577 15.211 ( 1.094 0.505 1.883) 2.235 15.526 ( -6.322 -3.034 -5.642) 9.000 16.530 ( 7.427 1.010 2.235) 7.821 16.758 ( 7.623 2.023 8.399) 11.521 17.176 ( -16.170 -2.300 -2.018) 16.457 17.778 ( -9.422 1.009 -7.520) 12.097 18.637 ( 5.716 4.051 -0.578) 7.030 19.037 ( -6.071 0.791 -6.532) 8.952 ======================= Grid point 404 (216/260) ======================= q-point: (-0.50 0.38 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 400 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.944 ( -5.302 -7.883 3.591) 10.157 2.141 ( -1.333 -6.127 -4.381) 7.650 2.469 ( -7.229 2.572 -0.121) 7.674 2.646 ( -3.420 -4.740 -7.965) 9.880 4.208 ( -4.766 2.729 6.281) 8.344 4.347 ( 1.597 2.203 -1.115) 2.941 4.617 ( -5.516 3.678 -0.654) 6.662 4.921 ( 1.202 0.698 -9.993) 10.089 5.860 ( -2.914 -0.417 6.677) 7.297 6.004 ( 2.275 0.473 -1.642) 2.845 6.363 ( 4.258 1.364 7.261) 8.527 6.577 ( -1.722 4.978 1.140) 5.389 6.688 ( -2.606 -0.964 3.213) 4.248 6.738 ( 3.219 -1.232 -0.032) 3.447 6.966 ( 3.777 3.037 2.115) 5.288 7.367 ( 6.372 -2.174 -5.893) 8.948 7.714 ( -3.445 2.633 -10.089) 10.981 7.848 ( -6.730 1.072 -12.011) 13.809 8.195 ( -2.382 7.547 2.810) 8.398 8.285 ( -0.377 3.627 -0.321) 3.661 8.345 ( -2.970 7.106 2.034) 7.965 8.543 ( 0.023 5.017 -6.208) 7.982 9.144 ( 2.071 -3.529 9.134) 10.009 9.491 ( 7.192 2.628 6.031) 9.747 9.602 ( -3.713 -2.234 -9.376) 10.329 9.758 ( 0.073 -1.675 -6.656) 6.864 10.149 ( -3.008 -2.069 8.758) 9.488 10.365 ( 4.186 -5.638 0.819) 7.069 10.470 ( 0.050 -5.607 1.470) 5.797 10.639 ( 0.737 -0.719 -11.030) 11.078 11.036 ( -1.199 0.369 1.934) 2.305 11.131 ( -3.943 -5.101 -2.146) 6.795 12.062 ( 1.383 1.192 4.923) 5.250 12.143 ( -3.434 -0.346 -0.638) 3.510 12.648 ( -1.906 -3.635 7.392) 8.455 12.929 ( 8.402 -2.959 -6.578) 11.074 13.909 ( 5.556 5.721 9.775) 12.616 14.184 ( -2.814 2.574 -3.259) 5.016 14.422 ( -8.488 -2.163 11.962) 14.826 14.860 ( 16.066 0.704 -8.414) 18.149 15.244 ( 1.433 -0.206 -0.124) 1.453 15.370 ( -5.374 -4.500 -5.171) 8.710 16.677 ( 5.683 1.430 4.198) 7.209 16.831 ( -8.484 -0.549 -4.490) 9.614 17.023 ( 2.888 -0.436 16.045) 16.309 17.549 ( -8.992 0.916 -8.745) 12.576 18.771 ( 7.928 4.860 -0.876) 9.340 18.880 ( -4.781 0.461 -6.863) 8.377 ======================= Grid point 405 (217/260) ======================= q-point: (-0.40 0.38 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 400 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.832 ( -8.509 -4.386 6.408) 11.519 2.135 ( 1.734 -10.037 -0.154) 10.186 2.386 ( -3.272 2.920 7.069) 8.319 2.573 ( -0.266 -5.708 -2.690) 6.316 4.144 ( -4.422 2.183 4.021) 6.363 4.425 ( 5.935 3.506 2.252) 7.251 4.554 ( -3.082 4.055 6.060) 7.916 4.874 ( 0.218 0.164 -9.107) 9.111 5.814 ( -5.732 1.971 5.646) 8.283 6.011 ( -0.246 0.488 -2.359) 2.421 6.414 ( -2.628 4.214 5.415) 7.347 6.563 ( -0.483 -0.610 4.984) 5.044 6.687 ( 0.060 0.454 -6.825) 6.840 6.790 ( 3.441 -1.075 -2.551) 4.416 7.027 ( 0.372 0.474 5.565) 5.597 7.411 ( 2.110 2.637 -10.142) 10.689 7.662 ( -2.900 0.313 -6.841) 7.437 7.695 ( 3.308 1.883 0.090) 3.807 8.101 ( -4.293 7.139 0.237) 8.334 8.264 ( -4.784 2.082 7.287) 8.962 8.449 ( 9.552 7.358 -0.243) 12.060 8.523 ( 1.834 6.314 -4.937) 8.222 9.223 ( 0.028 -2.272 9.209) 9.486 9.463 ( -4.016 -2.822 -8.548) 9.857 9.663 ( 6.875 1.259 0.790) 7.034 9.719 ( 1.488 -1.109 -8.340) 8.544 10.192 ( 1.493 -1.995 7.620) 8.017 10.476 ( 4.913 -3.733 1.482) 6.345 10.517 ( 6.100 -6.716 -0.175) 9.074 10.606 ( 2.525 -1.523 -9.339) 9.794 10.986 ( -3.104 -2.287 1.653) 4.195 11.174 ( 6.209 -3.094 2.854) 7.501 12.072 ( -1.811 0.869 0.971) 2.231 12.135 ( 0.973 -0.983 3.793) 4.037 12.611 ( -5.644 -5.155 4.311) 8.776 13.009 ( 5.113 -0.259 -9.899) 11.145 14.015 ( -4.955 8.287 3.027) 10.119 14.075 ( -1.492 3.737 1.304) 4.230 14.284 ( -10.590 -4.136 4.063) 12.073 15.027 ( 2.245 -1.569 -12.714) 13.006 15.238 ( 4.013 -1.516 1.918) 4.699 15.358 ( 4.473 -1.826 -0.274) 4.839 16.573 ( -13.855 -1.934 0.639) 14.004 16.826 ( 5.188 0.604 3.219) 6.135 17.235 ( 5.147 2.040 13.481) 14.574 17.351 ( -3.754 -0.876 -4.386) 5.839 18.733 ( -3.560 1.064 -5.718) 6.819 18.972 ( 10.915 4.753 -2.115) 12.092 ======================= Grid point 406 (218/260) ======================= q-point: (-0.30 0.38 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 400 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.737 ( -5.935 2.796 10.595) 12.462 2.192 ( 3.253 -12.350 1.749) 12.891 2.425 ( 0.542 2.229 12.956) 13.158 2.608 ( 3.245 -5.668 3.990) 7.653 4.115 ( -1.590 2.539 6.172) 6.861 4.566 ( 0.934 4.599 8.215) 9.461 4.586 ( 6.423 3.805 5.992) 9.573 4.829 ( 1.100 0.550 -8.253) 8.344 5.720 ( -7.139 3.041 4.972) 9.216 5.967 ( -2.194 1.174 -4.212) 4.893 6.397 ( -2.769 2.609 7.195) 8.139 6.559 ( -3.665 -3.996 0.501) 5.445 6.580 ( -2.821 -1.085 -10.041) 10.486 6.845 ( 2.831 1.674 -0.298) 3.302 7.063 ( 0.330 -0.855 3.657) 3.770 7.286 ( -5.325 2.210 -12.014) 13.326 7.694 ( 4.842 3.094 1.193) 5.868 7.788 ( 3.170 2.467 3.950) 5.634 8.081 ( 0.768 8.274 4.178) 9.301 8.253 ( 1.177 0.421 6.551) 6.669 8.540 ( 2.847 6.561 -1.613) 7.332 8.641 ( 9.586 6.703 -2.525) 11.967 9.247 ( -2.079 -1.197 3.993) 4.658 9.366 ( -1.583 -4.977 -3.770) 6.441 9.660 ( 1.793 0.040 -13.542) 13.661 9.806 ( 5.428 -1.512 -0.658) 5.673 10.267 ( 1.480 -2.077 5.585) 6.139 10.585 ( 6.183 0.191 1.216) 6.305 10.627 ( 5.441 -1.413 -6.832) 8.847 10.686 ( 9.407 -5.233 -0.391) 10.771 10.977 ( 1.208 -4.780 3.553) 6.077 11.357 ( 8.867 -2.063 6.917) 11.433 12.049 ( -0.492 1.377 -1.035) 1.791 12.185 ( 1.340 -3.006 5.193) 6.148 12.493 ( -8.043 -5.770 1.321) 9.987 12.998 ( 1.017 1.778 -12.986) 13.147 13.805 ( -12.445 7.371 -1.561) 14.548 14.072 ( -9.207 -4.403 -4.358) 11.097 14.114 ( -2.338 4.748 4.855) 7.182 14.856 ( -9.130 -5.098 -8.615) 13.548 15.403 ( 9.617 1.821 -3.703) 10.465 15.473 ( 5.946 -1.131 3.759) 7.124 16.296 ( -16.294 -3.557 3.705) 17.084 16.839 ( -5.180 1.360 -5.490) 7.669 17.296 ( 7.117 1.198 5.906) 9.326 17.540 ( 10.075 -1.509 15.151) 18.258 18.659 ( -0.739 1.077 -4.898) 5.069 19.158 ( 9.476 4.943 -3.685) 11.306 ======================= Grid point 407 (219/260) ======================= q-point: (-0.20 0.38 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 400 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.754 ( 0.345 9.786 12.451) 15.840 2.263 ( 2.459 -9.193 2.017) 9.727 2.556 ( 3.437 0.367 15.640) 16.018 2.726 ( 4.612 -4.534 7.373) 9.808 4.155 ( 0.270 3.713 9.624) 10.319 4.666 ( 4.318 4.946 9.242) 11.337 4.754 ( 5.818 3.191 7.029) 9.666 4.823 ( 3.467 2.135 -7.736) 8.742 5.612 ( -6.893 1.533 4.680) 8.472 5.873 ( -3.880 2.093 -6.683) 8.006 6.373 ( -4.299 -2.534 2.880) 5.762 6.444 ( -1.129 -6.099 -10.787) 12.443 6.525 ( -3.060 -0.111 7.002) 7.642 6.886 ( 1.278 3.061 0.388) 3.340 7.061 ( -2.397 2.724 -0.933) 3.747 7.142 ( -2.559 -2.401 -6.135) 7.068 7.759 ( -0.016 5.380 3.838) 6.609 7.849 ( 1.879 2.150 1.785) 3.368 8.159 ( 2.899 3.901 9.525) 10.693 8.429 ( 11.594 6.205 4.898) 14.032 8.597 ( 3.367 6.272 -0.101) 7.120 8.782 ( 6.933 6.198 -2.879) 9.735 9.215 ( 0.027 -4.668 -4.664) 6.599 9.335 ( -2.147 -4.899 1.974) 5.702 9.607 ( 1.860 0.104 -14.334) 14.454 9.870 ( 2.319 -3.724 -3.919) 5.883 10.318 ( 0.472 0.067 5.238) 5.260 10.652 ( 1.245 -0.057 -3.718) 3.921 10.755 ( 8.621 2.050 -0.292) 8.867 10.854 ( 9.337 -2.560 -0.851) 9.719 11.105 ( 8.836 -6.895 4.755) 12.175 11.566 ( 6.840 -0.755 8.612) 11.024 12.034 ( -0.510 -0.228 -1.567) 1.664 12.246 ( 1.764 -2.574 3.747) 4.876 12.343 ( -6.952 -5.082 0.265) 8.616 12.884 ( -3.941 2.927 -14.481) 15.290 13.560 ( -11.230 6.398 -1.672) 13.033 13.851 ( -8.178 -4.139 -8.205) 12.302 14.081 ( -4.158 3.374 3.281) 6.280 14.617 ( -10.220 -6.606 -6.787) 13.934 15.535 ( 6.685 3.428 -4.369) 8.691 15.613 ( 5.873 -0.587 3.667) 6.949 15.996 ( -17.584 -4.563 6.044) 19.146 16.636 ( -9.280 1.912 -8.540) 12.755 17.583 ( 13.968 2.649 12.907) 19.202 17.846 ( 11.896 -4.297 15.160) 19.744 18.640 ( 1.834 1.607 -5.009) 5.571 19.263 ( 3.931 3.975 -6.112) 8.283 ======================= Grid point 408 (220/260) ======================= q-point: (-0.10 0.38 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 400 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.894 ( 6.002 12.529 10.764) 17.574 2.300 ( 0.193 -2.377 1.208) 2.673 2.725 ( 3.855 -0.585 13.909) 14.445 2.855 ( 3.917 -2.678 6.777) 8.273 4.225 ( -0.570 5.313 12.271) 13.384 4.802 ( 4.074 6.579 -0.493) 7.754 4.878 ( 5.523 2.609 0.354) 6.119 4.903 ( 5.976 1.839 7.498) 9.763 5.523 ( -4.726 -2.044 3.359) 6.148 5.744 ( -4.492 -0.108 -7.939) 9.123 6.282 ( -4.095 -6.508 -1.088) 7.766 6.392 ( 0.667 -6.583 -6.581) 9.332 6.550 ( -0.913 2.069 10.685) 10.921 6.894 ( -1.156 3.357 0.977) 3.682 6.997 ( -1.396 3.702 -2.260) 4.557 7.072 ( -3.395 -2.977 -2.657) 5.239 7.767 ( -1.712 5.630 7.159) 9.267 7.913 ( 4.971 1.273 -2.241) 5.599 8.295 ( 4.429 2.419 9.493) 10.751 8.653 ( 3.619 11.281 -1.084) 11.897 8.666 ( 8.088 6.390 0.955) 10.352 8.894 ( 5.799 6.262 0.630) 8.558 9.213 ( 3.598 -9.280 -6.255) 11.756 9.292 ( -2.825 -4.305 0.260) 5.155 9.559 ( 2.163 -1.355 -12.573) 12.829 9.832 ( -3.353 -5.875 -5.955) 9.012 10.351 ( -0.431 2.222 5.689) 6.122 10.606 ( -3.097 1.775 -2.297) 4.245 10.938 ( 9.908 1.941 -0.592) 10.113 11.027 ( 8.046 -2.311 -1.253) 8.465 11.324 ( 10.171 -4.711 4.273) 11.996 11.686 ( 0.380 -0.585 6.298) 6.336 11.992 ( -3.776 -3.320 0.431) 5.046 12.255 ( -4.286 -0.597 3.642) 5.656 12.298 ( 3.902 -0.493 -1.706) 4.287 12.677 ( -7.976 3.429 -13.456) 16.014 13.377 ( -6.319 5.001 -0.952) 8.114 13.684 ( -3.020 -6.778 -10.275) 12.674 14.020 ( -3.552 2.322 4.293) 6.036 14.399 ( -7.744 -7.162 -5.857) 12.065 15.565 ( -6.946 2.197 3.587) 8.120 15.703 ( -0.454 -2.029 -3.591) 4.149 15.799 ( 1.408 -0.541 7.524) 7.673 16.412 ( -8.323 1.964 -7.835) 11.598 17.914 ( 10.195 5.813 14.687) 18.800 18.177 ( 11.452 -7.709 15.043) 20.418 18.670 ( 5.658 2.616 -6.808) 9.230 19.218 ( -3.937 1.806 -8.664) 9.686 ======================= Grid point 409 (221/260) ======================= q-point: ( 0.00 -0.50 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 252 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.222 ( 2.498 0.000 2.324) 3.412 2.302 ( 6.050 -0.000 0.064) 6.050 2.885 ( 3.273 0.000 9.164) 9.731 2.911 ( -0.046 -0.000 8.053) 8.053 4.342 ( -2.904 0.000 13.962) 14.260 4.877 ( -1.589 0.000 -4.294) 4.579 5.034 ( 7.074 0.000 1.550) 7.242 5.077 ( 3.986 0.000 3.650) 5.405 5.426 ( -1.657 0.000 0.906) 1.888 5.590 ( -2.760 -0.000 -7.062) 7.582 6.182 ( 2.105 0.000 -2.525) 3.287 6.249 ( -3.022 -0.000 -4.169) 5.149 6.624 ( -4.951 0.000 14.313) 15.145 6.911 ( -3.086 0.000 0.564) 3.137 6.962 ( -2.029 -0.000 2.247) 3.028 7.050 ( 3.440 -0.000 -1.467) 3.739 7.838 ( 0.270 -0.000 2.579) 2.593 8.022 ( 7.253 0.000 -3.401) 8.011 8.463 ( 4.216 0.000 8.399) 9.397 8.729 ( 0.194 0.000 -3.285) 3.291 8.925 ( 0.024 0.000 -5.457) 5.457 9.079 ( 3.902 -0.000 -13.804) 14.344 9.162 ( -4.210 0.000 3.598) 5.538 9.190 ( 10.902 -0.000 7.785) 13.396 9.500 ( 4.087 -0.000 -10.521) 11.287 9.578 ( -10.524 0.000 -7.641) 13.005 10.412 ( -1.096 0.000 7.374) 7.455 10.574 ( -1.524 0.000 -1.196) 1.937 11.004 ( -5.296 0.000 1.554) 5.519 11.167 ( 8.994 0.000 -5.686) 10.640 11.500 ( 10.622 0.000 3.852) 11.299 11.643 ( -7.284 0.000 -2.831) 7.815 11.892 ( -1.181 0.000 12.077) 12.134 12.188 ( -7.896 0.000 4.454) 9.065 12.426 ( 6.938 0.000 -0.341) 6.947 12.473 ( -7.965 0.000 -12.044) 14.439 13.387 ( -2.205 0.000 -3.970) 4.541 13.470 ( 2.448 -0.000 -9.147) 9.469 14.035 ( 1.276 0.000 3.734) 3.946 14.197 ( -1.983 0.000 -4.267) 4.705 15.343 ( -15.461 0.000 13.885) 20.781 