----------------------------- ------- calculate fc2 ------- ----------------------------- _ _ __ | |__ ___ _ __ ___ _ __ _ _ | '_ \| '_ \ / _ \| '_ \ / _ \ | '_ \| | | | | |_) | | | | (_) | | | | (_) || |_) | |_| | | .__/|_| |_|\___/|_| |_|\___(_) .__/ \__, | |_| |_| |___/ 2.47.1 -------------------------[time 2026-01-08 20:32:04]------------------------- 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: [1 3 3] Primitive matrix: [1. 0. 0.] [0. 1. 0.] [0. 0. 1.] Spacegroup: Pnma (62) Number of symmetry operations in supercell: 72 ------------------------------ primitive cell ------------------------------ Lattice vectors: a 10.218108270000000 0.000000000000000 0.000000000000000 b 0.000000000000000 3.201433030000000 0.000000000000000 c 0.000000000000000 0.000000000000000 4.726817620000000 Atomic positions (fractional): *1 Sc 0.85722938443406 0.75000000000000 0.92182247840999 44.956 2 Sc 0.35722938443406 0.75000000000000 0.57817752159001 44.956 3 Sc 0.14277061556594 0.25000000000000 0.07817752159001 44.956 4 Sc 0.64277061556594 0.25000000000000 0.42182247840999 44.956 *5 H 0.09810278869487 0.75000000000000 0.61105074581935 1.008 6 H 0.59810278869487 0.75000000000000 0.88894925418065 1.008 7 H 0.90189721130513 0.25000000000000 0.38894925418065 1.008 8 H 0.40189721130513 0.25000000000000 0.11105074581935 1.008 *9 O 0.19145235278014 0.75000000000000 0.32983791973795 15.999 10 O 0.69145235278014 0.75000000000000 0.17016208026205 15.999 11 O 0.80854764721986 0.25000000000000 0.67016208026205 15.999 12 O 0.30854764721986 0.25000000000000 0.82983791973795 15.999 *13 O 0.06199550339461 0.75000000000000 0.81151588221632 15.999 14 O 0.56199550339461 0.75000000000000 0.68848411778368 15.999 15 O 0.93800449660539 0.25000000000000 0.18848411778368 15.999 16 O 0.43800449660539 0.25000000000000 0.31151588221632 15.999 -------------------------------- unit cell --------------------------------- Lattice vectors: a 10.218108270000000 0.000000000000000 0.000000000000000 b 0.000000000000000 3.201433030000000 0.000000000000000 c 0.000000000000000 0.000000000000000 4.726817620000000 Atomic positions (fractional): *1 Sc 0.85722938443406 0.75000000000000 0.92182247840999 44.956 > 1 2 Sc 0.35722938443406 0.75000000000000 0.57817752159001 44.956 > 2 3 Sc 0.14277061556594 0.25000000000000 0.07817752159001 44.956 > 3 4 Sc 0.64277061556594 0.25000000000000 0.42182247840999 44.956 > 4 *5 H 0.09810278869487 0.75000000000000 0.61105074581935 1.008 > 5 6 H 0.59810278869487 0.75000000000000 0.88894925418065 1.008 > 6 7 H 0.90189721130513 0.25000000000000 0.38894925418065 1.008 > 7 8 H 0.40189721130513 0.25000000000000 0.11105074581935 1.008 > 8 *9 O 0.19145235278014 0.75000000000000 0.32983791973795 15.999 > 9 10 O 0.69145235278014 0.75000000000000 0.17016208026205 15.999 > 10 11 O 0.80854764721986 0.25000000000000 0.67016208026205 15.999 > 11 12 O 0.30854764721986 0.25000000000000 0.82983791973795 15.999 > 12 *13 O 0.06199550339461 0.75000000000000 0.81151588221632 15.999 > 13 14 O 0.56199550339461 0.75000000000000 0.68848411778368 15.999 > 14 15 O 0.93800449660539 0.25000000000000 0.18848411778368 15.999 > 15 16 O 0.43800449660539 0.25000000000000 0.31151588221632 15.999 > 16 -------------------------------- super cell -------------------------------- Lattice vectors: a 10.218108270000000 0.000000000000000 0.000000000000000 b 0.000000000000000 9.604299090000000 0.000000000000000 c 0.000000000000000 0.000000000000000 14.180452860000001 Atomic positions (fractional): *1 Sc 0.85722938443406 0.25000000000000 0.30727415947000 44.956 > 1 2 Sc 0.85722938443406 0.58333333333333 0.30727415947000 44.956 > 1 3 Sc 0.85722938443406 0.91666666666667 0.30727415947000 44.956 > 1 4 Sc 0.85722938443406 0.25000000000000 0.64060749280333 44.956 > 1 5 Sc 0.85722938443406 0.58333333333333 0.64060749280333 44.956 > 1 6 Sc 0.85722938443406 0.91666666666667 0.64060749280333 44.956 > 1 7 Sc 0.85722938443406 0.25000000000000 0.97394082613666 44.956 > 1 8 Sc 0.85722938443406 0.58333333333333 0.97394082613666 44.956 > 1 9 Sc 0.85722938443406 0.91666666666667 0.97394082613666 44.956 > 1 10 Sc 0.35722938443406 0.25000000000000 0.19272584053000 44.956 > 2 11 Sc 0.35722938443406 0.58333333333333 0.19272584053000 44.956 > 2 12 Sc 0.35722938443406 0.91666666666667 0.19272584053000 44.956 > 2 13 Sc 0.35722938443406 0.25000000000000 0.52605917386334 44.956 > 2 14 Sc 0.35722938443406 0.58333333333333 0.52605917386334 44.956 > 2 15 Sc 0.35722938443406 0.91666666666667 0.52605917386334 44.956 > 2 16 Sc 0.35722938443406 0.25000000000000 0.85939250719667 44.956 > 2 17 Sc 0.35722938443406 0.58333333333333 0.85939250719667 44.956 > 2 18 Sc 0.35722938443406 0.91666666666667 0.85939250719667 44.956 > 2 19 Sc 0.14277061556594 0.08333333333333 0.02605917386334 44.956 > 3 20 Sc 0.14277061556594 0.41666666666667 0.02605917386334 44.956 > 3 21 Sc 0.14277061556594 0.75000000000000 0.02605917386334 44.956 > 3 22 Sc 0.14277061556594 0.08333333333333 0.35939250719667 44.956 > 3 23 Sc 0.14277061556594 0.41666666666667 0.35939250719667 44.956 > 3 24 Sc 0.14277061556594 0.75000000000000 0.35939250719667 44.956 > 3 25 Sc 0.14277061556594 0.08333333333333 0.69272584053000 44.956 > 3 26 Sc 0.14277061556594 0.41666666666667 0.69272584053000 44.956 > 3 27 Sc 0.14277061556594 0.75000000000000 0.69272584053000 44.956 > 3 28 Sc 0.64277061556594 0.08333333333333 0.14060749280333 44.956 > 4 29 Sc 0.64277061556594 0.41666666666667 0.14060749280333 44.956 > 4 30 Sc 0.64277061556594 0.75000000000000 0.14060749280333 44.956 > 4 31 Sc 0.64277061556594 0.08333333333333 0.47394082613666 44.956 > 4 32 Sc 0.64277061556594 0.41666666666667 0.47394082613666 44.956 > 4 33 Sc 0.64277061556594 0.75000000000000 0.47394082613666 44.956 > 4 34 Sc 0.64277061556594 0.08333333333333 0.80727415947000 44.956 > 4 35 Sc 0.64277061556594 0.41666666666667 0.80727415947000 44.956 > 4 36 Sc 0.64277061556594 0.75000000000000 0.80727415947000 44.956 > 4 *37 H 0.09810278869487 0.25000000000000 0.20368358193978 1.008 > 5 38 H 0.09810278869487 0.58333333333333 0.20368358193978 1.008 > 5 39 H 0.09810278869487 0.91666666666667 0.20368358193978 1.008 > 5 40 H 0.09810278869487 0.25000000000000 0.53701691527312 1.008 > 5 41 H 0.09810278869487 0.58333333333333 0.53701691527312 1.008 > 5 42 H 0.09810278869487 0.91666666666667 0.53701691527312 1.008 > 5 43 H 0.09810278869487 0.25000000000000 0.87035024860645 1.008 > 5 44 H 0.09810278869487 0.58333333333333 0.87035024860645 1.008 > 5 45 H 0.09810278869487 0.91666666666667 0.87035024860645 1.008 > 5 46 H 0.59810278869487 0.25000000000000 0.29631641806022 1.008 > 6 47 H 0.59810278869487 0.58333333333333 0.29631641806022 1.008 > 6 48 H 0.59810278869487 0.91666666666667 0.29631641806022 1.008 > 6 49 H 0.59810278869487 0.25000000000000 0.62964975139355 1.008 > 6 50 H 0.59810278869487 0.58333333333333 0.62964975139355 1.008 > 6 51 H 0.59810278869487 0.91666666666667 0.62964975139355 1.008 > 6 52 H 0.59810278869487 0.25000000000000 0.96298308472688 1.008 > 6 53 H 0.59810278869487 0.58333333333333 0.96298308472688 1.008 > 6 54 H 0.59810278869487 0.91666666666667 0.96298308472688 1.008 > 6 55 H 0.90189721130513 0.08333333333333 0.12964975139355 1.008 > 7 56 H 0.90189721130513 0.41666666666667 0.12964975139355 1.008 > 7 57 H 0.90189721130513 0.75000000000000 0.12964975139355 1.008 > 7 58 H 0.90189721130513 0.08333333333333 0.46298308472688 1.008 > 7 59 H 0.90189721130513 0.41666666666667 0.46298308472688 1.008 > 7 60 H 0.90189721130513 0.75000000000000 0.46298308472688 1.008 > 7 61 H 0.90189721130513 0.08333333333333 0.79631641806022 1.008 > 7 62 H 0.90189721130513 0.41666666666667 0.79631641806022 1.008 > 7 63 H 0.90189721130513 0.75000000000000 0.79631641806022 1.008 > 7 64 H 0.40189721130513 0.08333333333333 0.03701691527312 1.008 > 8 65 H 0.40189721130513 0.41666666666667 0.03701691527312 1.008 > 8 66 H 0.40189721130513 0.75000000000000 0.03701691527312 1.008 > 8 67 H 0.40189721130513 0.08333333333333 0.37035024860645 1.008 > 8 68 H 0.40189721130513 0.41666666666667 0.37035024860645 1.008 > 8 69 H 0.40189721130513 0.75000000000000 0.37035024860645 1.008 > 8 70 H 0.40189721130513 0.08333333333333 0.70368358193978 1.008 > 8 71 H 0.40189721130513 0.41666666666667 0.70368358193978 1.008 > 8 72 H 0.40189721130513 0.75000000000000 0.70368358193978 1.008 > 8 *73 