15.754 ( 6.314 0.000 -6.880) 9.338 15.960 ( 7.711 0.000 6.487) 10.077 16.246 ( -5.730 0.000 -7.799) 9.678 18.236 ( 3.374 -0.000 13.240) 13.664 18.293 ( 2.457 0.000 12.266) 12.510 18.847 ( 13.334 0.000 -5.548) 14.442 18.989 ( -12.736 -0.000 -12.425) 17.793 ======================= Grid point 411 (222/260) ======================= q-point: ( 0.10 -0.50 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 250 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.235 ( -1.173 0.000 -1.766) 2.120 2.394 ( 3.982 0.000 -3.459) 5.275 2.918 ( -2.920 -0.000 3.889) 4.863 2.967 ( 1.060 0.000 3.659) 3.809 4.343 ( -5.828 0.000 14.343) 15.482 4.784 ( -4.544 -0.000 -5.789) 7.359 5.080 ( -2.594 -0.000 -1.634) 3.066 5.121 ( 0.497 0.000 -1.298) 1.390 5.498 ( 9.136 0.000 0.622) 9.157 5.601 ( 5.547 -0.000 -2.485) 6.078 6.161 ( -3.007 0.000 -5.140) 5.955 6.213 ( 0.716 -0.000 3.478) 3.551 6.579 ( -6.750 0.000 12.644) 14.333 6.838 ( -4.394 0.000 -0.327) 4.406 6.992 ( 2.410 0.000 2.901) 3.771 7.131 ( 5.502 -0.000 -2.319) 5.971 7.868 ( 1.856 -0.000 -0.585) 1.946 8.135 ( 6.308 0.000 -3.213) 7.079 8.583 ( 3.357 0.000 6.591) 7.397 8.684 ( -0.829 0.000 -8.080) 8.123 8.855 ( -4.039 0.000 -4.295) 5.896 9.020 ( -1.786 0.000 -12.394) 12.522 9.131 ( -1.345 0.000 4.565) 4.759 9.279 ( -14.502 -0.000 -9.330) 17.244 9.384 ( 6.728 0.000 3.509) 7.587 9.605 ( 9.964 -0.000 -4.555) 10.956 10.435 ( -1.468 0.000 7.597) 7.738 10.548 ( -0.871 0.000 -1.160) 1.450 10.843 ( -10.567 0.000 0.417) 10.575 11.187 ( -3.330 0.000 -4.694) 5.755 11.392 ( -15.097 0.000 -1.360) 15.158 11.761 ( 14.767 0.000 0.313) 14.771 12.027 ( -10.375 0.000 2.955) 10.788 12.040 ( 6.214 -0.000 12.586) 14.037 12.268 ( -7.162 0.000 -6.451) 9.639 12.511 ( 1.397 0.000 0.255) 1.421 13.352 ( 0.577 0.000 -1.045) 1.193 13.545 ( 10.216 -0.000 -7.233) 12.517 14.133 ( 5.785 0.000 3.958) 7.010 14.189 ( 3.616 -0.000 -4.312) 5.628 15.192 ( -9.770 -0.000 16.368) 19.062 15.826 ( 3.383 0.000 -4.210) 5.401 16.135 ( 0.372 0.000 -7.524) 7.533 16.159 ( 8.846 0.000 5.906) 10.636 18.304 ( -7.678 -0.000 12.252) 14.459 18.306 ( -4.932 0.000 4.048) 6.381 18.647 ( -10.094 0.000 -14.865) 17.968 19.075 ( 10.950 -0.000 -2.597) 11.253 ======================= Grid point 413 (223/260) ======================= q-point: ( 0.20 -0.50 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 252 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.168 ( -3.656 0.000 -3.608) 5.136 2.395 ( -0.509 -0.000 -7.188) 7.206 2.860 ( -3.933 -0.000 -0.365) 3.949 2.972 ( -0.980 0.000 -2.180) 2.390 4.310 ( -6.320 0.000 13.824) 15.201 4.641 ( -5.954 -0.000 -6.729) 8.984 5.022 ( -1.872 -0.000 -2.261) 2.935 5.071 ( -1.616 0.000 -6.895) 7.082 5.700 ( 8.193 0.000 2.012) 8.436 5.709 ( 6.327 -0.000 -1.460) 6.493 6.081 ( -1.801 0.000 -3.941) 4.333 6.281 ( 2.648 0.000 12.270) 12.552 6.568 ( -0.527 0.000 7.153) 7.172 6.747 ( -4.472 0.000 -0.608) 4.513 7.041 ( 0.461 0.000 1.187) 1.273 7.212 ( 4.845 0.000 -4.725) 6.768 7.898 ( 2.414 0.000 -2.959) 3.819 8.210 ( 3.390 0.000 -4.343) 5.509 8.612 ( -0.796 0.000 -8.895) 8.931 8.648 ( -2.300 0.000 3.221) 3.958 8.743 ( -4.277 0.000 -2.142) 4.783 8.879 ( -5.388 -0.000 -9.086) 10.563 8.940 ( -12.086 0.000 -8.640) 14.857 9.167 ( 1.180 -0.000 6.358) 6.467 9.520 ( 5.979 0.000 0.491) 6.000 9.750 ( 7.383 -0.000 -5.193) 9.026 10.424 ( -5.777 0.000 8.067) 9.922 10.508 ( -2.515 -0.000 -2.460) 3.518 10.645 ( -9.753 0.000 1.068) 9.812 11.032 ( -8.031 -0.000 -5.320) 9.633 11.124 ( -10.773 0.000 0.961) 10.815 11.793 ( -11.706 0.000 -0.582) 11.721 12.033 ( 3.851 0.000 -0.886) 3.952 12.182 ( 7.012 0.000 0.020) 7.012 12.232 ( 5.549 0.000 9.223) 10.763 12.492 ( -3.172 0.000 2.107) 3.808 13.408 ( 4.161 0.000 4.440) 6.085 13.746 ( 13.632 0.000 -4.791) 14.449 14.269 ( 7.558 0.000 -5.262) 9.210 14.279 ( 5.507 -0.000 6.325) 8.387 15.162 ( -3.975 -0.000 14.710) 15.237 15.788 ( -3.903 -0.000 -4.616) 6.045 16.199 ( 8.862 0.000 -4.100) 9.765 16.369 ( 8.974 0.000 6.103) 10.853 17.994 ( -22.848 -0.000 -2.046) 22.939 18.188 ( -7.751 0.000 -1.306) 7.860 18.552 ( 2.141 0.000 -3.304) 3.938 19.198 ( 3.402 0.000 -3.017) 4.547 ======================= Grid point 415 (224/260) ======================= q-point: ( 0.30 -0.50 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 250 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.064 ( -4.614 0.000 -3.259) 5.649 2.300 ( -3.500 0.000 -9.004) 9.660 2.768 ( -4.347 0.000 -3.755) 5.744 2.898 ( -3.776 0.000 -7.154) 8.089 4.283 ( -4.921 0.000 12.917) 13.822 4.487 ( -5.281 -0.000 -6.353) 8.261 4.951 ( -4.003 -0.000 -5.076) 6.464 5.005 ( 0.378 0.000 -9.664) 9.672 5.801 ( 0.893 -0.000 5.152) 5.229 5.826 ( 6.447 0.000 -0.129) 6.448 6.071 ( 2.267 0.000 1.074) 2.508 6.472 ( 5.084 0.000 18.885) 19.558 6.647 ( 7.464 0.000 -2.170) 7.773 6.669 ( -3.035 -0.000 -0.319) 3.052 7.001 ( -5.061 0.000 -0.410) 5.078 7.254 ( 3.626 0.000 -7.378) 8.221 7.921 ( 2.209 0.000 -4.967) 5.436 8.192 ( -1.440 0.000 -8.246) 8.371 8.471 ( -12.148 0.000 -6.014) 13.555 8.551 ( -1.740 -0.000 -3.799) 4.179 8.605 ( -5.870 0.000 -4.248) 7.246 8.718 ( -5.190 0.000 -7.647) 9.242 8.877 ( 2.781 -0.000 5.167) 5.868 9.250 ( 2.833 -0.000 7.644) 8.152 9.613 ( 4.372 0.000 -2.729) 5.154 9.811 ( 2.557 0.000 -6.476) 6.962 10.305 ( -10.746 0.000 8.679) 13.813 10.418 ( -4.410 -0.000 -3.612) 5.701 10.495 ( -6.721 0.000 2.074) 7.034 10.851 ( -6.004 -0.000 -7.590) 9.678 11.018 ( -1.899 0.000 1.538) 2.444 11.535 ( -13.847 0.000 -0.897) 13.876 12.021 ( -0.877 0.000 1.954) 2.141 12.295 ( -2.466 0.000 -1.025) 2.671 12.446 ( 15.340 -0.000 -1.518) 15.415 12.495 ( 0.562 0.000 10.894) 10.909 13.560 ( 6.886 0.000 9.425) 11.672 13.977 ( 11.540 0.000 -1.273) 11.610 14.408 ( 2.023 0.000 10.648) 10.838 14.411 ( 11.433 -0.000 -7.697) 13.782 15.193 ( -0.952 0.000 8.556) 8.608 15.655 ( -6.116 -0.000 -5.544) 8.255 16.369 ( 9.588 0.000 -0.771) 9.619 16.577 ( 8.225 0.000 7.428) 11.083 17.538 ( -20.935 0.000 -4.793) 21.476 18.004 ( -9.019 0.000 -4.892) 10.260 18.595 ( 3.556 0.000 -1.247) 3.768 19.174 ( -3.088 0.000 -4.479) 5.440 ======================= Grid point 417 (225/260) ======================= q-point: ( 0.40 -0.50 -0.60) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 252 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.958 ( -4.983 0.000 -0.853) 5.056 2.176 ( -3.353 0.000 -8.146) 8.809 2.647 ( -5.213 0.000 -4.643) 6.981 2.744 ( -6.452 0.000 -9.185) 11.225 4.274 ( -4.099 0.000 10.801) 11.552 4.379 ( -2.045 0.000 -4.323) 4.782 4.804 ( -6.746 -0.000 -6.376) 9.282 4.965 ( 1.488 0.000 -9.966) 10.076 5.836 ( -0.994 0.000 7.589) 7.654 5.940 ( 5.035 0.000 -0.486) 5.059 6.190 ( 6.902 0.000 7.216) 9.986 6.632 ( 1.953 0.000 11.618) 11.781 6.635 ( -0.259 -0.000 0.468) 0.535 6.827 ( 3.933 0.000 1.786) 4.320 6.858 ( -2.323 0.000 -3.117) 3.888 7.276 ( 4.241 0.000 -8.257) 9.283 7.880 ( -2.805 0.000 -10.174) 10.554 8.061 ( -5.212 0.000 -12.126) 13.199 8.271 ( -2.967 0.000 -3.387) 4.503 8.452 ( -8.490 0.000 2.353) 8.810 8.495 ( -4.423 0.000 -0.148) 4.426 8.624 ( 0.577 0.000 -8.154) 8.174 8.987 ( 3.755 0.000 7.960) 8.801 9.370 ( 4.642 0.000 7.737) 9.023 9.649 ( 2.550 0.000 -8.893) 9.251 9.779 ( -1.705 0.000 -3.839) 4.201 10.171 ( -8.086 0.000 9.238) 12.277 10.321 ( -2.763 0.000 -2.789) 3.926 10.417 ( -2.759 0.000 2.307) 3.596 10.716 ( -2.249 0.000 -10.464) 10.703 11.019 ( 0.648 0.000 0.178) 0.672 11.275 ( -11.817 0.000 -1.446) 11.905 12.038 ( 0.139 0.000 4.418) 4.420 12.211 ( -4.140 0.000 -0.914) 4.240 12.579 ( 0.111 0.000 10.219) 10.219 12.706 ( 13.153 0.000 -4.096) 13.776 13.771 ( 7.745 0.000 11.340) 13.733 14.146 ( 5.796 0.000 0.471) 5.815 14.470 ( -4.158 0.000 13.817) 14.429 14.616 ( 15.378 0.000 -9.724) 18.195 15.221 ( 0.799 0.000 1.279) 1.508 15.490 ( -7.297 0.000 -5.644) 9.225 16.542 ( 7.923 0.000 1.477) 8.060 16.778 ( 7.457 0.000 8.644) 11.416 17.154 ( -16.603 0.000 -1.616) 16.682 17.788 ( -9.373 0.000 -7.262) 11.858 18.679 ( 6.297 0.000 -1.414) 6.454 19.045 ( -6.418 0.000 -5.688) 8.576 ======================= Grid point 419 (226/260) ======================= q-point: (-0.50 -0.50 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 250 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.863 ( -5.509 0.000 3.146) 6.345 2.079 ( -2.362 0.000 -4.958) 5.492 2.527 ( -4.449 -0.000 -2.067) 4.906 2.565 ( -6.184 0.000 -6.368) 8.876 4.239 ( -5.192 0.000 6.090) 8.003 4.367 ( 2.524 -0.000 -0.909) 2.683 4.657 ( -5.238 0.000 -1.025) 5.338 4.926 ( 0.495 0.000 -9.346) 9.359 5.856 ( -2.087 -0.000 7.607) 7.888 6.006 ( 2.232 0.000 -1.134) 2.504 6.379 ( 6.613 0.000 7.643) 10.107 6.648 ( -10.779 -0.000 2.840) 11.146 6.674 ( 3.341 0.000 2.394) 4.110 6.716 ( 3.063 0.000 -0.547) 3.111 7.004 ( 4.488 -0.000 1.291) 4.670 7.335 ( 7.022 0.000 -6.748) 9.739 7.736 ( -2.806 0.000 -9.996) 10.382 7.858 ( -7.178 0.000 -13.139) 14.972 8.293 ( -8.548 -0.000 2.068) 8.795 8.293 ( 2.353 0.000 2.942) 3.767 8.435 ( -1.121 0.000 1.381) 1.779 8.602 ( 1.144 -0.000 -5.807) 5.918 9.105 ( 2.810 0.000 8.976) 9.405 9.523 ( 6.370 -0.000 6.547) 9.134 9.576 ( -2.990 0.000 -11.649) 12.027 9.737 ( 0.132 0.000 -4.993) 4.995 10.124 ( -2.504 0.000 8.437) 8.801 10.307 ( 2.789 -0.000 -0.541) 2.841 10.410 ( 0.486 0.000 1.959) 2.018 10.630 ( 0.287 0.000 -11.355) 11.359 11.045 ( 2.529 -0.000 0.243) 2.541 11.077 ( -7.657 0.000 -1.181) 7.747 12.069 ( -0.240 0.000 5.409) 5.415 12.144 ( -2.768 -0.000 0.855) 2.897 12.608 ( -2.917 0.000 7.316) 7.876 12.897 ( 10.126 0.000 -7.037) 12.331 13.976 ( 6.200 -0.000 9.784) 11.583 14.201 ( 0.495 0.000 -2.126) 2.182 14.402 ( -11.463 0.000 12.738) 17.136 14.868 ( 16.321 0.000 -9.936) 19.108 15.257 ( 3.495 0.000 -1.568) 3.830 15.308 ( -8.107 -0.000 -4.196) 9.129 16.694 ( 6.558 -0.000 3.098) 7.253 16.823 ( -11.346 0.000 -3.777) 11.958 17.021 ( 4.494 0.000 16.603) 17.200 17.559 ( -9.239 0.000 -8.446) 12.518 18.825 ( 9.750 0.000 -1.805) 9.916 18.880 ( -6.320 0.000 -6.041) 8.743 ======================= Grid point 421 (227/260) ======================= q-point: (-0.40 -0.50 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 252 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.795 ( -4.541 0.000 7.770) 8.999 2.026 ( -1.156 0.000 -1.084) 1.585 2.458 ( -2.605 0.000 0.408) 2.636 2.473 ( -1.258 0.000 3.619) 3.832 4.168 ( -4.365 0.000 3.540) 5.620 4.461 ( 6.296 -0.000 2.903) 6.933 4.597 ( -2.562 0.000 5.224) 5.818 4.871 ( -0.223 0.000 -8.357) 8.360 5.835 ( -4.630 -0.000 5.722) 7.361 6.014 ( -0.142 0.000 -2.026) 2.031 6.495 ( -7.746 0.000 6.349) 10.015 6.507 ( 2.396 -0.000 4.739) 5.311 6.712 ( -0.148 -0.000 -12.756) 12.757 6.777 ( 4.459 0.000 4.084) 6.046 7.030 ( -1.067 0.000 1.989) 2.257 7.435 ( 4.790 0.000 -8.553) 9.803 7.665 ( -3.004 0.000 -7.019) 7.634 7.712 ( 3.640 0.000 -0.882) 3.746 8.178 ( -3.445 -0.000 1.065) 3.606 8.280 ( -6.428 0.000 7.874) 10.165 8.533 ( 9.357 0.000 -0.450) 9.368 8.596 ( 1.655 -0.000 -4.399) 4.700 9.199 ( 0.923 0.000 9.479) 9.524 9.429 ( -4.544 0.000 -10.504) 11.445 9.677 ( 5.965 -0.000 3.426) 6.879 9.705 ( 1.319 0.000 -10.129) 10.215 10.167 ( 1.500 0.000 7.005) 7.164 10.418 ( 8.423 -0.000 0.354) 8.430 10.464 ( 4.148 0.000 2.132) 4.664 10.589 ( 2.419 0.000 -9.962) 10.251 10.967 ( -3.729 0.000 0.441) 3.755 11.143 ( 6.658 0.000 3.545) 7.543 12.098 ( -0.162 -0.000 5.735) 5.738 12.106 ( -2.030 0.000 0.929) 2.233 12.556 ( -6.056 0.000 3.950) 7.230 13.004 ( 6.548 0.000 -10.364) 12.259 14.110 ( 1.844 -0.000 4.906) 5.241 14.142 ( -3.711 0.000 -6.475) 7.463 14.206 ( -14.790 -0.000 10.170) 17.949 15.008 ( -1.194 0.000 -12.394) 12.451 15.225 ( 6.868 0.000 0.317) 6.876 15.339 ( 5.213 0.000 0.304) 5.222 16.554 ( -15.056 0.000 1.390) 15.120 16.833 ( 5.289 0.000 3.207) 6.185 17.256 ( 8.179 0.000 16.264) 18.204 17.343 ( -7.061 -0.000 -7.032) 9.965 18.744 ( -3.841 0.000 -5.436) 6.656 19.020 ( 11.505 0.000 -2.726) 11.824 ======================= Grid point 423 (228/260) ======================= q-point: (-0.30 -0.50 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 250 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.809 ( 0.163 0.000 11.670) 11.671 2.024 ( 0.908 -0.000 1.523) 1.773 2.471 ( 1.149 0.000 7.249) 7.340 2.529 ( 2.528 -0.000 9.796) 10.117 4.143 ( -1.057 0.000 5.927) 6.020 4.617 ( 0.511 -0.000 7.741) 7.758 4.625 ( 7.291 0.000 5.711) 9.261 4.829 ( 1.376 0.000 -7.488) 7.614 5.751 ( -7.078 -0.000 4.330) 8.297 5.984 ( -1.277 0.000 -3.260) 3.501 6.410 ( -5.538 0.000 2.322) 6.005 6.520 ( -3.333 -0.000 2.003) 3.889 6.576 ( -3.646 0.000 -10.099) 10.737 6.873 ( 2.725 0.000 4.047) 4.879 7.040 ( 0.889 -0.000 1.134) 1.441 7.316 ( -5.750 0.000 -12.699) 13.940 7.723 ( 5.611 0.000 0.578) 5.641 7.815 ( 4.125 0.000 5.043) 6.515 8.197 ( -6.825 -0.000 9.953) 12.068 8.222 ( 7.817 0.000 2.865) 8.325 8.617 ( 3.074 0.000 -3.043) 4.325 8.718 ( 9.740 -0.000 -2.227) 9.992 9.255 ( -1.165 -0.000 9.073) 9.148 9.284 ( -3.457 0.000 -10.915) 11.449 9.663 ( 1.881 0.000 -13.233) 13.366 9.785 ( 4.096 -0.000 -0.333) 4.109 10.247 ( 2.196 0.000 6.312) 6.683 10.605 ( 4.968 0.000 -6.857) 8.468 10.605 ( 8.431 -0.000 3.551) 9.148 10.614 ( 11.270 0.000 -2.343) 11.511 10.933 ( -0.721 0.000 3.184) 3.264 11.338 ( 9.437 -0.000 7.389) 11.986 12.072 ( -1.855 -0.000 -0.016) 1.855 12.143 ( 1.225 0.000 6.107) 6.229 12.432 ( -7.703 0.000 0.315) 7.710 13.014 ( 1.982 0.000 -13.345) 13.492 13.925 ( -15.197 0.000 3.011) 15.492 13.986 ( -6.873 -0.000 -10.162) 12.268 14.164 ( -2.071 0.000 4.934) 5.351 14.802 ( -10.374 0.000 -7.925) 13.055 15.426 ( 11.527 0.000 -3.626) 12.084 15.455 ( 5.733 -0.000 2.924) 6.436 16.260 ( -17.589 0.000 5.178) 18.335 16.853 ( -4.816 0.000 -4.993) 6.937 17.309 ( 7.118 0.000 4.606) 8.478 17.526 ( 9.231 -0.000 16.066) 18.529 18.670 ( -0.680 0.000 -4.548) 4.599 19.208 ( 9.543 0.000 -4.615) 10.600 ======================= Grid point 425 (229/260) ======================= q-point: (-0.20 -0.50 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 252 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.939 ( 5.008 0.000 11.838) 12.854 2.079 ( 3.414 -0.000 2.528) 4.248 2.579 ( 3.633 0.000 11.581) 12.137 2.671 ( 4.218 -0.000 12.660) 13.344 4.195 ( 1.145 0.000 9.425) 9.494 4.721 ( 5.085 0.000 8.628) 10.015 4.785 ( 4.433 -0.000 7.423) 8.646 4.840 ( 4.956 0.000 -8.293) 9.661 5.628 ( -8.089 -0.000 3.960) 9.007 5.912 ( -3.973 -0.000 -5.451) 6.746 6.274 ( -3.940 0.000 -10.635) 11.342 6.428 ( -5.331 -0.000 -1.169) 5.458 6.533 ( -1.169 0.000 8.076) 8.161 6.930 ( 0.668 0.000 3.675) 3.735 7.057 ( -0.043 -0.000 -0.041) 0.059 7.143 ( -5.018 0.000 -7.999) 9.443 7.814 ( 5.036 -0.000 -2.187) 5.491 7.871 ( -2.850 0.000 6.779) 7.354 8.195 ( 0.732 0.000 10.757) 10.782 8.488 ( 14.229 0.000 7.458) 16.065 8.678 ( 4.999 0.000 -1.433) 5.201 8.859 ( 6.871 -0.000 -4.521) 8.225 9.165 ( -1.138 -0.000 -12.491) 12.543 9.264 ( -3.216 0.000 7.332) 8.006 9.611 ( 1.631 0.000 -14.663) 14.753 9.825 ( 0.986 0.000 -3.500) 3.637 10.325 ( 1.339 0.000 7.187) 7.311 10.652 ( 2.430 0.000 -4.830) 5.407 10.793 ( 9.518 0.000 -4.915) 10.712 10.809 ( 9.523 -0.000 4.169) 10.396 11.027 ( 8.629 0.000 5.345) 10.150 11.561 ( 7.108 0.000 9.438) 11.815 12.031 ( -2.648 0.000 -0.189) 2.655 12.215 ( 1.676 0.000 6.348) 6.566 12.295 ( -4.254 0.000 -2.871) 5.132 12.912 ( -3.486 -0.000 -14.845) 15.249 13.668 ( -11.821 0.000 -0.142) 11.822 13.769 ( -7.973 -0.000 -11.828) 14.264 14.119 ( -4.719 0.000 2.933) 5.556 14.546 ( -11.100 -0.000 -6.072) 12.653 15.588 ( 8.387 0.000 -6.449) 10.580 15.590 ( 5.540 -0.000 4.294) 7.010 15.948 ( -18.748 0.000 8.913) 20.759 16.655 ( -9.177 0.000 -8.469) 12.488 17.614 ( 16.454 0.000 12.898) 20.907 17.801 ( 8.912 -0.000 15.277) 17.687 18.657 ( 2.151 0.000 -4.681) 5.152 19.302 ( 3.444 0.000 -7.160) 7.946 ======================= Grid point 427 (230/260) ======================= q-point: (-0.10 -0.50 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 250 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.110 ( 5.537 0.000 7.714) 9.495 2.181 ( 5.432 -0.000 2.085) 5.819 2.737 ( 4.572 0.000 12.402) 13.218 2.821 ( 2.968 -0.000 11.460) 11.838 4.282 ( 0.331 0.000 12.227) 12.231 4.885 ( 1.626 0.000 4.037) 4.352 4.903 ( 6.625 0.000 -6.060) 8.979 4.907 ( 8.079 -0.000 7.943) 11.329 5.502 ( -6.790 0.000 3.052) 7.445 5.755 ( -7.273 -0.000 -8.244) 10.993 6.182 ( 0.481 0.000 -7.594) 7.609 6.331 ( -3.382 -0.000 -2.973) 4.503 6.586 ( -0.886 0.000 12.890) 12.921 6.944 ( -1.234 0.000 2.465) 2.757 7.023 ( -3.622 -0.000 0.636) 3.677 7.041 ( -1.349 0.000 -3.607) 3.851 7.838 ( -3.152 -0.000 5.774) 6.578 7.908 ( 6.632 0.000 -3.480) 7.490 8.321 ( 4.371 0.000 9.933) 10.852 8.702 ( 3.312 0.000 2.330) 4.049 8.884 ( 14.791 0.000 6.494) 16.154 8.926 ( 3.489 -0.000 -5.789) 6.759 9.093 ( 2.447 -0.000 -14.028) 14.240 9.225 ( -4.629 0.000 5.019) 6.828 9.544 ( 0.910 0.000 -14.275) 14.304 9.765 ( -4.420 0.000 -5.879) 7.355 10.381 ( -0.315 0.000 7.599) 7.606 10.623 ( -2.071 0.000 -2.316) 3.107 10.974 ( 12.666 0.000 -5.654) 13.871 10.987 ( 5.159 -0.000 3.551) 6.263 11.268 ( 11.394 0.000 4.619) 12.294 11.682 ( 0.053 0.000 6.636) 6.636 11.951 ( -5.982 0.000 1.801) 6.247 12.255 ( -2.196 0.000 5.800) 6.202 12.293 ( 5.722 0.000 -2.013) 6.066 12.710 ( -7.416 0.000 -14.541) 16.323 13.485 ( -6.035 0.000 -3.117) 6.792 13.563 ( -5.040 -0.000 -11.146) 12.232 14.045 ( -4.024 0.000 3.106) 5.084 14.323 ( -7.970 -0.000 -4.875) 9.343 15.588 ( -15.111 0.000 8.701) 17.437 15.681 ( 6.416 -0.000 -7.955) 10.220 15.796 ( 2.967 0.000 8.428) 8.935 16.432 ( -8.245 0.000 -8.169) 11.607 18.026 ( 14.785 0.000 16.186) 21.923 18.048 ( 7.021 -0.000 14.128) 15.777 18.697 ( 6.211 0.000 -6.562) 9.035 19.235 ( -5.142 -0.000 -9.720) 10.996 ======================= Grid point 459 (231/260) ======================= q-point: ( 0.00 0.00 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 130 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.900 ( 3.586 0.000 -3.621) 5.096 1.900 ( -3.586 0.000 3.621) 5.096 2.925 ( -3.991 0.000 0.715) 4.055 2.925 ( 3.991 0.000 -0.715) 4.055 4.213 ( 3.091 0.000 -12.521) 12.897 4.213 ( -3.091 0.000 12.521) 12.897 4.937 ( 3.354 0.000 -3.712) 5.003 4.937 ( -3.354 0.000 3.712) 5.003 5.883 ( -6.343 0.000 -2.549) 6.836 5.883 ( 6.343 0.000 2.549) 6.836 6.345 ( -3.036 0.000 -9.428) 9.904 6.345 ( 3.036 0.000 9.428) 9.904 6.703 ( 2.478 0.000 -6.007) 6.498 6.703 ( -2.478 0.000 6.007) 6.498 7.175 ( -3.648 0.000 -0.463) 3.678 7.175 ( 3.648 0.000 0.463) 3.678 7.515 ( 4.102 0.000 -7.541) 8.584 7.515 ( -4.102 0.000 7.541) 8.584 8.246 ( 7.608 0.000 -9.277) 11.998 8.246 ( -7.608 0.000 9.277) 11.998 8.717 ( 4.873 0.000 -6.775) 8.346 8.717 ( -4.873 0.000 6.775) 8.346 9.342 ( 5.384 0.000 -5.104) 7.419 9.342 ( -5.384 0.000 5.104) 7.419 9.860 ( 4.038 0.000 -2.805) 4.916 9.860 ( -4.038 0.000 2.805) 4.916 10.300 ( -2.413 0.000 -1.647) 2.921 10.300 ( 2.413 0.000 1.647) 2.921 11.103 ( -0.582 0.000 -3.467) 3.516 11.103 ( 0.582 0.000 3.467) 3.516 11.540 ( 3.663 0.000 -3.088) 4.791 11.540 ( -3.663 0.000 3.088) 4.791 12.106 ( 8.042 0.000 -7.348) 10.894 12.106 ( -8.042 0.000 7.348) 10.894 12.326 ( 4.922 0.000 -2.996) 5.762 12.326 ( -4.922 0.000 2.996) 5.762 13.655 ( 2.632 0.000 -12.360) 12.638 13.655 ( -2.632 0.000 12.360) 12.638 14.339 ( -8.314 0.000 -14.388) 16.617 14.339 ( 8.314 0.000 14.388) 16.617 15.516 ( -13.568 0.000 1.596) 13.662 15.516 ( 13.568 0.000 -1.596) 13.662 16.030 ( -7.203 0.000 -3.585) 8.045 16.030 ( 7.203 0.000 3.585) 8.045 18.173 ( -5.040 0.000 -12.274) 13.269 18.173 ( 5.040 0.000 12.274) 13.269 18.992 ( 10.933 0.000 -7.579) 13.303 18.992 ( -10.933 0.000 7.579) 13.303 ======================= Grid point 461 (232/260) ======================= q-point: ( 0.10 0.00 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 250 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.937 ( 6.325 0.000 -0.218) 6.328 2.014 ( 10.804 0.000 -6.358) 12.536 2.866 ( -2.960 0.000 1.719) 3.423 3.001 ( 3.555 0.000 -0.170) 3.559 4.192 ( 2.573 0.000 -12.290) 12.557 4.232 ( -2.609 0.000 11.792) 12.077 4.843 ( -5.347 0.000 -4.923) 7.268 4.912 ( -1.572 0.000 -9.939) 10.062 5.739 ( -5.129 0.000 -6.708) 8.444 6.002 ( 5.253 0.000 -0.892) 5.328 6.235 ( -2.946 0.000 -6.118) 6.790 6.455 ( 2.441 0.000 8.420) 8.766 6.686 ( -3.085 0.000 5.886) 6.645 6.710 ( 2.012 0.000 -5.378) 5.742 7.103 ( -4.601 0.000 4.371) 6.346 7.240 ( 1.552 0.000 4.115) 4.398 7.504 ( -1.647 0.000 6.365) 6.575 7.562 ( 5.271 0.000 -7.442) 9.120 8.103 ( -10.465 0.000 1.887) 10.634 8.259 ( 2.505 0.000 -19.683) 19.842 8.609 ( -8.382 0.000 2.634) 8.787 8.712 ( 0.086 0.000 -6.626) 6.627 9.320 ( -2.279 0.000 9.919) 10.178 9.460 ( 8.469 0.000 -3.019) 8.991 9.720 ( -11.176 0.000 0.323) 11.181 9.889 ( 1.739 0.000 -2.444) 2.999 10.356 ( 7.153 0.000 4.227) 8.309 10.402 ( 4.790 0.000 3.392) 5.869 10.954 ( -10.044 0.000 -3.869) 10.763 11.012 ( -9.558 0.000 2.673) 9.925 11.491 ( -3.715 0.000 0.446) 3.742 11.570 ( -1.717 0.000 -0.423) 1.769 12.058 ( -2.680 0.000 8.729) 9.132 12.249 ( 8.655 0.000 -0.570) 8.674 12.332 ( 3.537 0.000 2.616) 4.399 12.493 ( 12.857 0.000 -1.079) 12.902 13.643 ( 3.595 0.000 -10.059) 10.682 13.683 ( -2.196 0.000 10.896) 11.115 14.113 ( -4.975 0.000 -14.087) 14.939 14.584 ( 8.065 0.000 12.117) 14.556 15.325 ( -8.598 0.000 6.056) 10.516 15.793 ( 9.921 0.000 0.320) 9.926 15.897 ( 0.158 0.000 -1.178) 1.189 16.193 ( 7.454 0.000 2.928) 8.009 17.970 ( -7.420 0.000 -13.792) 15.662 18.310 ( 1.692 0.000 10.440) 10.576 18.744 ( -18.261 0.000 4.010) 18.697 19.074 ( 3.534 0.000 -9.847) 10.462 ======================= Grid point 462 (233/260) ======================= q-point: ( 0.20 0.00 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 250 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.113 ( 12.087 0.000 -4.053) 12.749 2.208 ( 13.009 0.000 -6.923) 14.736 2.823 ( -3.241 0.000 2.891) 4.343 3.025 ( -1.411 0.000 -1.356) 1.957 4.157 ( 1.096 0.000 -10.246) 10.304 4.264 ( -1.616 0.000 11.497) 11.610 4.704 ( -2.775 0.000 -12.128) 12.441 4.768 ( -5.499 0.000 -12.386) 13.552 5.623 ( -1.167 0.000 -9.543) 9.614 6.066 ( 2.421 0.000 -2.838) 3.731 6.172 ( -0.960 0.000 -0.816) 1.260 6.544 ( 2.384 0.000 5.976) 6.434 6.662 ( -3.046 0.000 6.204) 6.911 6.716 ( 1.421 0.000 -3.408) 3.692 7.075 ( -1.337 0.000 6.603) 6.737 7.282 ( -0.451 0.000 5.427) 5.446 7.515 ( -1.525 0.000 4.516) 4.767 7.611 ( 4.082 0.000 -6.662) 7.813 7.886 ( -11.276 0.000 -1.336) 11.354 8.110 ( -2.463 0.000 -24.757) 24.880 8.460 ( -7.462 0.000 0.058) 7.463 8.663 ( -1.565 0.000 -5.827) 6.033 9.360 ( -0.991 0.000 12.241) 12.281 9.493 ( -11.408 0.000 1.658) 11.528 9.587 ( 7.175 0.000 -6.740) 9.844 9.900 ( 0.072 0.000 -1.189) 1.191 10.499 ( 3.544 0.000 1.125) 3.718 10.556 ( 8.081 0.000 4.943) 9.473 10.745 ( -8.026 0.000 -3.211) 8.645 10.850 ( -7.804 0.000 3.879) 8.715 11.394 ( -5.975 0.000 0.119) 5.976 11.474 ( -8.547 0.000 7.208) 11.180 12.033 ( -4.648 0.000 2.645) 5.348 12.409 ( 5.975 0.000 3.940) 7.158 12.490 ( 10.385 0.000 1.481) 10.490 12.723 ( 8.716 0.000 0.202) 8.718 13.675 ( 5.269 0.000 -7.462) 9.135 13.710 ( 1.618 0.000 1.274) 2.059 14.022 ( 2.697 0.000 -4.552) 5.291 14.780 ( 4.170 0.000 11.619) 12.345 15.259 ( -2.617 0.000 7.107) 7.574 15.716 ( -4.873 0.000 -5.658) 7.468 16.185 ( 15.539 0.000 8.219) 17.579 16.349 ( 6.818 0.000 2.930) 7.421 