O 0.19145235278014 0.25000000000000 0.10994597324598 15.999 > 9 74 O 0.19145235278014 0.58333333333333 0.10994597324598 15.999 > 9 75 O 0.19145235278014 0.91666666666667 0.10994597324598 15.999 > 9 76 O 0.19145235278014 0.25000000000000 0.44327930657932 15.999 > 9 77 O 0.19145235278014 0.58333333333333 0.44327930657932 15.999 > 9 78 O 0.19145235278014 0.91666666666667 0.44327930657932 15.999 > 9 79 O 0.19145235278014 0.25000000000000 0.77661263991265 15.999 > 9 80 O 0.19145235278014 0.58333333333333 0.77661263991265 15.999 > 9 81 O 0.19145235278014 0.91666666666667 0.77661263991265 15.999 > 9 82 O 0.69145235278014 0.25000000000000 0.05672069342068 15.999 > 10 83 O 0.69145235278014 0.58333333333333 0.05672069342068 15.999 > 10 84 O 0.69145235278014 0.91666666666667 0.05672069342068 15.999 > 10 85 O 0.69145235278014 0.25000000000000 0.39005402675402 15.999 > 10 86 O 0.69145235278014 0.58333333333333 0.39005402675402 15.999 > 10 87 O 0.69145235278014 0.91666666666667 0.39005402675402 15.999 > 10 88 O 0.69145235278014 0.25000000000000 0.72338736008735 15.999 > 10 89 O 0.69145235278014 0.58333333333333 0.72338736008735 15.999 > 10 90 O 0.69145235278014 0.91666666666667 0.72338736008735 15.999 > 10 91 O 0.80854764721986 0.08333333333333 0.22338736008735 15.999 > 11 92 O 0.80854764721986 0.41666666666667 0.22338736008735 15.999 > 11 93 O 0.80854764721986 0.75000000000000 0.22338736008735 15.999 > 11 94 O 0.80854764721986 0.08333333333333 0.55672069342068 15.999 > 11 95 O 0.80854764721986 0.41666666666667 0.55672069342068 15.999 > 11 96 O 0.80854764721986 0.75000000000000 0.55672069342068 15.999 > 11 97 O 0.80854764721986 0.08333333333333 0.89005402675402 15.999 > 11 98 O 0.80854764721986 0.41666666666667 0.89005402675402 15.999 > 11 99 O 0.80854764721986 0.75000000000000 0.89005402675402 15.999 > 11 100 O 0.30854764721986 0.08333333333333 0.27661263991265 15.999 > 12 101 O 0.30854764721986 0.41666666666667 0.27661263991265 15.999 > 12 102 O 0.30854764721986 0.75000000000000 0.27661263991265 15.999 > 12 103 O 0.30854764721986 0.08333333333333 0.60994597324598 15.999 > 12 104 O 0.30854764721986 0.41666666666667 0.60994597324598 15.999 > 12 105 O 0.30854764721986 0.75000000000000 0.60994597324598 15.999 > 12 106 O 0.30854764721986 0.08333333333333 0.94327930657932 15.999 > 12 107 O 0.30854764721986 0.41666666666667 0.94327930657932 15.999 > 12 108 O 0.30854764721986 0.75000000000000 0.94327930657932 15.999 > 12 *109 O 0.06199550339461 0.25000000000000 0.27050529407211 15.999 > 13 110 O 0.06199550339461 0.58333333333333 0.27050529407211 15.999 > 13 111 O 0.06199550339461 0.91666666666667 0.27050529407211 15.999 > 13 112 O 0.06199550339461 0.25000000000000 0.60383862740544 15.999 > 13 113 O 0.06199550339461 0.58333333333333 0.60383862740544 15.999 > 13 114 O 0.06199550339461 0.91666666666667 0.60383862740544 15.999 > 13 115 O 0.06199550339461 0.25000000000000 0.93717196073877 15.999 > 13 116 O 0.06199550339461 0.58333333333333 0.93717196073877 15.999 > 13 117 O 0.06199550339461 0.91666666666667 0.93717196073877 15.999 > 13 118 O 0.56199550339461 0.25000000000000 0.22949470592789 15.999 > 14 119 O 0.56199550339461 0.58333333333333 0.22949470592789 15.999 > 14 120 O 0.56199550339461 0.91666666666667 0.22949470592789 15.999 > 14 121 O 0.56199550339461 0.25000000000000 0.56282803926123 15.999 > 14 122 O 0.56199550339461 0.58333333333333 0.56282803926123 15.999 > 14 123 O 0.56199550339461 0.91666666666667 0.56282803926123 15.999 > 14 124 O 0.56199550339461 0.25000000000000 0.89616137259456 15.999 > 14 125 O 0.56199550339461 0.58333333333333 0.89616137259456 15.999 > 14 126 O 0.56199550339461 0.91666666666667 0.89616137259456 15.999 > 14 127 O 0.93800449660539 0.08333333333333 0.06282803926123 15.999 > 15 128 O 0.93800449660539 0.41666666666667 0.06282803926123 15.999 > 15 129 O 0.93800449660539 0.75000000000000 0.06282803926123 15.999 > 15 130 O 0.93800449660539 0.08333333333333 0.39616137259456 15.999 > 15 131 O 0.93800449660539 0.41666666666667 0.39616137259456 15.999 > 15 132 O 0.93800449660539 0.75000000000000 0.39616137259456 15.999 > 15 133 O 0.93800449660539 0.08333333333333 0.72949470592789 15.999 > 15 134 O 0.93800449660539 0.41666666666667 0.72949470592789 15.999 > 15 135 O 0.93800449660539 0.75000000000000 0.72949470592789 15.999 > 15 136 O 0.43800449660539 0.08333333333333 0.10383862740544 15.999 > 16 137 O 0.43800449660539 0.41666666666667 0.10383862740544 15.999 > 16 138 O 0.43800449660539 0.75000000000000 0.10383862740544 15.999 > 16 139 O 0.43800449660539 0.08333333333333 0.43717196073877 15.999 > 16 140 O 0.43800449660539 0.41666666666667 0.43717196073877 15.999 > 16 141 O 0.43800449660539 0.75000000000000 0.43717196073877 15.999 > 16 142 O 0.43800449660539 0.08333333333333 0.77050529407211 15.999 > 16 143 O 0.43800449660539 0.41666666666667 0.77050529407211 15.999 > 16 144 O 0.43800449660539 0.75000000000000 0.77050529407211 15.999 > 16 ---------------------------------------------------------------------------- NAC parameters were read from "phonopy_mlp_eval_fc2_dataset.yaml.xz". --------------------------- Dielectric constant ---------------------------- 3.9792893 0.0000000 0.0000000 0.0000000 4.1714889 0.0000000 0.0000000 0.0000000 3.9899115 -------------------------- Born effective charges -------------------------- 1 Sc 3.7636358 0.0000000 0.0160169 0.0000000 4.2049633 0.0000000 -0.1324085 0.0000000 3.3270621 2 Sc 3.7636358 0.0000000 -0.0160169 0.0000000 4.2049633 0.0000000 0.1324085 0.0000000 3.3270621 3 Sc 3.7636358 0.0000000 0.0160169 0.0000000 4.2049633 0.0000000 -0.1324085 0.0000000 3.3270621 4 Sc 3.7636358 0.0000000 -0.0160169 0.0000000 4.2049633 0.0000000 0.1324085 0.0000000 3.3270621 5 H 0.6160152 0.0000000 -0.6252183 0.0000000 0.2697149 0.0000000 -0.6326107 0.0000000 1.4192540 6 H 0.6160152 0.0000000 0.6252183 0.0000000 0.2697149 0.0000000 0.6326107 0.0000000 1.4192540 7 H 0.6160152 0.0000000 -0.6252183 0.0000000 0.2697149 0.0000000 -0.6326107 0.0000000 1.4192540 8 H 0.6160152 0.0000000 0.6252183 0.0000000 0.2697149 0.0000000 0.6326107 0.0000000 1.4192540 9 O -2.1390153 0.0000000 -0.5752736 0.0000000 -2.6490455 0.0000000 -0.6528439 0.0000000 -2.6903177 10 O -2.1390153 0.0000000 0.5752736 0.0000000 -2.6490455 0.0000000 0.6528439 0.0000000 -2.6903177 11 O -2.1390153 0.0000000 -0.5752736 0.0000000 -2.6490455 0.0000000 -0.6528439 0.0000000 -2.6903177 12 O -2.1390153 0.0000000 0.5752736 0.0000000 -2.6490455 0.0000000 0.6528439 0.0000000 -2.6903177 13 O -2.2406357 0.0000000 0.2511363 0.0000000 -1.8256328 0.0000000 0.2248571 0.0000000 -2.0559984 14 O -2.2406357 0.0000000 -0.2511363 0.0000000 -1.8256328 0.0000000 -0.2248571 0.0000000 -2.0559984 15 O -2.2406357 0.0000000 0.2511363 0.0000000 -1.8256328 0.0000000 0.2248571 0.0000000 -2.0559984 16 O -2.2406357 0.0000000 -0.2511363 0.0000000 -1.8256328 0.0000000 -0.2248571 0.0000000 -2.0559984 ---------------------------------------------------------------------------- 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: 432/432 Permutation basis: 10920/10920 Construct permutation basis matrix. Finding block diagonal structure in projector. Using scipy connected_components. Rank of projector: 1440 Number of blocks in projector: 1440 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: 384 Use standard eigh solver. --- Eigsh_solver_block: 2 / 6 --- Block_size: 224 Use standard eigh solver. --- Eigsh_solver_block: 3 / 6 --- Block_size: 224 Use standard eigh solver. --- Eigsh_solver_block: 4 / 6 --- Block_size: 224 Use standard eigh solver. --- Eigsh_solver_block: 5 / 6 --- Block_size: 192 Use standard eigh solver. --- Eigsh_solver_block: 6 / 6 --- Block_size: 192 Use standard eigh solver. Tree of FC basis block matrices: - (1440, 1420), data: False |-- (192, 192), data: True |-- (192, 192), data: True |-- (224, 220), data: True |-- (224, 220), data: True |-- (224, 220), data: True |-- (384, 376), data: True ----- Solver_atoms: 1 -- 144 / 144 Time (Solver_compr_matrix_reshape): 0.004 Solver_block: 100 / 240 - Time: 2.417 Solver_block: 200 / 240 - Time: 2.454 Solver_block: 240 / 240 - Time: 1.052 Solver: Calculate X.T @ X and X.T @ y (disp @ compr @ eigvecs).T @ (disp @ compr @ eigvecs): 5.956 --------------------------------- Symfc end -------------------------------- Max drift of force constants: -0.00000000 (zz) -0.00000000 (zz) Permutation basis: 432/432 Permutation basis: 10920/10920 Construct permutation basis matrix. Finding block diagonal structure in projector. Using scipy connected_components. Rank of projector: 1440 Number of blocks in projector: 1440 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: 384 Use standard eigh solver. --- Eigsh_solver_block: 2 / 6 --- Block_size: 224 Use standard eigh solver. --- Eigsh_solver_block: 3 / 6 --- Block_size: 224 Use standard eigh solver. --- Eigsh_solver_block: 4 / 6 --- Block_size: 224 Use standard eigh solver. --- Eigsh_solver_block: 5 / 6 --- Block_size: 192 Use standard eigh solver. --- Eigsh_solver_block: 6 / 6 --- Block_size: 192 Use standard eigh solver. Tree of FC basis block matrices: - (1440, 1420), data: False |-- (192, 192), data: True |-- (192, 192), data: True |-- (224, 220), data: True |-- (224, 220), data: True |-- (224, 220), data: True |-- (384, 376), data: True Max drift after symmetrization by symfc projector: -0.00000000 (zz) -0.00000000 (zz) 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 2026-01-08 20:32:23]------------------------- _ ___ _ __ __| | / _ \ '_ \ / _` | | __/ | | | (_| | \___|_| |_|\__,_| ---------------------------- ------ calculate fc3 ------- ---------------------------- _ _____ _ __ | |__ ___ _ __ ___|___ / _ __ _ _ | '_ \| '_ \ / _ \| '_ \ / _ \ |_ \| '_ \| | | | | |_) | | | | (_) | | | | (_) |__) | |_) | |_| | | .__/|_| |_|\___/|_| |_|\___/____/| .__/ \__, | |_| |_| |___/ 3.23.0 -------------------------[time 2026-01-08 20:32:24]------------------------- 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): [1 3 3] Primitive matrix: [1. 0. 0.] [0. 1. 0.] [0. 0. 1.] Spacegroup: Pnma (62) ------------------------------ primitive cell ------------------------------ Lattice vectors: a 10.218108270000000 0.000000000000000 0.000000000000000 b 0.000000000000000 3.201433030000000 0.000000000000000 c 0.000000000000000 0.000000000000000 4.726817620000000 Atomic positions (fractional): 1 Sc 0.85722938443406 0.75000000000000 0.92182247840999 44.956 2 Sc 0.35722938443406 0.75000000000000 0.57817752159001 44.956 3 Sc 0.14277061556594 0.25000000000000 0.07817752159001 44.956 4 Sc 0.64277061556594 0.25000000000000 0.42182247840999 44.956 5 H 0.09810278869487 0.75000000000000 0.61105074581935 1.008 6 H 0.59810278869487 0.75000000000000 0.88894925418065 1.008 7 H 0.90189721130513 0.25000000000000 0.38894925418065 1.008 8 H 0.40189721130513 0.25000000000000 0.11105074581935 1.008 9 O 0.19145235278014 0.75000000000000 0.32983791973795 15.999 10 O 0.69145235278014 0.75000000000000 0.17016208026205 15.999 11 O 0.80854764721986 0.25000000000000 0.67016208026205 15.999 12 O 0.30854764721986 0.25000000000000 0.82983791973795 15.999 13 O 0.06199550339461 0.75000000000000 0.81151588221632 15.999 14 O 0.56199550339461 0.75000000000000 0.68848411778368 15.999 15 O 0.93800449660539 0.25000000000000 0.18848411778368 15.999 16 O 0.43800449660539 0.25000000000000 0.31151588221632 15.999 -------------------------------- supercell --------------------------------- Lattice vectors: a 10.218108270000000 0.000000000000000 0.000000000000000 b 0.000000000000000 9.604299090000000 0.000000000000000 c 0.000000000000000 0.000000000000000 14.180452860000001 Atomic positions (fractional): 1 Sc 0.85722938443406 0.25000000000000 0.30727415947000 44.956 > 1 2 Sc 0.85722938443406 0.58333333333333 0.30727415947000 44.956 > 1 3 Sc 0.85722938443406 0.91666666666667 0.30727415947000 44.956 > 1 4 Sc 0.85722938443406 0.25000000000000 0.64060749280333 44.956 > 1 5 Sc 0.85722938443406 0.58333333333333 0.64060749280333 44.956 > 1 6 Sc 0.85722938443406 0.91666666666667 0.64060749280333 44.956 > 1 7 Sc 0.85722938443406 0.25000000000000 0.97394082613666 44.956 > 1 8 Sc 0.85722938443406 0.58333333333333 0.97394082613666 44.956 > 1 9 Sc 0.85722938443406 0.91666666666667 0.97394082613666 44.956 > 1 10 Sc 0.35722938443406 0.25000000000000 0.19272584053000 44.956 > 10 11 Sc 0.35722938443406 0.58333333333333 0.19272584053000 44.956 > 10 12 Sc 0.35722938443406 0.91666666666667 0.19272584053000 44.956 > 10 13 Sc 0.35722938443406 0.25000000000000 0.52605917386334 44.956 > 10 14 Sc 0.35722938443406 0.58333333333333 0.52605917386334 44.956 > 10 15 Sc 0.35722938443406 0.91666666666667 0.52605917386334 44.956 > 10 16 Sc 0.35722938443406 0.25000000000000 0.85939250719667 44.956 > 10 17 Sc 0.35722938443406 0.58333333333333 0.85939250719667 44.956 > 10 18 Sc 0.35722938443406 0.91666666666667 0.85939250719667 44.956 > 10 19 Sc 0.14277061556594 0.08333333333333 0.02605917386334 44.956 > 19 20 Sc 0.14277061556594 0.41666666666667 0.02605917386334 44.956 > 19 21 Sc 0.14277061556594 0.75000000000000 0.02605917386334 44.956 > 19 22 Sc 0.14277061556594 0.08333333333333 0.35939250719667 44.956 > 19 23 Sc 0.14277061556594 0.41666666666667 0.35939250719667 44.956 > 19 24 Sc 0.14277061556594 0.75000000000000 0.35939250719667 44.956 > 19 25 Sc 0.14277061556594 0.08333333333333 0.69272584053000 44.956 > 19 26 Sc 0.14277061556594 0.41666666666667 0.69272584053000 44.956 > 19 27 Sc 0.14277061556594 0.75000000000000 0.69272584053000 44.956 > 19 28 Sc 0.64277061556594 0.08333333333333 0.14060749280333 44.956 > 28 29 Sc 0.64277061556594 0.41666666666667 0.14060749280333 44.956 > 28 30 Sc 0.64277061556594 0.75000000000000 0.14060749280333 44.956 > 28 31 Sc 0.64277061556594 0.08333333333333 0.47394082613666 44.956 > 28 32 Sc 0.64277061556594 0.41666666666667 0.47394082613666 44.956 > 28 33 Sc 0.64277061556594 0.75000000000000 0.47394082613666 44.956 > 28 34 Sc 0.64277061556594 0.08333333333333 0.80727415947000 44.956 > 28 35 Sc 0.64277061556594 0.41666666666667 0.80727415947000 44.956 > 28 36 Sc 0.64277061556594 0.75000000000000 0.80727415947000 44.956 > 28 37 H 0.09810278869487 0.25000000000000 0.20368358193978 1.008 > 37 38 H 0.09810278869487 0.58333333333333 0.20368358193978 1.008 > 37 39 H 0.09810278869487 0.91666666666667 0.20368358193978 1.008 > 37 40 H 0.09810278869487 0.25000000000000 0.53701691527312 1.008 > 37 41 H 0.09810278869487 0.58333333333333 0.53701691527312 1.008 > 37 42 H 0.09810278869487 0.91666666666667 0.53701691527312 1.008 > 37 43 H 0.09810278869487 0.25000000000000 0.87035024860645 1.008 > 37 44 H 0.09810278869487 0.58333333333333 0.87035024860645 1.008 > 37 45 H 0.09810278869487 0.91666666666667 0.87035024860645 1.008 > 37 46 H 0.59810278869487 0.25000000000000 0.29631641806022 1.008 > 46 47 H 0.59810278869487 0.58333333333333 0.29631641806022 1.008 > 46 48 H 0.59810278869487 0.91666666666667 0.29631641806022 1.008 > 46 49 H 0.59810278869487 0.25000000000000 0.62964975139355 1.008 > 46 50 H 0.59810278869487 0.58333333333333 0.62964975139355 1.008 > 46 51 H 0.59810278869487 0.91666666666667 0.62964975139355 1.008 > 46 52 H 0.59810278869487 0.25000000000000 0.96298308472688 1.008 > 46 53 H 0.59810278869487 0.58333333333333 0.96298308472688 1.008 > 46 54 H 0.59810278869487 0.91666666666667 0.96298308472688 1.008 > 46 55 H 0.90189721130513 0.08333333333333 0.12964975139355 1.008 > 55 56 H 0.90189721130513 0.41666666666667 0.12964975139355 1.008 > 55 57 H 0.90189721130513 0.75000000000000 0.12964975139355 1.008 > 55 58 H 0.90189721130513 0.08333333333333 0.46298308472688 1.008 > 55 59 H 0.90189721130513 0.41666666666667 0.46298308472688 1.008 > 55 60 H 0.90189721130513 0.75000000000000 0.46298308472688 1.008 > 55 61 H 0.90189721130513 0.08333333333333 0.79631641806022 1.008 > 55 62 H 0.90189721130513 0.41666666666667 0.79631641806022 1.008 > 55 63 H 0.90189721130513 0.75000000000000 0.79631641806022 1.008 > 55 64 H 0.40189721130513 0.08333333333333 0.03701691527312 1.008 > 64 65 H 0.40189721130513 0.41666666666667 0.03701691527312 1.008 > 64 66 H 0.40189721130513 0.75000000000000 0.03701691527312 1.008 > 64 67 H 0.40189721130513 0.08333333333333 0.37035024860645 1.008 > 64 68 H 0.40189721130513 0.41666666666667 0.37035024860645 1.008 > 64 69 H 0.40189721130513 0.75000000000000 0.37035024860645 1.008 > 64 70 H 0.40189721130513 0.08333333333333 0.70368358193978 1.008 > 64 71 H 0.40189721130513 0.41666666666667 0.70368358193978 1.008 > 64 72 H 0.40189721130513 0.75000000000000 0.70368358193978 1.008 > 64 73 O 0.19145235278014 0.25000000000000 0.10994597324598 15.999 > 73 74 O 0.19145235278014 0.58333333333333 0.10994597324598 15.999 > 73 75 O 0.19145235278014 0.91666666666667 0.10994597324598 15.999 > 73 76 O 0.19145235278014 0.25000000000000 0.44327930657932 15.999 > 73 77 O 0.19145235278014 0.58333333333333 0.44327930657932 15.999 > 73 78 O 0.19145235278014 0.91666666666667 0.44327930657932 15.999 > 73 79 O 0.19145235278014 0.25000000000000 0.77661263991265 15.999 > 73 80 O 0.19145235278014 0.58333333333333 0.77661263991265 15.999 > 73 81 O 0.19145235278014 0.91666666666667 0.77661263991265 15.999 > 73 82 O 0.69145235278014 0.25000000000000 0.05672069342068 15.999 > 82 83 O 0.69145235278014 0.58333333333333 0.05672069342068 15.999 > 82 84 O 0.69145235278014 0.91666666666667 0.05672069342068 15.999 > 82 85 O 0.69145235278014 0.25000000000000 0.39005402675402 15.999 > 82 86 O 0.69145235278014 0.58333333333333 0.39005402675402 15.999 > 82 87 O 0.69145235278014 0.91666666666667 0.39005402675402 15.999 > 82 88 O 0.69145235278014 0.25000000000000 0.72338736008735 15.999 > 82 89 O 0.69145235278014 0.58333333333333 0.72338736008735 15.999 > 82 90 O 0.69145235278014 0.91666666666667 0.72338736008735 15.999 > 82 91 O 0.80854764721986 0.08333333333333 0.22338736008735 15.999 > 91 92 O 0.80854764721986 0.41666666666667 0.22338736008735 15.999 > 91 93 O 0.80854764721986 0.75000000000000 0.22338736008735 15.999 > 91 94 O 0.80854764721986 0.08333333333333 0.55672069342068 15.999 > 91 95 O 0.80854764721986 0.41666666666667 0.55672069342068 15.999 > 91 96 O 0.80854764721986 0.75000000000000 0.55672069342068 15.999 > 91 97 O 0.80854764721986 0.08333333333333 0.89005402675402 15.999 > 91 98 O 0.80854764721986 0.41666666666667 0.89005402675402 15.999 > 91 99 O 0.80854764721986 0.75000000000000 0.89005402675402 15.999 > 91 100 O 0.30854764721986 0.08333333333333 0.27661263991265 15.999 > 100 101 O 0.30854764721986 0.41666666666667 0.27661263991265 15.999 > 100 102 O 0.30854764721986 0.75000000000000 0.27661263991265 15.999 > 100 103 O 0.30854764721986 0.08333333333333 0.60994597324598 15.999 > 100 104 O 0.30854764721986 0.41666666666667 0.60994597324598 15.999 > 100 105 O 0.30854764721986 0.75000000000000 0.60994597324598 15.999 > 100 106 O 0.30854764721986 0.08333333333333 0.94327930657932 15.999 > 100 107 O 0.30854764721986 0.41666666666667 0.94327930657932 15.999 > 100 108 O 0.30854764721986 0.75000000000000 0.94327930657932 15.999 > 100 109 O 0.06199550339461 0.25000000000000 0.27050529407211 15.999 > 109 110 O 0.06199550339461 0.58333333333333 0.27050529407211 15.999 > 109 111 O 0.06199550339461 0.91666666666667 0.27050529407211 15.999 > 109 112 O 0.06199550339461 0.25000000000000 0.60383862740544 15.999 > 109 113 O 0.06199550339461 0.58333333333333 0.60383862740544 15.999 > 109 114 O 0.06199550339461 0.91666666666667 0.60383862740544 15.999 > 109 115 O 0.06199550339461 0.25000000000000 0.93717196073877 15.999 > 109 116 O 0.06199550339461 0.58333333333333 0.93717196073877 15.999 > 109 117 O 0.06199550339461 0.91666666666667 0.93717196073877 15.999 > 109 118 O 0.56199550339461 0.25000000000000 0.22949470592789 15.999 > 118 119 O 0.56199550339461 0.58333333333333 0.22949470592789 15.999 > 118 120 O 0.56199550339461 0.91666666666667 0.22949470592789 15.999 > 118 121 O 0.56199550339461 0.25000000000000 0.56282803926123 15.999 > 118 122 O 0.56199550339461 0.58333333333333 0.56282803926123 15.999 > 118 123 O 0.56199550339461 0.91666666666667 0.56282803926123 15.999 > 118 124 O 0.56199550339461 0.25000000000000 0.89616137259456 15.999 > 118 125 O 0.56199550339461 0.58333333333333 0.89616137259456 15.999 > 118 126 O 0.56199550339461 0.91666666666667 0.89616137259456 15.999 > 118 127 O 0.93800449660539 0.08333333333333 0.06282803926123 15.999 > 127 128 O 0.93800449660539 0.41666666666667 0.06282803926123 15.999 > 127 129 O 0.93800449660539 0.75000000000000 0.06282803926123 15.999 > 127 130 O 0.93800449660539 0.08333333333333 0.39616137259456 15.999 > 127 131 O 0.93800449660539 0.41666666666667 0.39616137259456 15.999 > 127 132 O 0.93800449660539 0.75000000000000 0.39616137259456 15.999 > 127 133 O 0.93800449660539 0.08333333333333 0.72949470592789 15.999 > 127 134 O 0.93800449660539 0.41666666666667 0.72949470592789 15.999 > 127 135 O 0.93800449660539 0.75000000000000 0.72949470592789 15.999 > 127 136 O 0.43800449660539 0.08333333333333 0.10383862740544 15.999 > 136 137 O 0.43800449660539 0.41666666666667 0.10383862740544 15.999 > 136 138 O 0.43800449660539 0.75000000000000 0.10383862740544 15.999 > 136 139 O 0.43800449660539 0.08333333333333 0.43717196073877 15.999 > 136 140 O 0.43800449660539 0.41666666666667 0.43717196073877 15.999 > 136 141 O 0.43800449660539 0.75000000000000 0.43717196073877 15.999 > 136 142 O 0.43800449660539 0.08333333333333 0.77050529407211 15.999 > 136 143 O 0.43800449660539 0.41666666666667 0.77050529407211 15.999 > 136 144 O 0.43800449660539 0.75000000000000 0.77050529407211 15.999 > 136 ---------------------------------------------------------------------------- NAC parameters were read from "phono3py_mlp_eval_fc3_disp.yaml.xz". --------------------------- Dielectric constant ---------------------------- 3.9792893 0.0000000 0.0000000 0.0000000 4.1714889 0.0000000 0.0000000 0.0000000 3.9899115 -------------------------- Born effective charges -------------------------- 1 Sc 3.7636358 0.0000000 0.0160169 0.0000000 4.2049633 0.0000000 -0.1324085 0.0000000 3.3270621 2 Sc 3.7636358 0.0000000 -0.0160169 0.0000000 4.2049633 0.0000000 0.1324085 0.0000000 3.3270621 3 Sc 3.7636358 0.0000000 0.0160169 0.0000000 4.2049633 0.0000000 -0.1324085 0.0000000 3.3270621 4 Sc 3.7636358 0.0000000 -0.0160169 0.0000000 4.2049633 0.0000000 0.1324085 0.0000000 3.3270621 5 H 0.6160152 0.0000000 -0.6252183 0.0000000 0.2697149 0.0000000 -0.6326107 0.0000000 1.4192540 6 H 0.6160152 0.0000000 0.6252183 0.0000000 0.2697149 0.0000000 0.6326107 0.0000000 1.4192540 7 H 0.6160152 0.0000000 -0.6252183 0.0000000 0.2697149 0.0000000 -0.6326107 0.0000000 1.4192540 8 H 0.6160152 0.0000000 0.6252183 0.0000000 0.2697149 0.0000000 0.6326107 0.0000000 1.4192540 9 O -2.1390153 0.0000000 -0.5752736 0.0000000 -2.6490455 0.0000000 -0.6528439 0.0000000 -2.6903177 10 O -2.1390153 0.0000000 0.5752736 0.0000000 -2.6490455 0.0000000 0.6528439 0.0000000 -2.6903177 11 O -2.1390153 0.0000000 -0.5752736 0.0000000 -2.6490455 0.0000000 -0.6528439 0.0000000 -2.6903177 12 O -2.1390153 0.0000000 0.5752736 0.0000000 -2.6490455 0.0000000 0.6528439 0.0000000 -2.6903177 13 O -2.2406357 0.0000000 0.2511363 0.0000000 -1.8256328 0.0000000 0.2248571 0.0000000 -2.0559984 14 O -2.2406357 0.0000000 -0.2511363 0.0000000 -1.8256328 0.0000000 -0.2248571 0.0000000 -2.0559984 15 O -2.2406357 0.0000000 0.2511363 0.0000000 -1.8256328 0.0000000 0.2248571 0.0000000 -2.0559984 16 O -2.2406357 0.0000000 -0.2511363 0.0000000 -1.8256328 0.0000000 -0.2248571 0.0000000 -2.0559984 ---------------------------------------------------------------------------- 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] [ 0.0000 0.0000 0.0100] [ 0.0000 0.0000 -0.0100] Computing fc3[ 37, 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] [ 0.0000 0.0000 0.0100] [ 0.0000 0.0000 -0.0100] 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] [ 0.0000 0.0000 0.0100] [ 0.0000 0.0000 -0.0100] Computing fc3[ 109, 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] [ 0.0000 0.0000 0.0100] [ 0.0000 0.0000 -0.0100] Expanding fc3. Symmetrizing fc3 by traditional approach (N=3). Symmetrizing fc2 by traditional approach (N=3). Max drift of fc3: 0.00000000 (zzz) 0.00000000 (zzz) 0.00000000 (zzz) fc3 was written into "fc3.hdf5". Max drift of fc2: -0.00000000 (zz) -0.00000000 (zz) 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 2026-01-08 20:32:44]------------------------- _ ___ _ __ __| | / _ \ '_ \ / _` | | __/ | | | (_| | \___|_| |_|\__,_| ---------------------------- ------ calculate LTC ------- ---------------------------- _ _____ _ __ | |__ ___ _ __ ___|___ / _ __ _ _ | '_ \| '_ \ / _ \| '_ \ / _ \ |_ \| '_ \| | | | | |_) | | | | (_) | | | | (_) |__) | |_) | |_| | | .__/|_| |_|\___/|_| |_|\___/____/| .__/ \__, | |_| |_| |___/ 3.23.0 -------------------------[time 2026-01-08 20:32:44]------------------------- 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): [1 3 3] Primitive matrix: [1. 0. 0.] [0. 1. 0.] [0. 0. 