17.730 ( -7.876 0.000 -14.449) 16.456 18.287 ( -17.772 0.000 3.345) 18.084 18.442 ( -5.681 0.000 5.323) 7.785 19.023 ( -1.615 0.000 -11.128) 11.245 ======================= Grid point 463 (234/260) ======================= q-point: ( 0.30 0.00 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 250 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.306 ( 11.080 0.000 -8.473) 13.949 2.409 ( 11.687 0.000 -6.403) 13.326 2.777 ( -4.131 0.000 5.717) 7.054 2.921 ( -7.661 0.000 -2.504) 8.059 4.113 ( 0.098 0.000 -6.594) 6.595 4.298 ( -2.713 0.000 10.368) 10.717 4.581 ( -5.598 0.000 -9.870) 11.347 4.601 ( 0.987 0.000 -15.587) 15.618 5.592 ( 3.876 0.000 -8.096) 8.976 6.052 ( -1.920 0.000 -3.281) 3.802 6.201 ( 3.714 0.000 2.264) 4.350 6.628 ( 2.869 0.000 4.111) 5.013 6.656 ( -1.621 0.000 6.956) 7.143 6.723 ( 0.790 0.000 -0.699) 1.055 7.126 ( 2.058 0.000 2.722) 3.413 7.271 ( -4.262 0.000 3.742) 5.672 7.445 ( -7.581 0.000 1.596) 7.747 7.632 ( 2.354 0.000 -6.544) 6.954 7.733 ( -3.451 0.000 2.619) 4.332 7.913 ( -1.869 0.000 -21.345) 21.426 8.329 ( -5.795 0.000 -0.528) 5.819 8.563 ( -4.718 0.000 -7.011) 8.451 9.343 ( -5.071 0.000 4.977) 7.105 9.432 ( -0.251 0.000 13.200) 13.203 9.647 ( 4.655 0.000 -10.302) 11.305 9.857 ( -3.346 0.000 -3.229) 4.650 10.499 ( -2.656 0.000 -5.788) 6.368 10.608 ( -5.357 0.000 4.488) 6.988 10.671 ( 1.842 0.000 -0.372) 1.879 10.811 ( -0.663 0.000 3.258) 3.325 11.297 ( -4.395 0.000 3.944) 5.905 11.411 ( -2.336 0.000 11.568) 11.801 11.928 ( -6.275 0.000 0.625) 6.306 12.468 ( -2.806 0.000 -0.540) 2.858 12.696 ( 10.293 0.000 -2.037) 10.493 12.813 ( 2.024 0.000 2.440) 3.170 13.741 ( 5.416 0.000 -5.516) 7.730 13.767 ( 3.248 0.000 -0.159) 3.252 14.171 ( 13.340 0.000 0.129) 13.340 14.876 ( -2.119 0.000 12.809) 12.983 15.297 ( 2.156 0.000 4.344) 4.850 15.597 ( -3.707 0.000 -5.702) 6.801 16.493 ( 6.015 0.000 3.955) 7.199 16.511 ( 11.809 0.000 9.669) 15.263 17.504 ( -5.962 0.000 -14.143) 15.348 17.852 ( -22.673 0.000 -2.480) 22.809 18.458 ( -0.445 0.000 7.745) 7.758 18.893 ( -4.039 0.000 -11.616) 12.298 ======================= Grid point 464 (235/260) ======================= q-point: ( 0.40 0.00 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 250 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.427 ( 8.014 0.000 -9.858) 12.705 2.561 ( 7.177 0.000 -6.046) 9.384 2.739 ( -8.521 0.000 -0.660) 8.547 2.740 ( -4.280 0.000 7.931) 9.012 4.096 ( 1.292 0.000 -1.984) 2.368 4.251 ( -5.636 0.000 0.655) 5.674 4.483 ( -2.431 0.000 4.133) 4.795 4.540 ( 2.444 0.000 -15.619) 15.809 5.668 ( 7.306 0.000 -3.259) 8.000 5.957 ( -5.772 0.000 -2.586) 6.325 6.339 ( 8.693 0.000 2.295) 8.990 6.654 ( -1.981 0.000 -2.285) 3.024 6.693 ( 0.821 0.000 7.554) 7.598 6.768 ( 2.337 0.000 5.778) 6.232 7.061 ( -6.028 0.000 -8.569) 10.477 7.159 ( -7.780 0.000 -0.747) 7.816 7.425 ( 2.800 0.000 9.697) 10.093 7.619 ( 0.840 0.000 -8.059) 8.102 7.733 ( -0.426 0.000 4.793) 4.812 7.796 ( 0.484 0.000 -12.442) 12.451 8.247 ( -2.391 0.000 1.198) 2.674 8.407 ( -6.359 0.000 -6.701) 9.238 9.368 ( 3.407 0.000 7.407) 8.153 9.514 ( 0.091 0.000 13.249) 13.249 9.643 ( 1.910 0.000 -11.227) 11.389 9.732 ( -6.267 0.000 -6.838) 9.275 10.410 ( -0.050 0.000 -9.913) 9.914 10.501 ( -8.785 0.000 8.154) 11.986 10.715 ( 2.163 0.000 -1.309) 2.528 10.781 ( -3.340 0.000 2.308) 4.060 11.303 ( 1.465 0.000 7.333) 7.478 11.478 ( 0.603 0.000 2.967) 3.028 11.866 ( 0.239 0.000 6.354) 6.358 12.298 ( -9.942 0.000 -9.005) 13.414 12.842 ( 7.187 0.000 -5.743) 9.199 12.875 ( 0.436 0.000 7.718) 7.730 13.801 ( 3.695 0.000 -4.221) 5.610 13.814 ( 0.738 0.000 2.533) 2.638 14.467 ( 16.243 0.000 -2.228) 16.396 14.859 ( -7.403 0.000 11.054) 13.304 15.370 ( 2.765 0.000 2.700) 3.865 15.504 ( -2.518 0.000 -4.965) 5.567 16.636 ( 5.888 0.000 5.426) 8.007 16.735 ( 5.453 0.000 6.405) 8.412 17.337 ( -2.366 0.000 -13.093) 13.305 17.454 ( -16.180 0.000 -0.666) 16.194 18.511 ( 0.873 0.000 8.647) 8.691 18.740 ( -4.164 0.000 -11.254) 12.000 ======================= Grid point 465 (236/260) ======================= q-point: ( 0.50 0.00 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 130 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.527 ( 7.267 0.000 -3.886) 8.240 2.527 ( -7.267 0.000 3.886) 8.240 2.699 ( 4.412 0.000 -5.952) 7.409 2.699 ( -4.412 0.000 5.952) 7.409 4.145 ( -3.887 0.000 -1.671) 4.231 4.145 ( 3.887 0.000 1.671) 4.231 4.497 ( 2.300 0.000 -12.655) 12.863 4.497 ( -2.300 0.000 12.655) 12.863 5.812 ( -7.832 0.000 -0.716) 7.865 5.812 ( 7.832 0.000 0.716) 7.865 6.532 ( -8.770 0.000 -1.902) 8.974 6.532 ( 8.770 0.000 1.902) 8.974 6.776 ( -3.015 0.000 -4.535) 5.446 6.776 ( 3.015 0.000 4.535) 5.446 7.008 ( -5.606 0.000 0.160) 5.608 7.008 ( 5.606 0.000 -0.160) 5.608 7.551 ( -2.260 0.000 -10.118) 10.368 7.551 ( 2.260 0.000 10.118) 10.368 7.756 ( 0.720 0.000 -6.222) 6.264 7.756 ( -0.720 0.000 6.222) 6.264 8.271 ( -3.265 0.000 -4.293) 5.394 8.271 ( 3.265 0.000 4.293) 5.394 9.535 ( -7.802 0.000 -7.558) 10.862 9.535 ( 7.802 0.000 7.558) 10.862 9.595 ( 0.174 0.000 -12.888) 12.889 9.595 ( -0.174 0.000 12.888) 12.889 10.405 ( 6.372 0.000 -10.762) 12.507 10.405 ( -6.372 0.000 10.762) 12.507 10.742 ( 2.058 0.000 -1.965) 2.845 10.742 ( -2.058 0.000 1.965) 2.845 11.414 ( -4.361 0.000 -6.130) 7.523 11.414 ( 4.361 0.000 6.130) 7.523 12.036 ( -9.404 0.000 -11.363) 14.749 12.036 ( 9.404 0.000 11.363) 14.749 12.900 ( 3.307 0.000 -8.091) 8.740 12.900 ( -3.307 0.000 8.091) 8.740 13.827 ( 1.395 0.000 -3.448) 3.720 13.827 ( -1.395 0.000 3.448) 3.720 14.723 ( 12.473 0.000 -6.451) 14.042 14.723 ( -12.473 0.000 6.451) 14.042 15.435 ( -2.119 0.000 -3.591) 4.169 15.435 ( 2.119 0.000 3.591) 4.169 16.766 ( -3.302 0.000 -2.913) 4.403 16.766 ( 3.302 0.000 2.913) 4.403 17.276 ( 4.477 0.000 -8.727) 9.808 17.276 ( -4.477 0.000 8.727) 9.808 18.604 ( -2.780 0.000 -10.088) 10.464 18.604 ( 2.780 0.000 10.088) 10.464 ======================= Grid point 471 (237/260) ======================= q-point: ( 0.00 0.12 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 208 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.951 ( -3.099 4.992 -5.644) 8.147 1.951 ( 3.099 4.992 5.644) 8.147 2.928 ( -0.837 0.398 -0.993) 1.358 2.928 ( 0.837 0.398 0.993) 1.358 4.268 ( 2.891 5.297 -12.992) 14.325 4.268 ( -2.891 5.297 12.992) 14.325 4.970 ( 3.531 2.956 -3.616) 5.855 4.970 ( -3.531 2.956 3.616) 5.855 5.801 ( -2.361 -6.829 -2.857) 7.770 5.801 ( 2.361 -6.829 2.857) 7.770 6.449 ( -1.102 8.745 -10.509) 13.716 6.449 ( 1.102 8.745 10.509) 13.716 6.677 ( 2.657 -3.476 -7.720) 8.873 6.677 ( -2.657 -3.476 7.720) 8.873 7.009 ( -2.816 -10.238 -0.962) 10.662 7.009 ( 2.816 -10.238 0.962) 10.662 7.679 ( 2.198 11.039 -5.601) 12.572 7.679 ( -2.198 11.039 5.601) 12.572 8.295 ( 6.111 4.816 -7.553) 10.843 8.295 ( -6.111 4.816 7.553) 10.843 8.715 ( 0.888 0.012 -6.136) 6.200 8.715 ( -0.888 0.012 6.136) 6.200 9.324 ( 5.814 -1.642 -4.817) 7.727 9.324 ( -5.814 -1.642 4.817) 7.727 9.837 ( -4.713 -2.889 -2.606) 6.112 9.837 ( 4.713 -2.889 2.606) 6.112 10.318 ( -4.272 2.120 -0.527) 4.798 10.318 ( 4.272 2.120 0.527) 4.798 11.095 ( -0.705 -0.670 -3.509) 3.641 11.095 ( 0.705 -0.670 3.509) 3.641 11.579 ( -2.332 3.308 -3.662) 5.458 11.579 ( 2.332 3.308 3.662) 5.458 12.114 ( 2.957 0.616 -6.749) 7.394 12.114 ( -2.957 0.616 6.749) 7.394 12.303 ( 2.964 -1.848 -2.065) 4.057 12.303 ( -2.964 -1.848 2.065) 4.057 13.614 ( 1.884 -3.972 -12.156) 12.927 13.614 ( -1.884 -3.972 12.156) 12.927 14.308 ( -7.240 -2.983 -12.967) 15.148 14.308 ( 7.240 -2.983 12.967) 15.148 15.526 ( -4.689 0.940 -2.010) 5.187 15.526 ( 4.689 0.940 2.010) 5.187 16.040 ( -6.941 0.935 -4.307) 8.222 16.040 ( 6.941 0.935 4.307) 8.222 18.205 ( -4.801 3.117 -12.250) 13.522 18.205 ( 4.801 3.117 12.250) 13.522 18.965 ( 1.714 -2.520 -7.536) 8.129 18.965 ( -1.714 -2.520 7.536) 8.129 ======================= Grid point 473 (238/260) ======================= q-point: ( 0.10 0.12 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 400 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.891 ( 2.914 -0.830 -6.334) 7.022 2.125 ( 10.437 7.218 -0.144) 12.691 2.862 ( -3.341 -0.065 0.559) 3.388 2.994 ( 2.893 -0.811 -1.309) 3.278 4.240 ( 2.314 4.624 -12.495) 13.523 4.295 ( -2.319 5.939 12.148) 13.720 4.870 ( -5.660 2.420 -4.496) 7.622 4.950 ( -1.545 3.401 -9.659) 10.356 5.709 ( -3.112 -2.795 -4.934) 6.468 5.868 ( 2.655 -9.314 -0.300) 9.690 6.361 ( -1.543 8.358 -6.959) 10.985 6.539 ( 1.747 7.737 6.340) 10.154 6.669 ( -2.877 -2.315 6.812) 7.748 6.687 ( 3.059 -2.926 -5.813) 7.191 6.953 ( -3.343 -11.006 5.332) 12.678 7.082 ( 1.644 -8.497 5.602) 10.309 7.649 ( -0.677 10.193 -0.202) 10.218 7.726 ( 3.374 10.796 -3.192) 11.753 8.166 ( -9.273 6.221 0.585) 11.182 8.298 ( 1.186 4.006 -16.462) 16.984 8.596 ( -6.821 -0.597 -0.740) 6.887 8.744 ( 0.277 2.619 -3.494) 4.375 9.295 ( -2.169 -2.514 9.910) 10.452 9.444 ( 8.226 -1.530 -2.881) 8.849 9.652 ( -11.053 -5.546 -1.239) 12.428 9.912 ( 1.219 0.577 -0.450) 1.422 10.316 ( 2.721 -1.631 3.687) 4.864 10.451 ( 7.476 3.147 2.797) 8.580 10.935 ( -10.186 -1.384 -1.705) 10.420 11.028 ( -8.929 1.268 0.699) 9.046 11.494 ( -4.618 0.223 -2.609) 5.309 11.629 ( -1.441 5.056 1.705) 5.527 12.047 ( -3.249 -0.912 5.800) 6.711 12.263 ( 7.300 -0.369 5.521) 9.160 12.293 ( 4.600 -1.909 -0.006) 4.981 12.476 ( 11.690 -1.464 -1.453) 11.870 13.584 ( 1.871 -5.043 -8.951) 10.443 13.662 ( 0.236 -2.289 9.917) 10.181 14.120 ( -3.248 0.449 -12.557) 12.978 14.534 ( 7.868 -4.808 10.961) 14.324 15.346 ( -8.551 2.074 7.024) 11.259 15.786 ( 9.947 -0.758 -0.086) 9.976 15.906 ( -0.175 0.941 -2.802) 2.961 16.208 ( 7.657 1.376 3.672) 8.603 17.998 ( -8.039 2.785 -13.279) 15.770 18.341 ( 1.868 3.008 9.796) 10.416 18.688 ( -17.950 -5.023 0.116) 18.640 19.086 ( 4.050 0.807 -5.741) 7.072 ======================= Grid point 474 (239/260) ======================= q-point: ( 0.20 0.12 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 400 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.978 ( 10.154 -7.082 -8.253) 14.879 2.322 ( 10.047 5.300 -1.582) 11.469 2.798 ( -3.510 -1.467 -0.615) 3.853 2.996 ( -1.937 -2.953 -2.679) 4.433 4.197 ( 0.645 3.708 -10.630) 11.277 4.332 ( -1.632 6.122 11.900) 13.481 4.730 ( -3.152 2.441 -10.933) 11.637 4.807 ( -5.474 3.492 -12.073) 13.708 5.638 ( 0.352 1.449 -7.968) 8.106 5.915 ( 2.429 -9.052 0.989) 9.424 6.302 ( -1.098 7.094 -4.453) 8.448 6.598 ( 1.379 4.531 2.827) 5.516 6.659 ( -1.611 -0.811 6.409) 6.658 6.715 ( 1.646 0.222 -1.269) 2.090 6.954 ( -0.588 -11.435 6.446) 13.140 7.134 ( -0.677 -6.115 8.371) 10.389 7.651 ( 1.513 8.914 -2.456) 9.369 7.760 ( 2.275 9.877 -4.209) 10.974 7.958 ( -11.044 7.250 -3.245) 13.604 8.152 ( -3.390 4.766 -19.319) 20.185 8.467 ( -6.151 0.998 -0.553) 6.255 8.695 ( -2.301 2.814 -6.060) 7.067 9.341 ( -0.806 -2.739 12.204) 12.533 9.438 ( -9.922 -4.183 1.875) 10.930 9.569 ( 7.007 -1.736 -6.509) 9.720 9.906 ( -1.219 0.156 -0.459) 1.312 10.412 ( 3.873 -5.145 3.108) 7.151 10.606 ( 5.185 1.902 2.530) 6.075 10.741 ( -7.894 -0.457 -2.171) 8.200 10.853 ( -8.268 0.424 2.643) 8.690 11.351 ( -8.589 -2.276 -0.020) 8.885 11.564 ( -5.836 6.007 4.709) 9.608 12.003 ( -4.816 -2.328 2.723) 6.002 12.412 ( 6.265 -2.209 -1.279) 6.765 12.472 ( 9.352 0.706 7.517) 12.019 12.672 ( 7.709 -4.692 -0.071) 9.025 13.577 ( 2.249 -5.083 -4.035) 6.868 13.781 ( 8.623 2.351 1.625) 9.084 14.045 ( 1.611 2.291 -6.303) 6.897 14.728 ( 4.911 -4.940 10.852) 12.896 15.278 ( -3.598 1.869 7.762) 8.757 15.721 ( -4.792 0.352 -5.629) 7.401 16.160 ( 14.857 -2.047 5.297) 15.906 16.380 ( 7.695 2.592 4.513) 9.290 17.743 ( -9.358 1.266 -13.724) 16.659 