1.] Spacegroup: Pnma (62) ------------------------------ primitive cell ------------------------------ Lattice vectors: a 10.218108270000000 0.000000000000000 0.000000000000000 b 0.000000000000000 3.201433030000000 0.000000000000000 c 0.000000000000000 0.000000000000000 4.726817620000000 Atomic positions (fractional): 1 Sc 0.85722938443406 0.75000000000000 0.92182247840999 44.956 2 Sc 0.35722938443406 0.75000000000000 0.57817752159001 44.956 3 Sc 0.14277061556594 0.25000000000000 0.07817752159001 44.956 4 Sc 0.64277061556594 0.25000000000000 0.42182247840999 44.956 5 H 0.09810278869487 0.75000000000000 0.61105074581935 1.008 6 H 0.59810278869487 0.75000000000000 0.88894925418065 1.008 7 H 0.90189721130513 0.25000000000000 0.38894925418065 1.008 8 H 0.40189721130513 0.25000000000000 0.11105074581935 1.008 9 O 0.19145235278014 0.75000000000000 0.32983791973795 15.999 10 O 0.69145235278014 0.75000000000000 0.17016208026205 15.999 11 O 0.80854764721986 0.25000000000000 0.67016208026205 15.999 12 O 0.30854764721986 0.25000000000000 0.82983791973795 15.999 13 O 0.06199550339461 0.75000000000000 0.81151588221632 15.999 14 O 0.56199550339461 0.75000000000000 0.68848411778368 15.999 15 O 0.93800449660539 0.25000000000000 0.18848411778368 15.999 16 O 0.43800449660539 0.25000000000000 0.31151588221632 15.999 -------------------------------- supercell --------------------------------- Lattice vectors: a 10.218108270000000 0.000000000000000 0.000000000000000 b 0.000000000000000 9.604299090000000 0.000000000000000 c 0.000000000000000 0.000000000000000 14.180452860000001 Atomic positions (fractional): 1 Sc 0.85722938443406 0.25000000000000 0.30727415947000 44.956 > 1 2 Sc 0.85722938443406 0.58333333333333 0.30727415947000 44.956 > 1 3 Sc 0.85722938443406 0.91666666666667 0.30727415947000 44.956 > 1 4 Sc 0.85722938443406 0.25000000000000 0.64060749280333 44.956 > 1 5 Sc 0.85722938443406 0.58333333333333 0.64060749280333 44.956 > 1 6 Sc 0.85722938443406 0.91666666666667 0.64060749280333 44.956 > 1 7 Sc 0.85722938443406 0.25000000000000 0.97394082613666 44.956 > 1 8 Sc 0.85722938443406 0.58333333333333 0.97394082613666 44.956 > 1 9 Sc 0.85722938443406 0.91666666666667 0.97394082613666 44.956 > 1 10 Sc 0.35722938443406 0.25000000000000 0.19272584053000 44.956 > 10 11 Sc 0.35722938443406 0.58333333333333 0.19272584053000 44.956 > 10 12 Sc 0.35722938443406 0.91666666666667 0.19272584053000 44.956 > 10 13 Sc 0.35722938443406 0.25000000000000 0.52605917386334 44.956 > 10 14 Sc 0.35722938443406 0.58333333333333 0.52605917386334 44.956 > 10 15 Sc 0.35722938443406 0.91666666666667 0.52605917386334 44.956 > 10 16 Sc 0.35722938443406 0.25000000000000 0.85939250719667 44.956 > 10 17 Sc 0.35722938443406 0.58333333333333 0.85939250719667 44.956 > 10 18 Sc 0.35722938443406 0.91666666666667 0.85939250719667 44.956 > 10 19 Sc 0.14277061556594 0.08333333333333 0.02605917386334 44.956 > 19 20 Sc 0.14277061556594 0.41666666666667 0.02605917386334 44.956 > 19 21 Sc 0.14277061556594 0.75000000000000 0.02605917386334 44.956 > 19 22 Sc 0.14277061556594 0.08333333333333 0.35939250719667 44.956 > 19 23 Sc 0.14277061556594 0.41666666666667 0.35939250719667 44.956 > 19 24 Sc 0.14277061556594 0.75000000000000 0.35939250719667 44.956 > 19 25 Sc 0.14277061556594 0.08333333333333 0.69272584053000 44.956 > 19 26 Sc 0.14277061556594 0.41666666666667 0.69272584053000 44.956 > 19 27 Sc 0.14277061556594 0.75000000000000 0.69272584053000 44.956 > 19 28 Sc 0.64277061556594 0.08333333333333 0.14060749280333 44.956 > 28 29 Sc 0.64277061556594 0.41666666666667 0.14060749280333 44.956 > 28 30 Sc 0.64277061556594 0.75000000000000 0.14060749280333 44.956 > 28 31 Sc 0.64277061556594 0.08333333333333 0.47394082613666 44.956 > 28 32 Sc 0.64277061556594 0.41666666666667 0.47394082613666 44.956 > 28 33 Sc 0.64277061556594 0.75000000000000 0.47394082613666 44.956 > 28 34 Sc 0.64277061556594 0.08333333333333 0.80727415947000 44.956 > 28 35 Sc 0.64277061556594 0.41666666666667 0.80727415947000 44.956 > 28 36 Sc 0.64277061556594 0.75000000000000 0.80727415947000 44.956 > 28 37 H 0.09810278869487 0.25000000000000 0.20368358193978 1.008 > 37 38 H 0.09810278869487 0.58333333333333 0.20368358193978 1.008 > 37 39 H 0.09810278869487 0.91666666666667 0.20368358193978 1.008 > 37 40 H 0.09810278869487 0.25000000000000 0.53701691527312 1.008 > 37 41 H 0.09810278869487 0.58333333333333 0.53701691527312 1.008 > 37 42 H 0.09810278869487 0.91666666666667 0.53701691527312 1.008 > 37 43 H 0.09810278869487 0.25000000000000 0.87035024860645 1.008 > 37 44 H 0.09810278869487 0.58333333333333 0.87035024860645 1.008 > 37 45 H 0.09810278869487 0.91666666666667 0.87035024860645 1.008 > 37 46 H 0.59810278869487 0.25000000000000 0.29631641806022 1.008 > 46 47 H 0.59810278869487 0.58333333333333 0.29631641806022 1.008 > 46 48 H 0.59810278869487 0.91666666666667 0.29631641806022 1.008 > 46 49 H 0.59810278869487 0.25000000000000 0.62964975139355 1.008 > 46 50 H 0.59810278869487 0.58333333333333 0.62964975139355 1.008 > 46 51 H 0.59810278869487 0.91666666666667 0.62964975139355 1.008 > 46 52 H 0.59810278869487 0.25000000000000 0.96298308472688 1.008 > 46 53 H 0.59810278869487 0.58333333333333 0.96298308472688 1.008 > 46 54 H 0.59810278869487 0.91666666666667 0.96298308472688 1.008 > 46 55 H 0.90189721130513 0.08333333333333 0.12964975139355 1.008 > 55 56 H 0.90189721130513 0.41666666666667 0.12964975139355 1.008 > 55 57 H 0.90189721130513 0.75000000000000 0.12964975139355 1.008 > 55 58 H 0.90189721130513 0.08333333333333 0.46298308472688 1.008 > 55 59 H 0.90189721130513 0.41666666666667 0.46298308472688 1.008 > 55 60 H 0.90189721130513 0.75000000000000 0.46298308472688 1.008 > 55 61 H 0.90189721130513 0.08333333333333 0.79631641806022 1.008 > 55 62 H 0.90189721130513 0.41666666666667 0.79631641806022 1.008 > 55 63 H 0.90189721130513 0.75000000000000 0.79631641806022 1.008 > 55 64 H 0.40189721130513 0.08333333333333 0.03701691527312 1.008 > 64 65 H 0.40189721130513 0.41666666666667 0.03701691527312 1.008 > 64 66 H 0.40189721130513 0.75000000000000 0.03701691527312 1.008 > 64 67 H 0.40189721130513 0.08333333333333 0.37035024860645 1.008 > 64 68 H 0.40189721130513 0.41666666666667 0.37035024860645 1.008 > 64 69 H 0.40189721130513 0.75000000000000 0.37035024860645 1.008 > 64 70 H 0.40189721130513 0.08333333333333 0.70368358193978 1.008 > 64 71 H 0.40189721130513 0.41666666666667 0.70368358193978 1.008 > 64 72 H 0.40189721130513 0.75000000000000 0.70368358193978 1.008 > 64 73 O 0.19145235278014 0.25000000000000 0.10994597324598 15.999 > 73 74 O 0.19145235278014 0.58333333333333 0.10994597324598 15.999 > 73 75 O 0.19145235278014 0.91666666666667 0.10994597324598 15.999 > 73 76 O 0.19145235278014 0.25000000000000 0.44327930657932 15.999 > 73 77 O 0.19145235278014 0.58333333333333 0.44327930657932 15.999 > 73 78 O 0.19145235278014 0.91666666666667 0.44327930657932 15.999 > 73 79 O 0.19145235278014 0.25000000000000 0.77661263991265 15.999 > 73 80 O 0.19145235278014 0.58333333333333 0.77661263991265 15.999 > 73 81 O 0.19145235278014 0.91666666666667 0.77661263991265 15.999 > 73 82 O 0.69145235278014 0.25000000000000 0.05672069342068 15.999 > 82 83 O 0.69145235278014 0.58333333333333 0.05672069342068 15.999 > 82 84 O 0.69145235278014 0.91666666666667 0.05672069342068 15.999 > 82 85 O 0.69145235278014 0.25000000000000 0.39005402675402 15.999 > 82 86 O 0.69145235278014 0.58333333333333 0.39005402675402 15.999 > 82 87 O 0.69145235278014 0.91666666666667 0.39005402675402 15.999 > 82 88 O 0.69145235278014 0.25000000000000 0.72338736008735 15.999 > 82 89 O 0.69145235278014 0.58333333333333 0.72338736008735 15.999 > 82 90 O 0.69145235278014 0.91666666666667 0.72338736008735 15.999 > 82 91 O 0.80854764721986 0.08333333333333 0.22338736008735 15.999 > 91 92 O 0.80854764721986 0.41666666666667 0.22338736008735 15.999 > 91 93 O 0.80854764721986 0.75000000000000 0.22338736008735 15.999 > 91 94 O 0.80854764721986 0.08333333333333 0.55672069342068 15.999 > 91 95 O 0.80854764721986 0.41666666666667 0.55672069342068 15.999 > 91 96 O 0.80854764721986 0.75000000000000 0.55672069342068 15.999 > 91 97 O 0.80854764721986 0.08333333333333 0.89005402675402 15.999 > 91 98 O 0.80854764721986 0.41666666666667 0.89005402675402 15.999 > 91 99 O 0.80854764721986 0.75000000000000 0.89005402675402 15.999 > 91 100 O 0.30854764721986 0.08333333333333 0.27661263991265 15.999 > 100 