18.265 ( -20.323 -2.759 -1.114) 20.540 18.439 ( -0.914 0.722 5.792) 5.908 19.062 ( -1.799 3.358 -7.503) 8.414 ======================= Grid point 475 (240/260) ======================= q-point: ( 0.30 0.12 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 400 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.146 ( 11.925 -10.269 -8.739) 18.001 2.478 ( 7.156 0.936 -2.153) 7.531 2.716 ( -4.340 -3.833 -1.017) 5.879 2.881 ( -7.537 -3.935 -3.431) 9.169 4.142 ( -0.163 2.716 -7.131) 7.632 4.364 ( -3.248 5.613 10.366) 12.227 4.607 ( -3.404 2.677 -11.328) 12.127 4.646 ( -1.252 3.823 -11.966) 12.624 5.637 ( 4.534 4.158 -6.916) 9.257 5.973 ( 2.191 -5.608 0.822) 6.076 6.269 ( 0.337 4.915 -1.468) 5.140 6.609 ( -1.855 -0.326 4.151) 4.559 6.709 ( 3.235 0.934 -3.009) 4.515 6.744 ( 0.722 4.059 9.542) 10.394 6.967 ( -2.512 -13.075 2.173) 13.490 7.186 ( 1.717 -1.996 8.508) 8.906 7.642 ( -3.651 11.816 -6.365) 13.909 7.710 ( -4.664 6.478 -3.981) 8.919 7.788 ( 0.813 3.912 -6.577) 7.695 7.986 ( -3.275 8.377 -10.317) 13.687 8.350 ( -5.350 2.276 -0.985) 5.897 8.576 ( -5.586 1.047 -7.330) 9.275 9.315 ( -3.617 -2.833 5.101) 6.865 9.417 ( -0.380 -1.136 13.001) 13.056 9.627 ( 4.428 -1.914 -9.926) 11.036 9.854 ( -3.458 -0.442 -2.672) 4.392 10.466 ( 0.246 -3.665 -2.894) 4.676 10.590 ( -6.160 -1.094 2.926) 6.907 10.650 ( -0.798 -1.845 0.417) 2.053 10.794 ( -2.023 -1.767 2.801) 3.881 11.209 ( -5.925 -4.464 3.721) 8.299 11.508 ( -2.964 4.248 5.277) 7.394 11.912 ( -5.109 -0.651 2.415) 5.688 12.436 ( -2.998 -3.421 -4.416) 6.340 12.686 ( 8.095 -0.047 5.292) 9.671 12.781 ( 4.965 -3.531 0.132) 6.094 13.642 ( 5.294 -3.192 0.584) 6.209 13.929 ( 4.758 9.229 -5.492) 11.747 14.152 ( 12.942 -1.898 0.557) 13.092 14.844 ( -0.787 -3.205 12.564) 12.990 15.289 ( 0.345 -0.492 4.688) 4.726 15.601 ( -3.863 0.228 -5.808) 6.979 16.434 ( 9.593 -3.156 4.528) 11.067 16.576 ( 8.910 3.763 7.862) 12.464 17.483 ( -8.852 -1.826 -12.112) 15.112 17.844 ( -19.113 -0.632 -5.732) 19.964 18.477 ( 0.191 1.909 6.705) 6.974 18.942 ( -4.918 4.378 -8.631) 10.856 ======================= Grid point 476 (241/260) ======================= q-point: ( 0.40 0.12 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 400 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.310 ( 10.285 -9.682 -7.533) 16.008 2.571 ( 4.542 -1.762 -4.385) 6.555 2.619 ( -6.492 -8.885 1.484) 11.103 2.706 ( -7.452 -3.177 -0.386) 8.111 4.120 ( 1.418 2.308 -2.534) 3.710 4.292 ( -6.580 3.647 -0.340) 7.531 4.535 ( -1.576 4.591 4.237) 6.443 4.584 ( 2.052 3.922 -13.105) 13.832 5.723 ( 7.180 4.917 -2.888) 9.169 5.965 ( -3.201 0.301 -1.352) 3.488 6.330 ( 6.072 0.219 1.107) 6.176 6.585 ( -3.538 -3.195 2.730) 5.494 6.723 ( 1.197 0.259 -1.913) 2.272 6.839 ( -2.232 2.788 5.210) 6.317 6.911 ( 1.171 -5.397 5.404) 7.727 7.251 ( -2.061 2.735 -2.523) 4.254 7.484 ( -2.000 5.847 0.775) 6.228 7.662 ( -0.375 3.843 -8.037) 8.917 7.796 ( 3.019 5.273 -4.185) 7.377 7.899 ( -2.901 10.390 -0.685) 10.809 8.267 ( -2.611 2.205 0.902) 3.534 8.410 ( -6.319 0.300 -6.868) 9.338 9.358 ( 3.863 -1.023 6.831) 7.914 9.491 ( -0.445 -2.076 12.401) 12.581 9.623 ( 1.826 -1.913 -10.257) 10.593 9.737 ( -5.671 0.448 -6.046) 8.302 10.409 ( 0.034 -0.348 -9.547) 9.553 10.485 ( -8.173 -1.614 8.348) 11.794 10.681 ( 2.256 -3.422 -0.597) 4.142 10.745 ( -3.779 -3.563 2.613) 5.814 11.201 ( 1.553 -6.865 6.761) 9.760 11.463 ( -4.312 -3.854 -2.254) 6.208 11.903 ( 2.264 3.664 7.028) 8.243 12.274 ( -8.446 -2.091 -7.586) 11.544 12.835 ( 4.063 -0.429 4.577) 6.135 12.870 ( 3.877 -1.297 -1.256) 4.277 13.759 ( 5.017 -0.081 3.332) 6.023 13.928 ( -0.464 7.118 -4.922) 8.666 14.453 ( 16.449 -1.308 -2.131) 16.638 14.845 ( -7.011 -1.370 11.439) 13.486 15.339 ( 2.212 -2.781 2.971) 4.631 15.499 ( -3.183 -0.733 -5.497) 6.394 16.611 ( 6.741 -1.820 4.937) 8.551 16.769 ( 4.627 2.658 5.242) 7.480 17.280 ( -5.076 -3.884 -5.673) 8.546 17.497 ( -12.244 2.709 -7.578) 14.652 18.537 ( 1.711 2.416 7.324) 7.899 18.785 ( -5.359 4.101 -8.921) 11.186 ======================= Grid point 477 (242/260) ======================= q-point: ( 0.50 0.12 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 208 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.462 ( -8.951 -7.535 2.640) 11.994 2.462 ( 8.951 -7.535 -2.640) 11.994 2.625 ( 3.002 -5.176 -8.708) 10.566 2.625 ( -3.002 -5.176 8.708) 10.566 4.172 ( -3.442 2.576 -2.116) 4.792 4.172 ( 3.442 2.576 2.116) 4.792 4.551 ( 2.813 4.675 -12.392) 13.540 4.551 ( -2.813 4.675 12.392) 13.540 5.856 ( -6.588 3.792 -0.537) 7.620 5.856 ( 6.588 3.792 0.537) 7.620 6.479 ( -6.216 -3.421 -1.304) 7.214 6.479 ( 6.216 -3.421 1.304) 7.214 6.761 ( -2.849 -1.411 -0.957) 3.320 6.761 ( 2.849 -1.411 0.957) 3.320 7.079 ( -5.789 5.251 -12.624) 14.848 7.079 ( 5.789 5.251 12.624) 14.848 7.572 ( -3.271 2.116 -8.962) 9.772 7.572 ( 3.271 2.116 8.962) 9.772 7.843 ( 2.486 8.232 -5.350) 10.128 7.843 ( -2.486 8.232 5.350) 10.128 8.281 ( -2.612 1.199 -4.375) 5.235 8.281 ( 2.612 1.199 4.375) 5.235 9.503 ( -3.020 -2.810 -4.179) 5.872 9.503 ( 3.020 -2.810 4.179) 5.872 9.605 ( 0.642 0.744 -7.655) 7.718 9.605 ( -0.642 0.744 7.655) 7.718 10.400 ( 5.859 -0.587 -10.777) 12.281 10.400 ( -5.859 -0.587 10.777) 12.281 10.708 ( 1.842 -3.436 -2.215) 4.484 10.708 ( -1.842 -3.436 2.215) 4.484 11.325 ( -5.308 -7.597 -7.424) 11.875 11.325 ( 5.308 -7.597 7.424) 11.875 12.060 ( -7.840 1.921 -8.351) 11.615 12.060 ( 7.840 1.921 8.351) 11.615 12.897 ( 1.989 -0.631 -7.472) 7.758 12.897 ( -1.989 -0.631 7.472) 7.758 13.863 ( -1.948 3.651 -5.755) 7.088 13.863 ( 1.948 3.651 5.755) 7.088 14.712 ( 8.604 -1.040 -7.030) 11.160 14.712 ( -8.604 -1.040 7.030) 11.160 15.410 ( -2.714 -2.390 -4.454) 5.737 15.410 ( 2.714 -2.390 4.454) 5.737 16.760 ( -4.765 -0.502 -4.133) 6.328 16.760 ( 4.765 -0.502 4.133) 6.328 17.284 ( -1.560 0.782 -10.152) 10.301 17.284 ( 1.560 0.782 10.152) 10.301 18.639 ( -3.685 3.236 -8.595) 9.896 18.639 ( 3.685 3.236 8.595) 9.896 ======================= Grid point 483 (243/260) ======================= q-point: ( 0.00 0.25 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 208 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.081 ( -5.230 7.407 -7.452) 11.737 2.081 ( 5.230 7.407 7.452) 11.737 2.943 ( 1.119 1.134 -2.605) 3.053 2.943 ( -1.119 1.134 2.605) 3.053 4.410 ( 2.476 8.426 -13.905) 16.446 4.410 ( -2.476 8.426 13.905) 16.446 5.036 ( 2.867 3.198 -3.219) 5.367 5.036 ( -2.867 3.198 3.219) 5.367 5.653 ( -0.287 -7.429 -2.621) 7.883 5.653 ( 0.287 -7.429 2.621) 7.883 6.484 ( 3.725 -10.546 -7.060) 13.227 6.484 ( -3.725 -10.546 7.060) 13.227 6.675 ( 0.899 8.566 -9.318) 12.689 6.675 ( -0.899 8.566 9.318) 12.689 6.904 ( 0.115 -0.269 -3.049) 3.063 6.904 ( -0.115 -0.269 3.049) 3.063 7.859 ( 4.050 6.256 -5.370) 9.185 7.859 ( -4.050 6.256 5.370) 9.185 8.428 ( -0.279 7.941 -2.223) 8.252 8.428 ( 0.279 7.941 2.223) 8.252 8.733 ( -4.056 2.204 -5.564) 7.230 8.733 ( 4.056 2.204 5.564) 7.230 9.287 ( 6.164 -1.795 -3.399) 7.265 9.287 ( -6.164 -1.795 3.399) 7.265 9.727 ( -8.101 -8.045 -3.712) 12.005 9.727 ( 8.101 -8.045 3.712) 12.005 10.388 ( -3.369 4.623 -2.519) 6.250 10.388 ( 3.369 4.623 2.519) 6.250 11.082 ( 0.134 -0.646 -3.094) 3.164 11.082 ( -0.134 -0.646 3.094) 3.164 11.633 ( -6.664 1.125 -3.368) 7.551 11.633 ( 6.664 1.125 3.368) 7.551 12.118 ( -3.535 -0.293 -6.111) 7.066 12.118 ( 3.535 -0.293 6.111) 7.066 12.291 ( -3.986 1.436 -0.588) 4.277 12.291 ( 3.986 1.436 0.588) 4.277 13.512 ( 0.537 -5.740 -10.997) 12.416 13.512 ( -0.537 -5.740 10.997) 12.416 14.230 ( -4.812 -4.475 -9.443) 11.504 14.230 ( 4.812 -4.475 9.443) 11.504 15.550 ( 5.891 1.375 -6.893) 9.171 15.550 ( -5.891 1.375 6.893) 9.171 16.063 ( -6.652 1.280 -5.662) 8.829 16.063 ( 6.652 1.280 5.662) 8.829 18.287 ( -4.190 4.732 -11.641) 13.246 18.287 ( 4.190 4.732 11.641) 13.246 18.901 ( -5.682 -3.616 -8.717) 11.016 18.901 ( 5.682 -3.616 8.717) 11.016 ======================= Grid point 485 (244/260) ======================= q-point: ( 0.10 0.25 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 400 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.939 ( -2.333 5.484 -8.554) 10.425 2.253 ( 7.405 5.034 2.086) 9.194 2.880 ( -3.110 2.072 -1.773) 4.137 2.968 ( 0.609 -1.714 -3.513) 3.956 4.362 ( 1.090 7.147 -12.733) 14.643 4.445 ( -2.581 8.346 12.746) 15.453 4.925 ( -5.926 2.862 -3.994) 7.698 5.023 ( -1.777 3.311 -8.807) 9.575 5.638 ( 1.065 -4.086 -2.003) 4.674 5.702 ( 2.653 -6.563 1.187) 7.178 6.432 ( -3.152 -5.598 1.892) 6.697 6.523 ( 3.203 -11.743 -4.201) 12.876 6.634 ( -0.274 3.340 -3.620) 4.933 6.731 ( 0.957 8.968 5.370) 10.497 6.832 ( -4.458 0.145 6.394) 7.796 7.007 ( 4.054 0.353 3.854) 5.605 7.816 ( -2.248 5.683 1.477) 6.287 7.900 ( 4.376 6.276 -8.826) 11.681 8.330 ( -5.880 9.139 -3.765) 11.501 8.426 ( -1.366 8.787 -6.421) 10.969 8.606 ( -5.036 1.941 -3.498) 6.432 8.808 ( 1.180 3.902 -0.596) 4.120 9.223 ( -3.745 -4.497 7.639) 9.623 9.399 ( 6.100 -3.114 -1.786) 7.078 9.528 ( -8.783 -6.468 -1.591) 11.022 9.862 ( 3.011 -5.733 2.562) 6.964 10.334 ( -0.786 3.610 0.610) 3.744 10.509 ( 5.923 2.488 2.836) 7.023 10.909 ( -10.673 -1.162 0.647) 10.755 11.054 ( -7.175 1.204 -1.749) 7.482 11.479 ( -7.189 -2.302 -3.861) 8.478 11.732 ( 0.413 4.252 0.169) 4.275 12.027 ( -3.419 -1.088 1.361) 3.837 12.201 ( 2.016 -2.434 5.649) 6.473 12.304 ( 6.572 0.101 5.134) 8.340 12.461 ( 8.936 0.708 -1.172) 9.040 13.475 ( 1.792 -5.216 -7.276) 9.130 13.597 ( 3.418 -4.063 8.931) 10.390 14.122 ( -0.139 -0.257 -8.805) 8.810 14.410 ( 7.470 -7.028 8.257) 13.167 15.400 ( -8.341 3.054 9.166) 12.764 15.765 ( 9.053 -1.276 -1.914) 9.340 15.932 ( -0.023 1.498 -5.685) 5.880 16.241 ( 8.035 1.756 5.136) 9.696 18.075 ( -9.363 4.812 -12.168) 16.090 18.416 ( 2.392 3.916 7.561) 8.845 18.571 ( -18.154 -6.085 -4.224) 19.607 19.095 ( 5.915 0.084 -0.045) 5.916 ======================= Grid point 486 (245/260) ======================= q-point: ( 0.20 0.25 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 400 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.901 ( 4.358 0.014 -9.661) 10.598 2.369 ( 3.561 -0.568 0.556) 3.649 2.800 ( -2.722 1.632 -6.806) 7.509 2.914 ( -3.521 -4.848 -4.787) 7.669 4.290 ( -0.666 5.258 -11.383) 12.556 4.471 ( -2.925 6.844 12.665) 14.690 4.791 ( -3.385 3.382 -9.096) 10.277 4.883 ( -5.422 3.554 -10.960) 12.734 5.670 ( 4.043 1.212 -4.443) 6.128 5.771 ( 3.566 -4.410 3.105) 6.466 6.390 ( -1.878 -0.365 0.107) 1.916 6.555 ( 0.307 -9.093 1.603) 9.238 6.642 ( 4.333 -1.373 -4.302) 6.259 6.764 ( -0.440 3.521 3.044) 4.675 6.815 ( -2.719 2.945 10.816) 11.535 7.096 ( 2.197 0.910 5.269) 5.781 7.795 ( 0.100 4.535 -1.761) 4.866 7.908 ( 3.094 5.653 -12.472) 14.039 8.156 ( -9.316 11.292 -5.935) 15.797 8.308 ( -4.555 10.203 -7.453) 13.431 8.513 ( -3.548 3.740 -1.634) 5.408 8.755 ( -4.302 2.840 -6.197) 8.060 9.219 ( -2.695 -8.612 8.333) 12.283 9.383 ( -4.435 -1.721 7.434) 8.826 9.522 ( 6.196 -2.829 -6.392) 9.341 9.882 ( -1.548 -3.010 1.137) 3.571 10.349 ( 1.030 -0.471 1.396) 1.797 10.612 ( 1.492 -1.100 2.712) 3.285 10.728 ( -7.813 -0.784 0.352) 7.861 10.870 ( -8.996 1.170 -0.518) 9.087 11.296 ( -9.353 -4.113 -2.057) 10.422 11.660 ( -6.190 3.339 -0.248) 7.037 11.976 ( -3.768 0.204 2.736) 4.662 12.325 ( 6.994 -4.834 -1.547) 8.641 12.487 ( 7.272 -3.264 6.811) 10.485 12.589 ( 4.340 -0.564 3.526) 5.620 13.504 ( 4.425 -1.844 -1.209) 4.944 13.785 ( 12.139 -1.579 4.156) 12.928 14.104 ( 2.500 3.205 -6.584) 7.738 14.602 ( 6.501 -7.146 9.050) 13.237 15.329 ( -5.347 3.083 8.994) 10.908 15.722 ( -4.752 -0.429 -5.255) 7.098 16.121 ( 14.308 -1.616 0.121) 14.400 16.436 ( 8.627 2.766 6.116) 10.931 17.779 ( -13.139 2.305 -12.275) 18.128 18.184 ( -17.478 -4.618 -7.057) 19.407 18.483 ( 0.761 3.193 5.535) 6.436 19.131 ( -1.282 3.156 -1.891) 3.896 ======================= Grid point 487 (246/260) ======================= q-point: ( 0.30 0.25 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 400 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.975 ( 8.562 -5.835 -8.571) 13.447 2.399 ( -1.014 -7.358 1.754) 7.632 2.687 ( -2.736 -0.131 -11.772) 12.086 2.784 ( -6.523 -4.895 -4.288) 9.215 4.210 ( -0.721 3.862 -8.234) 9.123 4.478 ( -4.939 4.986 10.653) 12.757 4.680 ( -1.786 4.329 -10.981) 11.937 4.728 ( -2.699 3.955 -8.695) 9.926 5.733 ( 5.530 4.685 -4.587) 8.578 5.880 ( 4.800 -3.031 3.628) 6.737 6.364 ( -0.697 3.740 0.268) 3.814 6.560 ( -1.540 -6.884 4.538) 8.388 6.699 ( 3.318 -1.015 -5.721) 6.691 6.763 ( -1.151 -1.236 2.403) 2.937 6.873 ( 0.920 5.039 13.657) 14.586 7.169 ( 3.013 -0.428 3.952) 4.988 7.783 ( -1.217 1.849 -5.455) 5.887 7.836 ( -2.739 6.228 -15.578) 16.999 7.950 ( -4.351 12.359 -4.013) 13.703 8.207 ( -2.989 11.729 -1.712) 12.224 8.428 ( -3.996 5.543 -2.260) 7.197 8.594 ( -7.378 0.639 -6.602) 9.921 9.233 ( -0.010 -5.228 7.261) 8.947 9.400 ( -0.988 -0.373 11.060) 11.111 9.573 ( 3.958 -3.362 -9.041) 10.426 9.835 ( -3.118 -1.528 -1.351) 3.726 10.377 ( 1.182 -4.031 0.071) 4.201 10.560 ( -7.808 -2.730 4.177) 9.267 10.618 ( -3.203 -0.978 -0.777) 3.438 10.748 ( -5.175 -2.440 0.901) 5.792 11.135 ( -5.503 -3.837 -0.590) 6.734 11.518 ( -7.805 -2.254 -2.008) 8.369 11.940 ( -1.332 3.319 4.313) 5.603 12.348 ( -2.249 -4.650 -5.587) 7.609 12.654 ( 7.364 -6.486 2.965) 10.251 12.722 ( 5.182 0.740 7.283) 8.969 13.630 ( 7.164 1.839 4.040) 8.428 14.092 ( 17.187 0.395 -0.290) 17.194 14.109 ( 1.442 3.956 -4.919) 6.475 14.757 ( 2.388 -5.127 11.605) 12.910 15.290 ( -3.450 0.742 5.274) 6.346 15.596 ( -4.690 -0.913 -5.665) 7.411 16.378 ( 11.332 -2.317 1.533) 11.667 16.649 ( 8.757 3.366 7.696) 12.134 17.447 ( -13.353 -1.508 -8.922) 16.130 17.832 ( -13.389 -0.491 -10.241) 16.864 18.529 ( 1.092 2.976 4.634) 5.615 19.039 ( -5.995 4.733 -3.519) 8.410 ======================= Grid point 488 (247/260) ======================= q-point: ( 0.40 0.25 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 400 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.104 ( 9.275 -9.591 -6.143) 14.688 2.358 ( -4.925 -12.665 3.094) 13.937 2.572 ( -1.489 -1.354 -9.035) 9.256 2.636 ( -5.631 -3.258 -3.264) 7.279 4.180 ( 1.793 3.405 -3.809) 5.415 4.375 ( -7.902 4.222 0.095) 8.959 4.635 ( -0.589 4.768 2.661) 5.492 4.668 ( 1.307 3.956 -8.968) 9.888 5.828 ( 6.331 4.737 -2.411) 8.267 5.958 ( 0.905 -0.759 1.235) 1.709 6.380 ( 2.174 4.511 0.990) 5.105 6.537 ( -3.735 -2.264 2.892) 5.238 6.711 ( 1.456 -1.910 -2.810) 3.697 6.749 ( -1.623 -2.311 1.743) 3.319 6.996 ( 3.074 5.602 13.333) 14.785 7.254 ( 2.645 -1.852 -1.442) 3.537 7.599 ( -5.078 4.626 -7.534) 10.195 7.748 ( -2.603 4.065 -8.223) 9.535 7.949 ( 4.602 9.673 -2.996) 11.123 8.151 ( -3.951 13.386 2.048) 14.106 8.344 ( -3.438 5.613 0.244) 6.586 8.421 ( -5.335 0.916 -6.767) 8.666 9.318 ( 3.660 -3.246 7.803) 9.210 9.451 ( -0.165 -1.331 7.075) 7.201 9.573 ( 1.732 -2.814 -6.351) 7.159 9.743 ( -4.563 -0.006 -4.572) 6.460 10.379 ( 0.999 -3.060 -6.453) 7.211 10.442 ( -7.587 -2.592 8.607) 11.763 10.595 ( 0.517 -4.271 -0.570) 4.340 10.650 ( -4.624 -5.530 1.638) 7.393 11.090 ( 0.515 -4.290 1.567) 4.596 11.341 ( -8.160 -6.708 -4.408) 11.446 11.987 ( 3.086 4.224 4.457) 6.872 12.230 ( -5.655 -2.051 -4.399) 7.452 12.794 ( 5.113 -4.708 1.787) 7.177 12.836 ( 2.688 -1.169 3.554) 4.606 13.804 ( 6.961 4.355 6.633) 10.556 14.069 ( -1.621 6.383 -6.589) 9.316 14.423 ( 17.023 -1.467 -2.925) 17.334 14.808 ( -5.577 -2.165 12.335) 13.710 15.278 ( 0.445 -2.825 2.565) 3.841 15.469 ( -4.841 -2.275 -5.771) 7.868 16.579 ( 8.491 -1.231 3.090) 9.119 16.821 ( 2.899 2.358 3.002) 4.793 17.220 ( -4.926 -1.895 0.721) 5.327 17.540 ( -9.871 1.638 -11.988) 15.615 18.597 ( 3.269 3.297 4.654) 6.574 18.879 ( -7.406 4.819 -4.598) 9.961 ======================= Grid point 489 (248/260) ======================= q-point: ( 0.50 0.25 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 208 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.246 ( 2.328 -12.042 -2.799) 12.580 2.246 ( -2.328 -12.042 2.799) 12.580 2.549 ( 2.348 -2.695 -8.241) 8.983 2.549 ( -2.348 -2.695 8.241) 8.983 4.238 ( -2.205 3.724 -2.661) 5.080 4.238 ( 2.205 3.724 2.661) 5.080 4.648 ( 3.068 4.409 -11.224) 12.444 4.648 ( -3.068 4.409 11.224) 12.444 5.927 ( -0.717 2.594 -1.813) 3.245 5.927 ( 0.717 2.594 1.813) 3.245 6.456 ( -0.554 1.589 -3.915) 4.261 6.456 ( 0.554 1.589 3.915) 4.261 6.727 ( 1.369 -1.706 -1.720) 2.783 6.727 ( -1.369 -1.706 1.720) 2.783 7.161 ( -3.259 2.510 -15.616) 16.149 7.161 ( 3.259 2.510 15.616) 16.149 7.622 ( -4.516 2.308 -6.868) 8.538 7.622 ( 4.516 2.308 6.868) 8.538 8.053 ( 0.891 11.764 -2.735) 12.110 8.053 ( -0.891 11.764 2.735) 12.110 8.329 ( -0.445 3.720 -4.876) 6.149 8.329 ( 0.445 3.720 4.876) 6.149 9.434 ( -0.297 -3.914 -9.335) 10.127 9.434 ( 0.297 -3.914 9.335) 10.127 9.619 ( -2.678 0.622 -6.784) 7.320 9.619 ( 2.678 0.622 6.784) 7.320 10.376 ( 4.863 -2.046 -10.080) 11.377 10.376 ( -4.863 -2.046 10.080) 11.377 10.608 ( 0.925 -6.113 -1.853) 6.454 10.608 ( -0.925 -6.113 1.853) 6.454 11.172 ( -4.140 -6.617 -5.960) 9.821 11.172 ( 4.140 -6.617 5.960) 9.820 12.097 ( -5.284 1.666 -3.759) 6.695 12.097 ( 5.284 1.666 3.759) 6.695 12.862 ( 2.170 -2.967 -6.912) 7.829 12.862 ( -2.170 -2.967 6.912) 7.829 13.964 ( -4.205 5.974 -7.867) 10.736 13.964 ( 4.205 5.974 7.867) 10.736 14.686 ( 8.744 -1.394 -9.274) 12.822 14.686 ( -8.744 -1.394 9.274) 12.822 15.347 ( -3.628 -3.613 -4.917) 7.099 15.347 ( 3.628 -3.613 4.917) 7.099 16.752 ( -6.525 -0.198 -4.468) 7.911 16.752 ( 6.525 -0.198 4.468) 7.911 17.304 ( -5.725 1.136 -12.409) 13.713 17.304 ( 5.725 1.136 12.409) 13.713 18.717 ( -5.474 4.071 -5.417) 8.711 18.717 ( 5.474 4.071 5.417) 8.711 ======================= Grid point 495 (249/260) ======================= q-point: ( 0.00 0.38 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 208 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.217 ( -3.129 5.503 -5.751) 8.552 2.217 ( 3.129 5.503 5.751) 8.552 2.969 ( 0.997 1.241 -2.504) 2.967 2.969 ( -0.997 1.241 2.504) 2.967 4.571 ( 2.455 6.810 -14.779) 16.457 4.571 ( -2.455 6.810 14.779) 16.457 5.085 ( -0.088 1.538 -2.308) 2.774 5.085 ( 0.088 1.538 2.308) 2.774 5.525 ( 1.004 -4.993 -3.696) 6.293 5.525 ( -1.004 -4.993 3.696) 6.293 6.272 ( 1.518 -8.559 -4.112) 9.616 6.272 ( -1.518 -8.559 4.112) 9.616 6.809 ( 0.469 3.649 -7.878) 8.695 6.809 ( -0.469 3.649 7.878) 8.695 6.958 ( 2.904 4.535 -1.750) 5.663 6.958 ( -2.904 4.535 1.750) 5.663 7.929 ( 4.770 1.276 -6.202) 7.927 7.929 ( -4.770 1.276 6.202) 7.927 8.569 ( -1.939 5.029 -5.878) 7.975 8.569 ( 1.939 5.029 5.878) 7.975 8.814 ( -3.591 5.728 -5.599) 8.779 8.814 ( 3.591 5.728 5.599) 8.779 9.261 ( -0.483 -0.584 -1.985) 2.125 9.261 ( 0.483 -0.584 1.985) 2.125 9.542 ( -8.924 -9.477 -4.327) 13.717 9.542 ( 8.924 -9.477 4.327) 13.717 10.480 ( -1.331 4.003 -3.792) 5.672 10.480 ( 1.331 4.003 3.792) 5.672 11.070 ( 4.355 -0.544 -3.315) 5.500 11.070 ( -4.355 -0.544 3.315) 5.500 11.612 ( -8.550 -2.554 -3.337) 9.526 11.612 ( 8.550 -2.554 3.337) 9.526 12.121 ( -3.598 0.688 -8.993) 9.710 12.121 ( 3.598 0.688 8.993) 9.710 12.346 ( -3.184 3.177 -2.290) 5.048 12.346 ( 3.184 3.177 2.290) 5.048 13.406 ( -0.012 -4.388 -7.384) 8.589 13.406 ( 0.012 -4.388 7.384) 8.589 14.148 ( -2.500 -3.316 -5.739) 7.084 14.148 ( 2.500 -3.316 5.739) 7.084 15.575 ( 9.835 0.984 -9.555) 13.748 15.575 ( -9.835 0.984 9.555) 13.748 16.086 ( -6.504 0.903 -6.780) 9.439 16.086 ( 6.504 0.903 6.780) 9.439 18.377 ( -3.504 3.830 -8.583) 10.031 18.377 ( 3.504 3.830 8.583) 10.031 18.834 ( -11.889 -2.866 -7.464) 14.327 18.834 ( 11.889 -2.866 7.464) 14.327 ======================= Grid point 497 (250/260) ======================= q-point: ( 0.10 0.38 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 400 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.086 ( -4.434 8.321 -7.121) 11.816 2.307 ( 2.794 0.166 -0.617) 2.866 2.931 ( -2.509 -1.713 -5.293) 6.103 2.935 ( -2.296 2.779 -2.621) 4.457 4.499 ( -0.616 5.857 -13.516) 14.744 4.591 ( -4.756 5.458 13.972) 15.736 4.979 ( -4.921 2.539 -4.351) 7.042 5.061 ( -2.928 0.272 -7.198) 7.776 5.566 ( 4.425 -2.269 -0.511) 4.999 5.616 ( 6.481 -2.523 3.534) 7.801 6.221 ( -2.773 -10.611 3.816) 11.612 6.342 ( 4.199 -6.464 -0.725) 7.742 6.733 ( -2.836 4.400 -4.651) 7.003 6.821 ( -3.297 1.249 7.615) 8.392 6.935 ( 0.110 7.175 1.321) 7.296 7.047 ( 4.843 2.416 -0.142) 5.414 7.873 ( -2.792 0.729 0.720) 2.974 7.984 ( 5.613 2.392 -9.753) 11.504 8.474 ( -3.214 4.319 -8.186) 9.798 8.613 ( -0.678 8.508 2.474) 8.886 8.691 ( -5.268 6.797 -3.342) 9.226 8.895 ( 0.909 4.027 2.691) 4.928 9.123 ( -9.386 -5.187 -2.350) 10.978 9.324 ( 0.499 -3.552 3.745) 5.186 9.412 ( 0.173 -5.148 -1.701) 5.424 9.720 ( 5.424 -7.003 4.604) 9.983 10.433 ( -1.358 5.216 -2.175) 5.812 10.547 ( 2.299 1.225 3.471) 4.340 10.890 ( -11.314 -0.737 2.517) 11.614 11.073 ( -4.852 0.633 -4.112) 6.392 11.402 ( -10.441 -4.591 -3.546) 11.944 11.770 ( 5.522 -0.252 -2.137) 5.927 12.014 ( -3.014 0.021 -1.100) 3.208 12.201 ( -2.908 1.929 5.180) 6.245 12.290 ( 3.381 -0.984 4.728) 5.895 12.493 ( 6.136 1.599 2.285) 6.740 13.401 ( 3.288 -1.825 -2.012) 4.265 13.512 ( 6.712 -4.092 5.123) 9.383 14.114 ( 2.382 -0.385 -5.007) 5.558 14.280 ( 7.023 -5.306 5.769) 10.524 15.456 ( -8.006 2.268 11.303) 14.036 15.740 ( 7.577 -1.060 -4.440) 8.846 15.960 ( 0.664 1.135 -7.956) 8.064 16.271 ( 8.306 1.165 6.327) 10.506 18.182 ( -10.238 5.638 -10.858) 15.953 18.424 ( -10.250 -4.929 -9.442) 14.782 18.513 ( -5.956 1.858 8.343) 10.418 19.092 ( 7.995 -0.326 3.348) 8.674 ======================= Grid point 498 (251/260) ======================= q-point: ( 0.20 0.38 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 400 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.979 ( -1.263 7.075 -8.526) 11.151 2.309 ( -1.161 -5.346 -3.625) 6.562 2.812 ( -4.641 -2.742 -9.152) 10.622 2.854 ( -3.491 1.167 -5.797) 6.867 4.388 ( -2.221 4.109 -12.182) 13.047 4.573 ( -5.628 3.111 13.715) 15.148 4.859 ( -3.217 3.282 -8.547) 9.704 4.932 ( -4.492 1.193 -8.784) 9.937 5.673 ( 6.884 0.108 -0.979) 6.954 5.758 ( 5.228 1.843 3.495) 6.553 6.225 ( -0.448 -11.277 7.828) 13.734 6.440 ( 6.772 -3.408 -1.692) 7.768 6.662 ( -1.267 2.515 -3.884) 4.797 6.809 ( -3.532 1.533 10.496) 11.180 6.946 ( -0.418 7.158 2.460) 7.580 7.120 ( 2.894 0.454 -1.238) 3.180 7.834 ( -0.412 0.318 -3.546) 3.584 8.010 ( 3.250 4.091 -11.154) 12.317 8.347 ( -4.495 6.890 -8.897) 12.118 8.519 ( -7.256 10.260 -3.893) 13.156 8.608 ( -3.143 5.094 -1.252) 6.115 8.799 ( -8.300 1.371 -4.982) 9.776 9.038 ( -0.449 -8.784 8.459) 12.203 9.356 ( -1.135 -0.816 10.472) 10.565 9.461 ( 5.423 -3.115 -7.044) 9.420 9.800 ( 0.752 -4.264 2.645) 5.073 10.389 ( -2.009 3.628 -1.939) 4.578 10.578 ( -2.589 -1.873 3.882) 5.027 10.710 ( -8.451 -0.906 2.848) 8.964 10.896 ( -8.947 1.344 -3.854) 9.834 11.184 ( -9.180 -6.137 -3.057) 11.457 11.707 ( -8.050 1.634 -4.896) 9.563 12.004 ( -0.443 1.944 1.252) 2.355 12.248 ( 5.997 -2.591 1.466) 6.696 12.373 ( 2.778 -5.651 0.021) 6.297 12.618 ( 3.152 1.424 10.900) 11.436 13.509 ( 7.143 2.160 3.745) 8.349 13.731 ( 13.201 -3.481 2.646) 13.906 14.159 ( 4.732 2.105 -4.524) 6.877 14.471 ( 8.006 -5.333 7.442) 12.162 15.390 ( -6.385 2.617 10.097) 12.230 15.703 ( -4.834 -1.229 -4.978) 7.047 16.101 ( 13.896 -0.456 -4.454) 14.600 16.482 ( 9.199 1.700 6.914) 11.632 17.827 ( -18.166 