101 O 0.30854764721986 0.41666666666667 0.27661263991265 15.999 > 100 102 O 0.30854764721986 0.75000000000000 0.27661263991265 15.999 > 100 103 O 0.30854764721986 0.08333333333333 0.60994597324598 15.999 > 100 104 O 0.30854764721986 0.41666666666667 0.60994597324598 15.999 > 100 105 O 0.30854764721986 0.75000000000000 0.60994597324598 15.999 > 100 106 O 0.30854764721986 0.08333333333333 0.94327930657932 15.999 > 100 107 O 0.30854764721986 0.41666666666667 0.94327930657932 15.999 > 100 108 O 0.30854764721986 0.75000000000000 0.94327930657932 15.999 > 100 109 O 0.06199550339461 0.25000000000000 0.27050529407211 15.999 > 109 110 O 0.06199550339461 0.58333333333333 0.27050529407211 15.999 > 109 111 O 0.06199550339461 0.91666666666667 0.27050529407211 15.999 > 109 112 O 0.06199550339461 0.25000000000000 0.60383862740544 15.999 > 109 113 O 0.06199550339461 0.58333333333333 0.60383862740544 15.999 > 109 114 O 0.06199550339461 0.91666666666667 0.60383862740544 15.999 > 109 115 O 0.06199550339461 0.25000000000000 0.93717196073877 15.999 > 109 116 O 0.06199550339461 0.58333333333333 0.93717196073877 15.999 > 109 117 O 0.06199550339461 0.91666666666667 0.93717196073877 15.999 > 109 118 O 0.56199550339461 0.25000000000000 0.22949470592789 15.999 > 118 119 O 0.56199550339461 0.58333333333333 0.22949470592789 15.999 > 118 120 O 0.56199550339461 0.91666666666667 0.22949470592789 15.999 > 118 121 O 0.56199550339461 0.25000000000000 0.56282803926123 15.999 > 118 122 O 0.56199550339461 0.58333333333333 0.56282803926123 15.999 > 118 123 O 0.56199550339461 0.91666666666667 0.56282803926123 15.999 > 118 124 O 0.56199550339461 0.25000000000000 0.89616137259456 15.999 > 118 125 O 0.56199550339461 0.58333333333333 0.89616137259456 15.999 > 118 126 O 0.56199550339461 0.91666666666667 0.89616137259456 15.999 > 118 127 O 0.93800449660539 0.08333333333333 0.06282803926123 15.999 > 127 128 O 0.93800449660539 0.41666666666667 0.06282803926123 15.999 > 127 129 O 0.93800449660539 0.75000000000000 0.06282803926123 15.999 > 127 130 O 0.93800449660539 0.08333333333333 0.39616137259456 15.999 > 127 131 O 0.93800449660539 0.41666666666667 0.39616137259456 15.999 > 127 132 O 0.93800449660539 0.75000000000000 0.39616137259456 15.999 > 127 133 O 0.93800449660539 0.08333333333333 0.72949470592789 15.999 > 127 134 O 0.93800449660539 0.41666666666667 0.72949470592789 15.999 > 127 135 O 0.93800449660539 0.75000000000000 0.72949470592789 15.999 > 127 136 O 0.43800449660539 0.08333333333333 0.10383862740544 15.999 > 136 137 O 0.43800449660539 0.41666666666667 0.10383862740544 15.999 > 136 138 O 0.43800449660539 0.75000000000000 0.10383862740544 15.999 > 136 139 O 0.43800449660539 0.08333333333333 0.43717196073877 15.999 > 136 140 O 0.43800449660539 0.41666666666667 0.43717196073877 15.999 > 136 141 O 0.43800449660539 0.75000000000000 0.43717196073877 15.999 > 136 142 O 0.43800449660539 0.08333333333333 0.77050529407211 15.999 > 136 143 O 0.43800449660539 0.41666666666667 0.77050529407211 15.999 > 136 144 O 0.43800449660539 0.75000000000000 0.77050529407211 15.999 > 136 ---------------------------------------------------------------------------- NAC parameters were read from "phono3py.yaml". --------------------------- Dielectric constant ---------------------------- 3.9792893 0.0000000 0.0000000 0.0000000 4.1714889 0.0000000 0.0000000 0.0000000 3.9899115 -------------------------- Born effective charges -------------------------- 1 Sc 3.7636358 0.0000000 0.0160169 0.0000000 4.2049633 0.0000000 -0.1324085 0.0000000 3.3270621 2 Sc 3.7636358 0.0000000 -0.0160169 0.0000000 4.2049633 0.0000000 0.1324085 0.0000000 3.3270621 3 Sc 3.7636358 0.0000000 0.0160169 0.0000000 4.2049633 0.0000000 -0.1324085 0.0000000 3.3270621 4 Sc 3.7636358 0.0000000 -0.0160169 0.0000000 4.2049633 0.0000000 0.1324085 0.0000000 3.3270621 5 H 0.6160152 0.0000000 -0.6252183 0.0000000 0.2697149 0.0000000 -0.6326107 0.0000000 1.4192540 6 H 0.6160152 0.0000000 0.6252183 0.0000000 0.2697149 0.0000000 0.6326107 0.0000000 1.4192540 7 H 0.6160152 0.0000000 -0.6252183 0.0000000 0.2697149 0.0000000 -0.6326107 0.0000000 1.4192540 8 H 0.6160152 0.0000000 0.6252183 0.0000000 0.2697149 0.0000000 0.6326107 0.0000000 1.4192540 9 O -2.1390153 0.0000000 -0.5752736 0.0000000 -2.6490455 0.0000000 -0.6528439 0.0000000 -2.6903177 10 O -2.1390153 0.0000000 0.5752736 0.0000000 -2.6490455 0.0000000 0.6528439 0.0000000 -2.6903177 11 O -2.1390153 0.0000000 -0.5752736 0.0000000 -2.6490455 0.0000000 -0.6528439 0.0000000 -2.6903177 12 O -2.1390153 0.0000000 0.5752736 0.0000000 -2.6490455 0.0000000 0.6528439 0.0000000 -2.6903177 13 O -2.2406357 0.0000000 0.2511363 0.0000000 -1.8256328 0.0000000 0.2248571 0.0000000 -2.0559984 14 O -2.2406357 0.0000000 -0.2511363 0.0000000 -1.8256328 0.0000000 -0.2248571 0.0000000 -2.0559984 15 O -2.2406357 0.0000000 0.2511363 0.0000000 -1.8256328 0.0000000 0.2248571 0.0000000 -2.0559984 16 O -2.2406357 0.0000000 -0.2511363 0.0000000 -1.8256328 0.0000000 -0.2248571 0.0000000 -2.0559984 ---------------------------------------------------------------------------- fc3 was read from "fc3.hdf5". fc2 was read from "fc2.hdf5". ----------------------------- Force constants ------------------------------ Max drift of fc3: 0.00000000 (zzz) 0.00000000 (zzz) 0.00000000 (zzz) Max drift of fc2: -0.00000000 (zz) -0.00000000 (zz) --------------------------- 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 ... [ 5 16 11 ] 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: 0.77, Number of G-points: 309, Lambda: 0.16 Running harmonic phonon calculations... -------------------- Lattice thermal conductivity (RTA) -------------------- ======================= Grid point 0 (1/162) ======================= q-point: ( 0.00 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 162 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 3.110 ( 0.000 0.000 0.000) 0.000 3.698 ( 0.000 0.000 0.000) 0.000 4.072 ( 0.000 0.000 0.000) 0.000 5.287 ( 0.000 0.000 0.000) 0.000 5.571 ( 0.000 0.000 0.000) 0.000 6.436 ( 0.000 0.000 0.000) 0.000 7.145 ( 0.000 0.000 0.000) 0.000 7.300 ( 0.000 0.000 0.000) 0.000 7.874 ( 0.000 0.000 0.000) 0.000 8.378 ( 0.000 0.000 0.000) 0.000 8.500 ( 0.000 0.000 0.000) 0.000 8.832 ( 0.000 0.000 0.000) 0.000 9.115 ( 0.000 0.000 0.000) 0.000 9.153 ( 0.000 0.000 0.000) 0.000 9.156 ( 0.000 0.000 0.000) 0.000 9.837 ( 0.000 0.000 0.000) 0.000 10.653 ( 0.000 0.000 0.000) 0.000 11.501 ( 0.000 0.000 0.000) 0.000 11.621 ( 0.000 0.000 0.000) 0.000 12.027 ( 0.000 0.000 0.000) 0.000 12.074 ( 0.000 0.000 0.000) 0.000 12.106 ( 0.000 0.000 0.000) 0.000 12.190 ( 0.000 0.000 0.000) 0.000 12.191 ( 0.000 0.000 0.000) 0.000 13.004 ( 0.000 0.000 0.000) 0.000 13.757 ( 0.000 0.000 0.000) 0.000 14.261 ( 0.000 0.000 0.000) 0.000 14.733 ( 0.000 0.000 0.000) 0.000 15.450 ( 0.000 0.000 0.000) 0.000 15.687 ( 0.000 0.000 0.000) 0.000 16.032 ( 0.000 0.000 0.000) 0.000 18.358 ( 0.000 0.000 0.000) 0.000 19.424 ( 0.000 0.000 0.000) 0.000 27.393 ( 0.000 0.000 0.000) 0.000 27.466 ( 0.000 0.000 0.000) 0.000 28.741 ( 0.000 0.000 0.000) 0.000 28.809 ( 0.000 0.000 0.000) 0.000 29.700 ( 0.000 0.000 0.000) 0.000 30.842 ( 0.000 0.000 0.000) 0.000 32.262 ( 0.000 0.000 0.000) 0.000 32.368 ( 0.000 0.000 0.000) 0.000 85.898 ( 0.000 0.000 0.000) 0.000 86.092 ( 0.000 0.000 0.000) 0.000 86.401 ( 0.000 0.000 0.000) 0.000 86.658 ( 0.000 0.000 0.000) 0.000 ======================= Grid point 1 (2/162) ======================= q-point: ( 0.20 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 162 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.846 ( 42.361 0.000 0.000) 42.361 0.889 ( 44.844 0.000 0.000) 44.844 1.528 ( 76.128 0.000 0.000) 76.128 2.908 ( -18.696 0.000 0.000) 18.696 3.240 ( -32.632 0.000 0.000) 32.632 4.421 ( 21.435 0.000 0.000) 21.435 5.233 ( -5.556 0.000 0.000) 5.556 5.673 ( -56.718 0.000 0.000) 56.718 5.830 ( 17.844 0.000 0.000) 17.844 7.047 ( -12.048 0.000 0.000) 12.048 7.816 ( 33.251 0.000 0.000) 33.251 7.953 ( 7.816 0.000 0.000) 7.816 8.388 ( 1.066 0.000 0.000) 1.066 8.487 ( -1.252 0.000 0.000) 1.252 8.771 ( -5.483 0.000 0.000) 5.483 9.107 ( -5.200 0.000 0.000) 5.200 9.120 ( 0.465 0.000 0.000) 0.465 9.150 ( -0.270 0.000 0.000) 0.270 10.689 ( 3.558 0.000 0.000) 3.558 11.153 ( -8.592 0.000 0.000) 8.592 11.667 ( 3.709 0.000 0.000) 3.709 11.943 ( -6.858 0.000 0.000) 6.858 