2.225 -11.104) 21.407 18.103 ( -12.019 -3.232 -9.763) 15.818 18.544 ( 0.515 2.455 4.242) 4.928 19.179 ( -0.336 1.621 1.757) 2.415 ======================= Grid point 499 (252/260) ======================= q-point: ( 0.30 0.38 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 400 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.940 ( 2.463 2.391 -7.614) 8.352 2.231 ( -3.963 -9.047 -3.778) 10.575 2.661 ( -4.403 -2.167 -9.598) 10.779 2.729 ( -4.726 -0.708 -8.340) 9.612 4.283 ( -1.243 3.037 -9.318) 9.879 4.544 ( -6.351 1.634 11.957) 13.637 4.762 ( -0.677 3.396 -10.391) 10.952 4.794 ( -3.784 2.473 -7.456) 8.719 5.797 ( 6.622 1.581 -2.774) 7.351 5.870 ( 3.848 1.795 4.974) 6.539 6.303 ( 2.257 -8.079 11.798) 14.476 6.520 ( 2.523 3.374 -5.107) 6.620 6.663 ( 3.322 -2.360 -4.149) 5.815 6.812 ( -2.030 3.648 5.480) 6.889 6.972 ( -0.591 4.448 13.338) 14.073 7.148 ( 2.049 -1.939 -3.333) 4.367 7.797 ( -1.229 0.353 -7.174) 7.287 7.946 ( -2.613 4.087 -11.507) 12.488 8.185 ( -6.098 10.498 -5.559) 13.352 8.395 ( -0.820 5.527 -6.001) 8.199 8.531 ( -3.338 3.450 -2.017) 5.207 8.624 ( -8.416 3.431 -0.965) 9.140 9.120 ( 2.302 -5.629 9.966) 11.675 9.408 ( 0.008 1.101 8.899) 8.967 9.502 ( 3.654 -3.466 -8.282) 9.693 9.796 ( -1.725 -2.091 -0.035) 2.712 10.336 ( -1.939 -0.060 -1.684) 2.569 10.495 ( -8.013 -3.060 6.070) 10.508 10.590 ( -5.928 -2.260 2.073) 6.674 10.713 ( -7.670 -0.875 -4.293) 8.833 11.048 ( -2.827 -4.167 -2.849) 5.786 11.479 ( -11.351 -1.019 -4.715) 12.334 12.014 ( 0.819 3.575 2.375) 4.369 12.272 ( -2.055 -2.720 -3.994) 5.251 12.509 ( 10.209 -6.768 -0.141) 12.249 12.740 ( 1.327 0.494 12.503) 12.583 13.702 ( 8.578 4.786 7.611) 12.426 14.019 ( 13.723 -4.272 1.363) 14.437 14.227 ( 6.292 4.398 -6.432) 10.015 14.660 ( 5.257 -3.974 10.533) 12.425 15.317 ( -6.346 1.662 5.539) 8.586 15.566 ( -5.799 -1.835 -5.350) 8.101 16.345 ( 12.700 -0.997 -1.459) 12.822 16.704 ( 8.808 2.011 7.416) 11.688 17.427 ( -15.899 -0.537 -6.900) 17.340 17.826 ( -9.979 -0.135 -12.364) 15.889 18.583 ( 1.636 2.125 2.754) 3.843 19.115 ( -6.379 2.697 0.070) 6.926 ======================= Grid point 500 (253/260) ======================= q-point: ( 0.40 0.38 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 400 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.972 ( 4.653 -3.078 -5.074) 7.541 2.131 ( -4.488 -9.692 -1.334) 10.764 2.542 ( -2.535 -1.351 -5.895) 6.558 2.589 ( -4.185 -1.509 -6.980) 8.277 4.244 ( 2.211 2.662 -5.220) 6.263 4.445 ( -8.459 2.500 3.105) 9.351 4.708 ( -1.824 2.363 3.182) 4.363 4.731 ( 1.989 2.320 -10.248) 10.694 5.894 ( 5.239 1.937 -2.550) 6.140 5.949 ( 1.205 0.028 3.653) 3.847 6.438 ( 2.519 -1.196 12.700) 13.003 6.525 ( 2.143 3.727 -4.490) 6.217 6.674 ( 0.982 -2.005 -4.677) 5.182 6.772 ( -3.435 3.334 -0.069) 4.788 7.081 ( 0.928 2.938 14.592) 14.914 7.191 ( 4.002 -4.046 -1.673) 5.932 7.665 ( -4.845 2.159 -8.050) 9.641 7.805 ( -5.085 1.558 -9.588) 10.964 8.135 ( 3.580 7.782 -2.107) 8.821 8.385 ( 0.267 8.823 -0.850) 8.868 8.442 ( -6.662 1.774 -2.837) 7.455 8.474 ( -3.479 5.890 -0.683) 6.875 9.239 ( 3.094 -3.958 10.901) 12.003 9.435 ( 0.449 -0.847 -6.083) 6.159 9.530 ( 2.382 -1.052 3.447) 4.320 9.736 ( -3.489 -0.574 -3.006) 4.641 10.304 ( 0.210 -3.362 -2.962) 4.486 10.384 ( -7.680 -3.022 8.696) 11.989 10.520 ( -2.460 -4.382 0.902) 5.105 10.559 ( -4.541 -2.034 -4.492) 6.704 11.020 ( 1.139 -2.661 -1.764) 3.390 11.244 ( -9.723 -2.752 -3.700) 10.761 12.062 ( 2.516 3.206 1.846) 4.474 12.197 ( -3.152 -1.284 -2.336) 4.128 12.686 ( 8.618 -5.089 -3.020) 10.454 12.808 ( -1.659 -1.512 9.711) 9.967 13.911 ( 7.415 5.583 8.546) 12.617 14.152 ( 0.480 1.455 -2.956) 3.329 14.408 ( 16.307 0.176 -7.264) 17.853 14.766 ( -3.482 -1.866 13.256) 13.833 15.239 ( -2.269 -0.983 1.026) 2.678 15.417 ( -6.187 -2.543 -5.010) 8.357 16.563 ( 10.109 -0.423 1.164) 10.185 16.857 ( 1.138 1.245 1.017) 1.970 17.201 ( -3.937 -0.252 4.839) 6.243 17.564 ( -8.754 0.776 -13.764) 16.331 18.655 ( 4.462 2.212 2.329) 5.497 18.959 ( -8.760 2.913 -1.308) 9.324 ======================= Grid point 501 (254/260) ======================= q-point: ( 0.50 0.38 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 208 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.044 ( 1.952 -7.402 -5.272) 9.295 2.044 ( -1.952 -7.402 5.272) 9.295 2.509 ( 1.077 -1.354 -4.790) 5.093 2.509 ( -1.077 -1.354 4.790) 5.093 4.307 ( -0.205 2.764 -2.452) 3.700 4.307 ( 0.205 2.764 2.452) 3.700 4.713 ( 2.278 2.051 -9.446) 9.931 4.713 ( -2.278 2.051 9.446) 9.931 5.956 ( 2.199 0.704 -3.340) 4.060 5.956 ( -2.199 0.704 3.340) 4.060 6.521 ( 0.486 3.723 -7.210) 8.129 6.521 ( -0.486 3.723 7.210) 8.129 6.699 ( -0.908 -0.987 -0.735) 1.529 6.699 ( 0.908 -0.987 0.735) 1.529 7.183 ( 1.291 0.086 -13.305) 13.368 7.183 ( -1.291 0.086 13.305) 13.368 7.651 ( -4.463 0.664 -4.923) 6.677 7.651 ( 4.463 0.664 4.923) 6.677 8.254 ( -5.475 7.108 -1.088) 9.037 8.254 ( 5.475 7.108 1.088) 9.037 8.427 ( 1.747 5.607 -5.344) 7.940 8.427 ( -1.747 5.607 5.344) 7.940 9.360 ( -1.435 -3.140 -11.973) 12.460 9.360 ( 1.435 -3.139 11.973) 12.460 9.630 ( -3.890 0.489 -6.137) 7.283 9.630 ( 3.890 0.489 6.137) 7.283 10.315 ( 4.121 -3.741 -6.810) 8.795 10.315 ( -4.121 -3.741 6.810) 8.795 10.501 ( 0.366 -3.765 -2.714) 4.656 10.501 ( -0.366 -3.765 2.714) 4.656 11.079 ( -4.070 -2.796 -2.286) 5.441 11.079 ( 4.070 -2.796 2.286) 5.441 12.126 ( -2.694 1.263 -1.621) 3.389 12.126 ( 2.694 1.263 1.621) 3.389 12.792 ( 4.911 -3.429 -7.073) 9.269 12.792 ( -4.911 -3.429 7.074) 9.269 14.077 ( -4.269 4.710 -7.098) 9.528 14.077 ( 4.269 4.710 7.098) 9.528 14.661 ( 11.736 -1.043 -11.096) 16.185 14.661 ( -11.736 -1.043 11.096) 16.185 15.281 ( -4.069 -2.687 -3.403) 5.946 15.281 ( 4.069 -2.687 3.403) 5.946 16.752 ( -7.698 0.112 -3.615) 8.505 16.752 ( 7.698 0.112 3.615) 8.505 17.325 ( -6.717 0.822 -13.658) 15.242 17.325 ( 6.717 0.822 13.658) 15.242 18.786 ( -7.118 2.590 -2.438) 7.958 18.786 ( 7.118 2.590 2.438) 7.958 ======================= Grid point 507 (255/260) ======================= q-point: ( 0.00 -0.50 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 130 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.276 ( 2.844 0.000 -2.455) 3.757 2.276 ( -2.844 0.000 2.455) 3.757 2.983 ( -1.321 0.000 -0.705) 1.498 2.983 ( 1.321 0.000 0.705) 1.498 4.645 ( 2.762 0.000 -15.310) 15.558 4.645 ( -2.762 0.000 15.310) 15.558 5.099 ( -1.964 0.000 -1.782) 2.652 5.099 ( 1.964 0.000 1.782) 2.652 5.472 ( 1.590 0.000 -4.259) 4.546 5.472 ( -1.590 0.000 4.259) 4.546 6.183 ( -3.855 0.000 -2.118) 4.399 6.183 ( 3.855 0.000 2.118) 4.399 6.840 ( 1.211 0.000 -7.251) 7.352 6.840 ( -1.211 0.000 7.251) 7.352 7.015 ( 2.166 0.000 -2.406) 3.237 7.015 ( -2.166 0.000 2.406) 3.237 7.936 ( 5.296 0.000 -5.701) 7.781 7.936 ( -5.296 0.000 5.701) 7.781 8.616 ( -2.809 0.000 -7.274) 7.797 8.616 ( 2.809 0.000 7.274) 7.797 8.895 ( 1.997 0.000 -3.341) 3.892 8.895 ( -1.997 0.000 3.341) 3.892 9.261 ( 4.345 0.000 -4.931) 6.572 9.261 ( -4.345 0.000 4.931) 6.572 9.422 ( -11.618 0.000 -6.353) 13.241 9.422 ( 11.618 -0.000 6.353) 13.241 10.524 ( -0.083 0.000 -3.979) 3.980 10.524 ( 0.083 0.000 3.979) 3.980 11.063 ( 7.985 0.000 -4.343) 9.090 11.063 ( -7.985 0.000 4.343) 9.090 11.578 ( -9.200 0.000 -3.743) 9.932 11.578 ( 9.200 0.000 3.743) 9.932 12.131 ( -3.822 0.000 -10.924) 11.574 12.131 ( 3.822 0.000 10.924) 11.574 12.383 ( 8.449 0.000 -2.904) 8.934 12.383 ( -8.449 0.000 2.904) 8.934 13.358 ( 2.371 0.000 -1.767) 2.957 13.358 ( -2.371 0.000 1.767) 2.957 14.113 ( -1.569 0.000 -4.109) 4.399 14.113 ( 1.569 0.000 4.109) 4.399 15.585 ( 10.501 0.000 -10.330) 14.731 15.585 ( -10.501 0.000 10.330) 14.731 16.096 ( -6.444 0.000 -7.215) 9.674 16.096 ( 6.444 0.000 7.215) 9.674 18.419 ( -4.737 0.000 -2.444) 5.330 18.419 ( 4.737 0.000 2.444) 5.330 18.802 ( -17.461 0.000 -4.151) 17.947 18.802 ( 17.461 0.000 4.151) 17.947 ======================= Grid point 511 (256/260) ======================= q-point: ( 0.10 -0.50 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 250 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.209 ( -4.097 0.000 -1.057) 4.231 2.276 ( 0.297 0.000 -7.920) 7.925 2.910 ( -4.264 0.000 -4.664) 6.319 2.968 ( -1.880 0.000 -3.563) 4.028 4.563 ( -1.328 0.000 -14.457) 14.518 4.645 ( -6.586 -0.000 15.003) 16.385 5.017 ( -2.652 0.000 -4.883) 5.556 5.048 ( -4.968 0.000 -5.872) 7.691 5.550 ( 6.885 0.000 -2.345) 7.274 5.590 ( 8.311 0.000 7.574) 11.244 6.105 ( -3.132 0.000 0.109) 3.134 6.274 ( 4.243 0.000 2.831) 5.100 6.781 ( -2.448 0.000 -5.944) 6.429 6.830 ( -4.773 0.000 11.369) 12.330 7.024 ( 1.466 0.000 0.052) 1.467 7.067 ( 4.094 0.000 -3.491) 5.380 7.876 ( -2.980 0.000 0.686) 3.058 8.005 ( 6.563 0.000 -9.381) 11.449 8.512 ( -2.661 0.000 -9.058) 9.441 8.700 ( 1.360 0.000 3.754) 3.993 8.844 ( -4.913 -0.000 5.372) 7.280 8.873 ( -2.211 0.000 -1.747) 2.818 9.081 ( -13.847 0.000 -9.772) 16.948 9.292 ( -1.839 0.000 10.761) 10.917 9.338 ( 6.722 0.000 -5.858) 8.917 9.642 ( 6.639 -0.000 5.963) 8.924 10.497 ( -0.521 0.000 -4.079) 4.112 10.555 ( 0.108 0.000 4.586) 4.587 10.882 ( -11.696 0.000 3.442) 12.192 11.079 ( -3.288 0.000 -5.508) 6.415 11.346 ( -12.299 0.000 -3.175) 12.702 11.759 ( 7.941 0.000 -1.276) 8.043 12.017 ( -2.652 0.000 -3.969) 4.774 12.237 ( -7.430 0.000 2.759) 7.926 12.273 ( 3.381 0.000 7.793) 8.495 12.509 ( 5.029 0.000 2.420) 5.581 13.393 ( 3.574 0.000 5.436) 6.505 13.460 ( 9.001 0.000 -1.194) 9.079 14.110 ( 3.445 0.000 -3.585) 4.972 14.223 ( 6.715 0.000 4.941) 8.337 15.480 ( -7.848 0.000 12.360) 14.641 15.728 ( 6.903 0.000 -5.766) 8.995 15.972 ( 1.005 0.000 -8.817) 8.874 16.284 ( 8.396 0.000 6.772) 10.786 18.274 ( -6.924 0.000 -7.384) 10.122 18.334 ( -17.746 -0.000 -14.457) 22.890 18.539 ( -2.405 0.000 8.933) 9.251 19.087 ( 8.909 0.000 4.416) 9.943 ======================= Grid point 513 (257/260) ======================= q-point: ( 0.20 -0.50 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 250 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.118 ( -4.179 0.000 -1.763) 4.535 2.192 ( -2.006 0.000 -12.506) 12.666 2.778 ( -5.027 0.000 -7.605) 9.117 2.873 ( -4.147 0.000 -7.672) 8.721 4.433 ( -2.832 0.000 -12.865) 13.173 4.601 ( -7.046 -0.000 14.307) 15.948 4.902 ( -4.118 0.000 -9.344) 10.211 4.937 ( -2.794 0.000 -6.447) 7.026 5.680 ( 7.611 0.000 -1.539) 7.765 5.791 ( 6.436 0.000 6.188) 8.928 6.089 ( 0.473 0.000 5.279) 5.300 6.403 ( 8.009 0.000 2.005) 8.256 6.693 ( -2.583 0.000 -5.446) 6.027 6.823 ( -4.160 0.000 14.779) 15.353 7.043 ( 0.206 -0.000 -0.257) 0.329 7.105 ( 2.451 0.000 -4.842) 5.427 7.834 ( -0.489 0.000 -3.191) 3.228 8.053 ( 3.659 0.000 -10.227) 10.862 8.416 ( -0.005 0.000 -10.956) 10.956 8.660 ( -14.106 -0.000 -8.478) 16.458 8.669 ( -6.222 -0.000 -0.088) 6.222 8.798 ( -5.240 0.000 0.687) 5.285 8.929 ( 1.255 0.000 9.090) 9.177 9.350 ( 0.064 -0.000 11.450) 11.450 9.422 ( 6.007 0.000 -8.060) 10.052 9.751 ( 1.940 0.000 3.363) 3.882 10.440 ( -2.737 -0.000 -4.489) 5.257 10.554 ( -4.473 0.000 5.288) 6.926 10.699 ( -9.343 0.000 4.163) 10.228 10.914 ( -8.734 -0.000 -6.089) 10.647 11.109 ( -8.904 0.000 -2.544) 9.260 11.724 ( -8.443 0.000 -6.346) 10.562 12.028 ( 1.896 0.000 0.061) 1.897 12.223 ( 6.220 -0.000 3.670) 7.222 12.310 ( -1.187 0.000 -2.013) 2.337 12.631 ( 2.803 0.000 12.268) 12.584 13.550 ( 7.348 0.000 9.579) 12.073 13.680 ( 14.287 0.000 -1.755) 14.394 14.181 ( 5.705 0.000 -3.634) 6.764 14.414 ( 8.623 0.000 6.990) 11.100 15.419 ( -6.626 0.000 10.777) 12.651 15.688 ( -4.907 0.000 -5.256) 7.190 16.097 ( 13.687 0.000 -6.189) 15.022 16.499 ( 9.400 -0.000 7.157) 11.815 17.853 ( -21.571 0.000 -10.623) 24.045 18.068 ( -8.486 0.000 -10.549) 13.539 18.570 ( 0.387 0.000 3.659) 3.680 19.195 ( 0.095 0.000 2.966) 2.968 ======================= Grid point 515 (258/260) ======================= q-point: ( 0.30 -0.50 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 250 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.037 ( -3.418 0.000 -0.190) 3.423 2.069 ( -1.586 0.000 -13.371) 13.465 2.637 ( -4.079 0.000 -8.477) 9.407 2.724 ( -5.227 0.000 -9.758) 11.070 4.316 ( -1.429 0.000 -10.006) 10.107 4.556 ( -6.704 -0.000 12.855) 14.498 4.798 ( -0.216 0.000 -10.300) 10.302 4.819 ( -4.435 0.000 -7.006) 8.292 5.811 ( 6.747 0.000 -1.821) 6.989 5.901 ( 2.089 0.000 4.862) 5.292 6.204 ( 5.670 0.000 11.906) 13.188 6.574 ( 7.863 0.000 -3.070) 8.441 6.625 ( -1.087 0.000 -4.515) 4.644 6.854 ( -1.559 0.000 11.375) 11.482 7.032 ( -2.614 -0.000 8.147) 8.556 7.110 ( 2.012 0.000 -6.026) 6.353 7.801 ( -1.035 0.000 -6.261) 6.346 7.987 ( -3.444 0.000 -10.967) 11.495 8.329 ( -11.069 0.000 -6.993) 13.093 8.401 ( 4.814 -0.000 -10.082) 11.172 8.581 ( -4.163 0.000 0.718) 4.225 8.677 ( -7.995 -0.000 1.454) 8.126 9.050 ( 3.564 0.000 11.469) 12.010 9.429 ( 1.177 -0.000 10.292) 10.359 9.457 ( 3.388 0.000 -10.558) 11.089 9.770 ( -0.903 0.000 0.553) 1.059 10.346 ( -3.746 -0.000 -3.938) 5.435 10.460 ( -8.118 0.000 7.119) 10.797 10.555 ( -8.130 0.000 3.677) 8.923 10.707 ( -7.985 -0.000 -6.542) 10.322 11.002 ( -1.206 0.000 -2.821) 3.068 11.472 ( -12.370 0.000 -5.445) 13.516 12.057 ( 1.476 0.000 1.433) 2.057 12.244 ( -2.661 -0.000 -3.905) 4.726 12.431 ( 11.580 0.000 -0.019) 11.580 12.743 ( 0.049 0.000 13.525) 13.525 13.770 ( 8.148 0.000 11.156) 13.815 13.959 ( 14.496 0.000 -0.836) 14.520 14.272 ( 6.968 0.000 -6.215) 9.337 14.618 ( 6.345 0.000 10.223) 12.031 15.338 ( -7.308 0.000 5.751) 9.299 15.543 ( -6.257 0.000 -5.441) 8.292 16.336 ( 13.181 0.000 -2.662) 13.448 16.725 ( 8.834 0.000 7.279) 11.446 17.423 ( -16.623 0.000 -6.235) 17.754 17.825 ( -8.964 0.000 -12.883) 15.695 18.605 ( 1.811 0.000 1.997) 2.696 19.142 ( -6.435 0.000 1.299) 6.565 ======================= Grid point 517 (259/260) ======================= q-point: ( 0.40 -0.50 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 250 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.987 ( 0.879 -0.000 -10.403) 10.440 1.987 ( -2.561 0.000 2.683) 3.708 2.528 ( -2.248 0.000 -5.932) 6.343 2.574 ( -4.268 0.000 -7.173) 8.347 4.273 ( 2.410 0.000 -6.027) 6.491 4.469 ( -8.464 0.000 5.284) 9.978 4.731 ( -2.256 -0.000 1.843) 2.913 4.755 ( 1.893 0.000 -10.110) 10.286 5.912 ( 4.947 0.000 -2.425) 5.509 5.952 ( 0.361 -0.000 4.374) 4.389 6.414 ( 6.141 0.000 14.239) 15.507 6.607 ( 2.242 -0.000 -3.420) 4.089 6.622 ( 0.864 0.000 -6.079) 6.140 6.822 ( -5.259 0.000 -1.186) 5.392 7.121 ( 0.869 0.000 20.068) 20.087 7.127 ( 4.184 -0.000 -6.455) 7.693 7.686 ( -4.678 0.000 -7.512) 8.850 7.818 ( -6.302 0.000 -10.533) 12.274 8.219 ( 2.295 0.000 -2.387) 3.312 8.434 ( 2.118 0.000 -6.485) 6.823 8.522 ( -6.940 0.000 -0.157) 6.942 8.524 ( -2.863 -0.000 2.765) 3.980 9.193 ( 3.462 0.000 12.159) 12.642 9.421 ( 0.371 0.000 -12.258) 12.264 9.525 ( 2.867 0.000 8.118) 8.610 9.728 ( -2.911 0.000 -2.177) 3.635 10.271 ( -1.305 0.000 -3.181) 3.439 10.345 ( -8.122 0.000 7.789) 11.254 10.466 ( -2.969 0.000 2.803) 4.083 10.545 ( -4.328 0.000 -6.488) 7.799 10.993 ( 1.587 0.000 -1.973) 2.532 11.220 ( -10.139 0.000 -3.805) 10.830 12.101 ( 1.756 0.000 1.710) 2.451 12.181 ( -1.698 0.000 -2.605) 3.109 12.629 ( 9.734 0.000 -3.647) 10.395 12.790 ( -3.213 0.000 10.936) 11.398 13.981 ( 6.643 0.000 9.546) 11.630 14.152 ( 3.838 0.000 -0.278) 3.848 14.416 ( 14.601 0.000 -10.458) 17.960 14.745 ( -2.509 0.000 13.748) 13.975 15.232 ( -3.721 0.000 -0.069) 3.722 15.387 ( -6.555 0.000 -4.285) 7.831 16.560 ( 10.716 0.000 0.402) 10.724 16.870 ( 0.425 0.000 0.287) 0.513 17.200 ( -3.502 0.000 6.237) 7.153 17.571 ( -8.421 0.000 -14.229) 16.534 18.678 ( 4.887 0.000 1.421) 5.089 18.989 ( -9.194 0.000 -0.130) 9.194 ======================= Grid point 519 (260/260) ======================= q-point: ( 0.50 -0.50 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 130 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.969 ( 2.241 0.000 -6.190) 6.583 1.969 ( -2.241 0.000 6.190) 6.583 2.495 ( -1.046 0.000 -0.373) 1.110 2.495 ( 1.046 0.000 0.373) 1.110 4.336 ( 6.738 0.000 -2.788) 7.292 4.336 ( -6.738 0.000 2.788) 7.292 4.733 ( 1.697 0.000 -8.391) 8.561 4.733 ( -1.697 0.000 8.391) 8.561 5.963 ( 2.058 0.000 -3.460) 4.026 5.963 ( -2.058 -0.000 3.460) 4.026 6.564 ( -1.587 0.000 -9.828) 9.955 6.564 ( 1.587 0.000 9.828) 9.955 6.690 ( -7.033 0.000 0.189) 7.035 6.690 ( 7.033 0.000 -0.189) 7.035 7.181 ( 5.235 0.000 -10.424) 11.664 7.181 ( -5.235 0.000 10.424) 11.664 7.656 ( -4.017 0.000 -3.711) 5.468 7.656 ( 4.017 0.000 3.711) 5.468 8.322 ( -7.823 0.000 0.343) 7.831 8.322 ( 7.823 0.000 -0.343) 7.831 8.497 ( 2.603 0.000 -4.660) 5.338 8.497 ( -2.603 0.000 4.660) 5.338 9.326 ( -2.071 0.000 -12.642) 12.810 9.326 ( 2.071 0.000 12.642) 12.810 9.636 ( -4.019 -0.000 -5.193) 6.566 9.636 ( 4.019 0.000 5.193) 6.566 10.268 ( 3.645 0.000 -4.829) 6.050 10.268 ( -3.645 0.000 4.829) 6.050 10.465 ( -0.369 0.000 -4.787) 4.802 10.465 ( 0.369 0.000 4.787) 4.802 11.053 ( -5.461 0.000 -0.900) 5.535 11.053 ( 5.461 0.000 0.900) 5.535 12.141 ( -1.346 0.000 -1.729) 2.191 12.141 ( 1.346 0.000 1.729) 2.191 12.753 ( 6.569 0.000 -7.320) 9.836 12.753 ( -6.569 0.000 7.320) 9.836 14.127 ( -3.284 0.000 -5.500) 6.406 14.127 ( 3.284 0.000 5.500) 6.406 14.649 ( 14.558 0.000 -11.912) 18.810 14.649 ( -14.558 0.000 11.912) 18.810 15.252 ( -4.876 0.000 -1.276) 5.040 15.252 ( 4.876 0.000 1.276) 5.040 16.753 ( -8.199 0.000 -3.090) 8.762 16.753 ( 8.199 0.000 3.090) 8.762 17.333 ( -6.784 0.000 -14.038) 15.591 17.333 ( 6.784 0.000 14.038) 15.591 18.813 ( -8.157 0.000 -1.007) 8.219 18.813 ( 8.157 0.000 1.007) 8.219 =================== End of collection of collisions =================== ----------- Thermal conductivity (W/m-k) with tetrahedron method ----------- # T(K) xx yy zz yz xz xy #ipm 0.0 0.000 0.000 0.000 0.000 0.000 0.000 3/38400 10.0 2018.101 1512.231 1898.695 0.000 -40.252 0.000 3/38400 20.0 556.434 525.330 644.297 0.000 -71.079 0.000 3/38400 30.0 234.116 219.089 271.944 0.000 -26.167 0.000 3/38400 40.0 107.129 100.296 123.025 0.000 -9.314 0.000 3/38400 50.0 55.482 52.460 63.399 0.000 -3.920 0.000 3/38400 60.0 32.626 31.184 37.235 0.000 -2.023 0.000 3/38400 70.0 21.313 20.556 24.329 0.000 -1.231 0.000 3/38400 80.0 15.101 14.665 17.250 0.000 -0.843 0.000 3/38400 90.0 11.382 11.108 13.013 0.000 -0.625 0.000 3/38400 100.0 8.995 8.808 10.292 0.000 -0.490 0.000 3/38400 110.0 7.374 7.235 8.443 0.000 -0.400 0.000 3/38400 120.0 6.221 6.109 7.127 0.000 -0.337 0.000 3/38400 130.0 5.371 5.273 6.155 0.000 -0.290 0.000 3/38400 140.0 4.722 4.633 5.413 0.000 -0.254 0.000 3/38400 150.0 4.215 4.129 4.831 0.000 -0.226 0.000 3/38400 160.0 3.809 3.724 4.365 0.000 -0.203 0.000 3/38400 170.0 3.477 3.393 3.984 0.000 -0.184 0.000 3/38400 180.0 3.202 3.117 3.667 0.000 -0.168 0.000 3/38400 190.0 2.969 2.883 3.400 0.000 -0.154 0.000 3/38400 200.0 2.771 2.683 3.171 0.000 -0.143 0.000 3/38400 210.0 2.599 2.511 2.973 0.000 -0.133 0.000 3/38400 220.0 2.449 2.360 2.801 0.000 -0.124 0.000 3/38400 230.0 2.317 2.227 2.649 0.000 -0.116 0.000 3/38400 240.0 2.200 2.109 2.513 0.000 -0.109 0.000 3/38400 250.0 2.095 2.003 2.392 0.000 -0.103 0.000 3/38400 260.0 2.000 1.908 2.283 0.000 -0.097 0.000 3/38400 270.0 1.914 1.822 2.184 0.000 -0.092 0.000 3/38400 280.0 1.836 1.744 2.094 0.000 -0.088 0.000 3/38400 290.0 1.765 1.673 2.012 0.000 -0.083 0.000 3/38400 300.0 1.699 1.607 1.936 0.000 -0.080 0.000 3/38400 310.0 1.638 1.547 1.867 0.000 -0.076 0.000 3/38400 320.0 1.582 1.491 1.802 0.000 -0.073 0.000 3/38400 330.0 1.530 1.440 1.742 0.000 -0.070 0.000 3/38400 340.0 1.481 1.392 1.686 0.000 -0.067 0.000 3/38400 350.0 1.435 1.347 1.634 0.000 -0.065 0.000 3/38400 360.0 1.393 1.305 1.585 0.000 -0.062 0.000 3/38400 370.0 1.353 1.266 1.539 0.000 -0.060 0.000 3/38400 380.0 1.315 1.229 1.496 0.000 -0.058 0.000 3/38400 390.0 1.279 1.194 1.455 0.000 -0.056 0.000 3/38400 400.0 1.246 1.162 1.416 0.000 -0.055 0.000 3/38400 410.0 1.214 1.131 1.380 0.000 -0.053 0.000 3/38400 420.0 1.184 1.102 1.345 0.000 -0.051 0.000 3/38400 430.0 1.155 1.074 1.312 0.000 -0.050 0.000 3/38400 440.0 1.128 1.048 1.281 0.000 -0.048 0.000 3/38400 450.0 1.102 1.023 1.252 0.000 -0.047 0.000 3/38400 460.0 1.077 0.999 1.223 0.000 -0.046 0.000 3/38400 470.0 1.053 0.976 1.196 0.000 -0.045 0.000 3/38400 480.0 1.031 0.954 1.170 0.000 -0.044 0.000 3/38400 490.0 1.009 0.934 1.146 0.000 -0.042 0.000 3/38400 500.0 0.988 0.914 1.122 0.000 -0.041 0.000 3/38400 510.0 0.968 0.895 1.099 0.000 -0.040 0.000 3/38400 520.0 0.949 0.877 1.078 0.000 -0.040 0.000 3/38400 530.0 0.931 0.859 1.057 0.000 -0.039 0.000 3/38400 540.0 0.913 0.843 1.037 0.000 -0.038 0.000 3/38400 550.0 0.897 0.827 1.017 0.000 -0.037 0.000 3/38400 560.0 0.880 0.811 0.999 0.000 -0.036 0.000 3/38400 570.0 0.864 0.796 0.981 0.000 -0.035 0.000 3/38400 580.0 0.849 0.782 0.964 0.000 -0.035 0.000 3/38400 590.0 0.835 0.768 0.947 0.000 -0.034 0.000 3/38400 600.0 0.821 0.755 0.931 0.000 -0.033 0.000 3/38400 610.0 0.807 0.742 0.915 0.000 -0.033 0.000 3/38400 620.0 0.794 0.730 0.900 0.000 -0.032 0.000 3/38400 630.0 0.781 0.718 0.886 0.000 -0.032 0.000 3/38400 640.0 0.769 0.706 0.872 0.000 -0.031 0.000 3/38400 650.0 0.757 0.695 0.858 0.000 -0.031 0.000 3/38400 660.0 0.745 0.684 0.845 0.000 -0.030 0.000 3/38400 670.0 0.734 0.673 0.832 0.000 -0.029 0.000 3/38400 680.0 0.723 0.663 0.820 0.000 -0.029 0.000 3/38400 690.0 0.712 0.653 0.808 0.000 -0.029 0.000 3/38400 700.0 0.702 0.644 0.796 0.000 -0.028 0.000 3/38400 710.0 0.692 0.634 0.784 0.000 -0.028 0.000 3/38400 720.0 0.682 0.625 0.773 0.000 -0.027 0.000 3/38400 730.0 0.673 0.616 0.763 0.000 -0.027 0.000 3/38400 740.0 0.664 0.608 0.752 0.000 -0.026 0.000 3/38400 750.0 0.655 0.600 0.742 0.000 -0.026 0.000 3/38400 760.0 0.646 0.592 0.732 0.000 -0.026 0.000 3/38400 770.0 0.638 0.584 0.723 0.000 -0.025 0.000 3/38400 780.0 0.629 0.576 0.713 0.000 -0.025 0.000 3/38400 790.0 0.621 0.569 0.704 0.000 -0.025 0.000 3/38400 800.0 0.614 0.561 0.695 0.000 -0.024 0.000 3/38400 810.0 0.606 0.554 0.687 0.000 -0.024 0.000 3/38400 820.0 0.599 0.547 0.678 0.000 -0.024 0.000 3/38400 830.0 0.591 0.541 0.670 0.000 -0.023 0.000 3/38400 840.0 0.584 0.534 0.662 0.000 -0.023 0.000 3/38400 850.0 0.577 0.528 0.654 0.000 -0.023 0.000 3/38400 860.0 0.571 0.521 0.646 0.000 -0.022 0.000 3/38400 870.0 0.564 0.515 0.639 0.000 -0.022 0.000 3/38400 880.0 0.557 0.509 0.632 0.000 -0.022 0.000 3/38400 890.0 0.551 0.504 0.624 0.000 -0.022 0.000 3/38400 900.0 0.545 0.498 0.617 0.000 -0.021 0.000 3/38400 910.0 0.539 0.492 0.611 0.000 -0.021 0.000 3/38400 920.0 0.533 0.487 0.604 0.000 -0.021 0.000 3/38400 930.0 0.527 0.481 0.597 0.000 -0.021 0.000 3/38400 940.0 0.522 0.476 0.591 0.000 -0.020 0.000 3/38400 950.0 0.516 0.471 0.585 0.000 -0.020 0.000 3/38400 960.0 0.511 0.466 0.579 0.000 -0.020 0.000 3/38400 970.0 0.506 0.461 0.573 0.000 -0.020 0.000 3/38400 980.0 0.500 0.457 0.567 0.000 -0.019 0.000 3/38400 990.0 0.495 0.452 0.561 0.000 -0.019 0.000 3/38400 1000.0 0.490 0.447 0.555 0.000 -0.019 0.000 3/38400 Thermal conductivity related properties were written into "kappa-m10810.hdf5". Summary of calculation was written in "phono3py.yaml". -------------------------[time 2026-01-09 03:06:51]------------------------- _ ___ _ __ __| | / _ \ '_ \ / _` | | __/ | | | (_| | \___|_| |_|\__,_|