12.078 ( 0.432 0.000 0.000) 0.432 12.105 ( -0.149 0.000 0.000) 0.149 12.189 ( -0.145 0.000 0.000) 0.145 12.190 ( -0.127 0.000 0.000) 0.127 13.083 ( 7.001 0.000 0.000) 7.001 13.658 ( -9.144 0.000 0.000) 9.144 14.346 ( 7.989 0.000 0.000) 7.989 14.729 ( -0.877 0.000 0.000) 0.877 15.487 ( 3.424 0.000 0.000) 3.424 15.669 ( -1.679 0.000 0.000) 1.679 16.059 ( 2.550 0.000 0.000) 2.550 16.287 ( -3.158 0.000 0.000) 3.158 19.428 ( 0.451 0.000 0.000) 0.451 19.488 ( -0.959 0.000 0.000) 0.959 27.400 ( 0.659 0.000 0.000) 0.659 27.458 ( -0.714 0.000 0.000) 0.714 28.747 ( 0.673 0.000 0.000) 0.673 28.803 ( -0.617 0.000 0.000) 0.617 30.865 ( 2.291 0.000 0.000) 2.291 31.072 ( -2.569 0.000 0.000) 2.569 32.274 ( 1.150 0.000 0.000) 1.150 32.359 ( -0.861 0.000 0.000) 0.861 85.926 ( 2.884 0.000 0.000) 2.884 86.295 ( -8.049 0.000 0.000) 8.049 86.771 ( 8.674 0.000 0.000) 8.674 87.194 ( -3.516 0.000 0.000) 3.516 ======================= Grid point 2 (3/162) ======================= q-point: ( 0.40 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 162 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.641 ( 38.307 0.000 0.000) 38.307 1.745 ( 42.406 0.000 0.000) 42.406 2.306 ( -25.821 0.000 0.000) 25.821 2.539 ( -38.474 0.000 0.000) 38.474 3.093 ( 67.651 0.000 0.000) 67.651 4.449 ( -67.069 0.000 0.000) 67.069 4.797 ( 16.687 0.000 0.000) 16.687 5.070 ( -11.140 0.000 0.000) 11.140 6.259 ( 24.098 0.000 0.000) 24.098 6.714 ( -21.170 0.000 0.000) 21.170 8.151 ( 11.092 0.000 0.000) 11.092 8.264 ( 6.560 0.000 0.000) 6.560 8.417 ( 1.800 0.000 0.000) 1.800 8.455 ( -1.913 0.000 0.000) 1.913 8.720 ( 5.736 0.000 0.000) 5.736 8.944 ( -11.516 0.000 0.000) 11.516 9.131 ( 0.634 0.000 0.000) 0.634 9.143 ( -0.516 0.000 0.000) 0.516 10.792 ( 7.073 0.000 0.000) 7.073 10.962 ( -9.958 0.000 0.000) 9.958 11.740 ( 3.611 0.000 0.000) 3.611 11.820 ( -5.067 0.000 0.000) 5.067 12.089 ( 0.598 0.000 0.000) 0.598 12.099 ( -0.419 0.000 0.000) 0.419 12.186 ( -0.063 0.000 0.000) 0.063 12.187 ( -0.110 0.000 0.000) 0.110 13.246 ( 9.377 0.000 0.000) 9.377 13.449 ( -11.177 0.000 0.000) 11.177 14.528 ( 9.283 0.000 0.000) 9.283 14.674 ( -5.163 0.000 0.000) 5.163 15.563 ( 3.844 0.000 0.000) 3.844 15.627 ( -2.635 0.000 0.000) 2.635 16.124 ( 3.922 0.000 0.000) 3.922 16.208 ( -4.497 0.000 0.000) 4.497 19.442 ( 0.980 0.000 0.000) 0.980 19.465 ( -1.295 0.000 0.000) 1.295 27.417 ( 1.091 0.000 0.000) 1.091 27.440 ( -1.125 0.000 0.000) 1.125 28.765 ( 1.059 0.000 0.000) 1.059 28.786 ( -1.024 0.000 0.000) 1.024 30.927 ( 3.816 0.000 0.000) 3.816 31.006 ( -3.983 0.000 0.000) 3.983 32.303 ( 1.682 0.000 0.000) 1.682 32.335 ( -1.508 0.000 0.000) 1.508 86.009 ( 5.506 0.000 0.000) 5.506 86.138 ( -7.530 0.000 0.000) 7.530 86.945 ( 8.544 0.000 0.000) 8.544 87.094 ( -6.524 0.000 0.000) 6.524 ======================= Grid point 5 (4/162) ======================= q-point: ( 0.00 0.06 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 144 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.677 ( 0.000 36.993 0.000) 36.993 0.886 ( 0.000 45.142 0.000) 45.142 1.693 ( 0.000 85.947 0.000) 85.947 3.218 ( 0.000 10.877 0.000) 10.877 3.925 ( 0.000 21.352 0.000) 21.352 4.319 ( 0.000 23.257 0.000) 23.257 5.435 ( 0.000 4.918 0.000) 4.918 5.739 ( 0.000 26.135 0.000) 26.135 6.506 ( 0.000 7.693 0.000) 7.693 7.197 ( 0.000 5.436 0.000) 5.436 7.285 ( 0.000 -1.526 0.000) 1.526 7.888 ( 0.000 1.462 0.000) 1.462 8.521 ( 0.000 2.104 0.000) 2.104 8.714 ( 0.000 -7.058 0.000) 7.058 9.115 ( 0.000 -4.193 0.000) 4.193 9.239 ( 0.000 8.430 0.000) 8.430 9.299 ( 0.000 14.199 0.000) 14.199 9.840 ( 0.000 0.396 0.000) 0.396 10.119 ( 0.000 -1.026 0.000) 1.026 10.628 ( 0.000 -2.376 0.000) 2.376 11.453 ( 0.000 -4.349 0.000) 4.349 11.622 ( 0.000 0.180 0.000) 0.180 11.824 ( 0.000 -10.671 0.000) 10.671 11.912 ( 0.000 -14.193 0.000) 14.193 12.214 ( 0.000 10.293 0.000) 10.293 12.481 ( 0.000 19.217 0.000) 19.217 12.974 ( 0.000 -3.063 0.000) 3.063 13.733 ( 0.000 -2.403 0.000) 2.403 14.467 ( 0.000 17.020 0.000) 17.020 14.674 ( 0.000 -5.914 0.000) 5.914 15.415 ( 0.000 -3.468 0.000) 3.468 15.730 ( 0.000 5.485 0.000) 5.485 15.966 ( 0.000 -6.537 0.000) 6.537 18.293 ( 0.000 -6.541 0.000) 6.541 18.821 ( 0.000 -2.651 0.000) 2.651 19.301 ( 0.000 -12.247 0.000) 12.247 27.485 ( 0.000 9.137 0.000) 9.137 28.681 ( 0.000 3.793 0.000) 3.793 28.755 ( 0.000 1.467 0.000) 1.467 28.830 ( 0.000 2.087 0.000) 2.087 29.756 ( 0.000 5.654 0.000) 5.654 30.837 ( 0.000 -0.424 0.000) 0.424 32.232 ( 0.000 -3.030 0.000) 3.030 32.313 ( 0.000 -5.417 0.000) 5.417 85.891 ( 0.000 -0.641 0.000) 0.641 86.080 ( 0.000 -1.142 0.000) 1.142 86.371 ( 0.000 -2.969 0.000) 2.969 86.612 ( 0.000 -4.511 0.000) 4.511 ======================= Grid point 6 (5/162) ======================= q-point: ( 0.20 0.06 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 240 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.070 ( 32.250 22.267 0.000) 39.190 1.350 ( 35.116 32.476 0.000) 47.831 2.207 ( 46.806 62.036 0.000) 77.713 2.990 ( -19.483 10.395 0.000) 22.083 3.475 ( -31.960 21.760 0.000) 38.665 4.671 ( 21.941 23.752 0.000) 32.335 5.475 ( -0.984 17.993 0.000) 18.020 5.791 ( -53.294 12.650 0.000) 54.775 5.852 ( 14.179 10.515 0.000) 17.652 7.047 ( -12.493 0.054 0.000) 12.493 7.810 ( 30.603 -0.486 0.000) 30.607 7.922 ( 4.351 0.008 0.000) 4.351 8.513 ( -0.767 2.794 0.000) 2.897 8.673 ( -3.058 -5.948 0.000) 6.688 8.856 ( -27.089 24.558 0.000) 36.564 9.070 ( -4.791 -3.672 0.000) 6.036 9.263 ( -0.124 11.290 0.000) 11.290 9.297 ( -0.240 14.192 0.000) 14.194 10.666 ( 3.700 -2.151 0.000) 4.280 10.969 ( 11.762 -17.601 0.000) 21.169 11.532 ( 10.177 -16.688 0.000) 19.546 11.701 ( 7.128 -7.451 0.000) 10.311 11.778 ( -3.546 -9.402 0.000) 10.048 11.920 ( 0.246 -14.535 0.000) 14.537 12.230 ( 1.715 10.887 0.000) 11.021 12.436 ( -3.865 18.268 0.000) 18.673 13.048 ( 6.942 -3.482 0.000) 7.766 13.687 ( -6.982 -1.218 0.000) 7.087 14.537 ( 6.257 15.036 0.000) 16.286 14.686 ( 1.985 -5.279 0.000) 5.640 15.448 ( 3.149 -3.845 0.000) 4.970 15.690 ( -3.343 1.797 0.000) 3.795 16.039 ( 6.805 -0.433 0.000) 6.819 17.196 ( -49.804 44.537 0.000) 66.813 19.238 ( 9.842 -18.627 0.000) 21.068 19.305 ( 0.365 -12.264 0.000) 12.270 27.498 ( 1.363 9.733 0.000) 9.828 27.916 ( -26.172 30.199 0.000) 39.961 28.766 ( 0.710 1.855 0.000) 1.987 28.824 ( -0.640 2.066 0.000) 2.163 30.603 ( 29.051 -26.414 0.000) 39.264 30.852 ( 1.445 -1.142 0.000) 1.842 32.235 ( 0.561 -3.464 0.000) 3.509 32.305 ( -0.781 -5.317 0.000) 5.374 85.919 ( 2.827 -0.694 0.000) 2.911 86.273 ( -7.516 -2.117 0.000) 7.808 86.605 ( 25.614 -30.147 0.000) 39.559 86.704 ( 6.841 -6.453 0.000) 9.404 ======================= Grid point 7 (6/162) ======================= q-point: ( 0.40 0.06 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 240 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.751 ( 35.259 12.427 0.000) 37.385 2.068 ( 36.962 26.527 0.000) 45.496 2.406 ( -29.014 11.207 0.000) 31.103 2.800 ( -36.290 23.373 0.000) 43.166 3.409 ( 61.849 33.208 0.000) 70.200 4.641 ( -61.327 20.133 0.000) 64.548 5.067 ( 16.656 25.882 0.000) 30.778 5.345 ( -11.079 25.932 0.000) 28.199 6.254 ( 23.917 1.000 0.000) 23.938 6.709 ( -21.307 -0.097 0.000) 21.307 8.060 ( 8.722 -4.614 0.000) 9.867 8.172 ( 2.324 -6.714 0.000) 7.105 8.523 ( 2.644 5.653 0.000) 6.241 8.589 ( -5.560 11.809 0.000) 13.052 8.693 ( 8.364 -1.636 0.000) 8.523 8.919 ( -10.749 -2.320 0.000) 10.996 9.274 ( 0.809 12.274 0.000) 12.300 9.289 ( -0.618 13.719 0.000) 13.733 10.769 ( 6.776 -2.191 0.000) 7.122 10.921 ( -7.992 -3.998 0.000) 8.936 11.665 ( 3.461 -7.277 0.000) 8.058 11.716 ( -2.550 -6.859 0.000) 7.318 11.846 ( 5.547 -19.817 0.000) 20.579 11.910 ( -1.504 -16.679 0.000) 16.746 12.280 ( 3.297 12.509 0.000) 12.936 12.354 ( -4.150 15.370 0.000) 15.921 13.227 ( 11.084 -2.494 0.000) 11.361 13.471 ( -13.175 -0.333 0.000) 13.179 14.664 ( 5.442 9.049 0.000) 10.559 14.719 ( -0.012 0.672 0.000) 0.672 15.527 ( 4.574 -4.114 0.000) 6.151 15.615 ( -4.239 -2.202 0.000) 4.777 16.224 ( 12.315 11.472 0.000) 16.830 16.545 ( -21.834 28.362 0.000) 35.793 19.314 ( 0.505 -12.534 0.000) 12.545 19.316 ( 0.796 -13.955 0.000) 13.978 27.541 ( 3.147 11.955 0.000) 12.362 27.636 ( -7.374 17.684 0.000) 19.160 28.784 ( 1.101 1.932 0.000) 2.224 28.806 ( -1.063 2.008 0.000) 2.272 30.869 ( 4.104 -11.258 0.000) 11.983 30.883 ( 1.233 -3.909 0.000) 4.099 32.256 ( 1.409 -4.443 0.000) 4.661 32.284 ( -1.358 -5.018 0.000) 5.198 86.000 ( 5.356 -0.885 0.000) 5.429 86.125 ( -7.221 -1.314 0.000) 7.340 86.825 ( 4.711 -11.030 0.000) 11.994 86.853 ( 3.175 -19.745 0.000) 19.999 ======================= Grid point 10 (7/162) ======================= q-point: ( 0.00 0.12 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 162 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.456 ( 0.000 42.545 0.000) 42.545 1.758 ( 0.000 44.031 0.000) 44.031 3.319 ( 0.000 73.870 0.000) 73.870 3.537 ( 0.000 27.491 0.000) 27.491 4.423 ( 0.000 26.788 0.000) 26.788 4.852 ( 0.000 27.565 0.000) 27.565 5.453 ( 0.000 -0.137 0.000) 0.137 6.540 ( 0.000 50.628 0.000) 50.628 6.774 ( 0.000 21.036 0.000) 21.036 7.242 ( 0.000 -2.813 0.000) 2.813 7.351 ( 0.000 9.514 0.000) 9.514 7.933 ( 0.000 3.186 0.000) 3.186 8.576 ( 0.000 3.210 0.000) 3.210 8.660 ( 0.000 3.435 0.000) 3.435 8.996 ( 0.000 -7.827 0.000) 7.827 9.454 ( 0.000 12.596 0.000) 12.596 9.601 ( 0.000 16.255 0.000) 16.255 9.860 ( 0.000 2.061 0.000) 2.061 10.088 ( 0.000 -2.183 0.000) 2.183 10.573 ( 0.000 -2.738 0.000) 2.738 11.350 ( 0.000 -5.931 0.000) 5.931 11.606 ( 0.000 -15.906 0.000) 15.906 11.626 ( 0.000 0.161 0.000) 0.161 11.671 ( 0.000 -4.893 0.000) 4.893 12.475 ( 0.000 15.675 0.000) 15.675 12.858 ( 0.000 18.622 0.000) 18.622 12.888 ( 0.000 -5.449 0.000) 5.449 13.667 ( 0.000 -4.259 0.000) 4.259 14.514 ( 0.000 -10.039 0.000) 10.039 14.734 ( 0.000 7.226 0.000) 7.226 15.320 ( 0.000 -6.136 0.000) 6.136 15.790 ( 0.000 -11.081 0.000) 11.081 15.956 ( 0.000 18.038 0.000) 18.038 18.108 ( 0.000 -12.240 0.000) 12.240 18.739 ( 0.000 -5.843 0.000) 5.843 18.968 ( 0.000 -21.176 0.000) 21.176 27.730 ( 0.000 15.308 0.000) 15.308 28.787 ( 0.000 6.919 0.000) 6.919 28.798 ( 0.000 2.901 0.000) 2.901 28.885 ( 0.000 3.384 0.000) 3.384 29.915 ( 0.000 10.331 0.000) 10.331 30.834 ( 0.000 0.300 0.000) 0.300 32.147 ( 0.000 -5.583 0.000) 5.583 32.167 ( 0.000 -9.227 0.000) 9.227 85.874 ( 0.000 -1.097 0.000) 1.097 86.049 ( 0.000 -2.036 0.000) 2.036 86.295 ( 0.000 -4.585 0.000) 4.585 86.497 ( 0.000 -6.772 0.000) 6.772 ======================= Grid point 11 (8/162) ======================= q-point: ( 0.20 0.12 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 246 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.663 ( 19.619 36.736 0.000) 41.647 2.030 ( 24.964 36.723 0.000) 44.405 3.250 ( -20.048 22.730 0.000) 30.309 3.640 ( 24.799 72.371 0.000) 76.502 3.963 ( -32.250 25.309 0.000) 40.995 5.226 ( 23.256 29.471 0.000) 37.542 5.619 ( 14.570 1.239 0.000) 14.622 6.195 ( -42.894 29.008 0.000) 51.782 6.486 ( -4.731 47.020 0.000) 47.257 7.054 ( -12.496 0.839 0.000) 12.525 7.803 ( 23.152 -0.014 0.000) 23.152 7.950 ( 1.993 2.612 0.000) 3.285 8.587 ( 1.181 2.010 0.000) 2.331 8.644 ( -0.375 7.046 0.000) 7.056 8.969 ( -3.095 -6.448 0.000) 7.152 9.181 ( -26.331 11.721 0.000) 28.822 9.533 ( -0.746 14.493 0.000) 14.512 9.599 ( -0.130 16.139 0.000) 16.140 10.618 ( 4.190 -2.211 0.000) 4.737 10.659 ( 23.119 -12.007 0.000) 26.052 11.316 ( -0.914 -7.627 0.000) 7.682 11.606 ( -0.095 -15.534 0.000) 15.534 11.647 ( -2.190 -4.673 0.000) 5.161 11.650 ( 1.534 -0.952 0.000) 1.806 12.500 ( 2.537 15.833 0.000) 16.035 12.803 ( -5.081 17.822 0.000) 18.533 12.957 ( 6.846 -4.996 0.000) 8.475 13.625 ( -5.954 -4.513 0.000) 7.471 14.536 ( 3.514 -9.636 0.000) 10.257 14.750 ( 1.009 4.550 0.000) 4.660 15.343 ( 2.245 -6.733 0.000) 7.098 15.656 ( -8.204 -6.937 0.000) 10.744 16.171 ( 16.371 15.299 0.000) 22.407 17.668 ( -32.731 8.410 0.000) 33.794 18.897 ( 7.980 -15.808 0.000) 17.708 18.974 ( 0.601 -20.821 0.000) 20.829 27.756 ( 2.732 15.943 0.000) 16.176 28.396 ( -24.333 19.554 0.000) 31.217 28.817 ( 0.782 3.275 0.000) 3.367 28.878 ( -0.682 3.369 0.000) 3.437 30.316 ( 25.494 -4.545 0.000) 25.896 30.833 ( -0.257 -0.500 0.000) 0.562 32.144 ( -0.230 -5.842 0.000) 5.847 32.163 ( -0.401 -8.945 0.000) 8.954 85.901 ( 2.680 -1.178 0.000) 2.928 86.218 ( -6.204 -3.390 0.000) 7.070 86.239 ( 15.112 -10.925 0.000) 18.647 86.546 ( 3.237 -8.978 0.000) 9.543 ======================= Grid point 12 (9/162) ======================= q-point: ( 0.40 0.12 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 246 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.151 ( 28.556 27.949 0.000) 39.957 2.609 ( 26.856 28.400 0.000) 39.087 2.748 ( -22.941 22.811 0.000) 32.351 3.300 ( -34.701 25.313 0.000) 42.953 4.337 ( 43.289 58.038 0.000) 72.405 5.234 ( -44.338 39.162 0.000) 59.157 5.689 ( 13.547 33.818 0.000) 36.430 5.851 ( 2.865 16.449 0.000) 16.697 6.455 ( 6.347 26.297 0.000) 27.052 6.741 ( -18.229 4.821 0.000) 18.855 8.015 ( 4.299 -0.227 0.000) 4.305 8.060 ( 2.646 -4.315 0.000) 5.062 8.640 ( 4.841 2.898 0.000) 5.642 8.711 ( 7.719 7.742 0.000) 10.933 8.796 ( -11.975 6.841 0.000) 13.791 8.878 ( -7.651 1.207 0.000) 7.746 9.559 ( 2.016 15.561 0.000) 15.691 9.591 ( -0.975 16.088 0.000) 16.117 10.721 ( 6.008 -2.119 0.000) 6.370 10.825 ( -2.656 -5.077 0.000) 5.730 11.406 ( 8.505 -14.642 0.000) 16.933 11.553 ( -5.692 -14.568 0.000) 15.640 11.638 ( 1.346 -4.736 0.000) 4.923 11.662 ( -0.523 -2.734 0.000) 2.783 12.573 ( 4.888 16.284 0.000) 17.001 12.685 ( -6.339 16.996 0.000) 18.140 13.149 ( 12.451 -4.725 0.000) 13.317 13.418 ( -13.824 -4.407 0.000) 14.509 14.650 ( 6.649 -7.009 0.000) 9.661 14.743 ( -2.330 -1.285 0.000) 2.661 15.405 ( 4.218 -7.984 0.000) 9.030 15.511 ( -6.506 -8.274 0.000) 10.526 16.552 ( 22.464 19.412 0.000) 29.689 17.052 ( -28.714 19.890 0.000) 34.930 18.983 ( 1.564 -18.841 0.000) 18.906 18.988 ( 0.565 -19.946 0.000) 19.954 27.843 ( 6.473 17.930 0.000) 19.063 28.029 ( -13.284 20.865 0.000) 24.735 28.837 ( 1.176 3.289 0.000) 3.493 28.860 ( -1.133 3.331 0.000) 3.518 30.678 ( 11.462 -6.650 0.000) 13.251 30.807 ( -3.012 -3.031 0.000) 4.273 32.143 ( 0.272 -6.862 0.000) 6.867 32.153 ( -0.580 -8.108 0.000) 8.128 85.976 ( 4.970 -1.482 0.000) 5.186 86.090 ( -6.433 -2.162 0.000) 6.786 86.489 ( 8.802 -15.730 0.000) 18.025 86.578 ( -0.771 -12.879 0.000) 12.902 ======================= Grid point 15 (10/162) ======================= q-point: ( 0.00 0.19 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 144 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.313 ( 0.000 44.443 0.000) 44.443 2.602 ( 0.000 42.359 0.000) 42.359 3.909 ( 0.000 22.942 0.000) 22.942 4.892 ( 0.000 20.458 0.000) 20.458 4.911 ( 0.000 75.519 0.000) 75.519 5.290 ( 0.000 16.535 0.000) 16.535 5.469 ( 0.000 2.158 0.000) 2.158 7.176 ( 0.000 -3.975 0.000) 3.975 7.342 ( 0.000 35.845 0.000) 35.845 7.508 ( 0.000 5.191 0.000) 5.191 7.573 ( 0.000 51.804 0.000) 51.804 8.013 ( 0.000 4.980 0.000) 4.980 8.625 ( 0.000 1.184 0.000) 1.184 8.816 ( 0.000 -10.261 0.000) 10.261 8.913 ( 0.000 22.794 0.000) 22.794 9.698 ( 0.000 11.946 0.000) 11.946 9.934 ( 0.000 18.327 0.000) 18.327 9.944 ( 0.000 7.409 0.000) 7.409 10.039 ( 0.000 -2.515 0.000) 2.515 10.545 ( 0.000 0.431 0.000) 0.431 11.230 ( 0.000 -6.187 0.000) 6.187 11.311 ( 0.000 -14.288 0.000) 14.288 11.626 ( 0.000 -0.194 0.000) 0.194 11.630 ( 0.000 0.596 0.000) 0.596 12.774 ( 0.000 -5.885 0.000) 5.885 12.795 ( 0.000 16.297 0.000) 16.297 13.183 ( 0.000 14.137 0.000) 14.137 13.574 ( 0.000 -5.083 0.000) 5.083 14.305 ( 0.000 -10.637 0.000) 10.637 14.753 ( 0.000 -3.615 0.000) 3.615 15.184 ( 0.000 -7.595 0.000) 7.595 15.555 ( 0.000 -12.403 0.000) 12.403 16.362 ( 0.000 20.847 0.000) 20.847 17.826 ( 0.000 -16.341 0.000) 16.341 18.500 ( 0.000 -26.142 0.000) 26.142 18.588 ( 0.000 -9.788 0.000) 9.788 28.058 ( 0.000 17.730 0.000) 17.730 28.867 ( 0.000 4.208 0.000) 4.208 28.943 ( 0.000 8.752 0.000) 8.752 28.955 ( 0.000 3.651 0.000) 3.651 30.149 ( 0.000 13.344 0.000) 13.344 30.856 ( 0.000 2.151 0.000) 2.151 31.968 ( 0.000 -10.833 0.000) 10.833 32.020 ( 0.000 -7.278 0.000) 7.278 85.851 ( 0.000 -1.257 0.000) 1.257 86.003 ( 0.000 -2.528 0.000) 2.528 86.203 ( 0.000 -4.584 0.000) 4.584 86.364 ( 0.000 -6.573 0.000) 6.573 ======================= Grid point 16 (11/162) ======================= q-point: ( 0.20 0.19 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 240 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.442 ( 12.839 41.796 0.000) 43.723 2.763 ( 15.869 38.034 0.000) 41.212 3.702 ( -19.056 24.645 0.000) 31.154 4.403 ( -32.578 19.605 0.000) 38.022 5.078 ( 16.649 71.470 0.000) 73.384 5.643 ( 15.605 2.040 0.000) 15.738 5.709 ( 24.630 18.662 0.000) 30.902 6.825 ( -29.118 25.272 0.000) 38.556 7.132 ( -10.030 13.956 0.000) 17.186 7.444 ( -12.148 46.599 0.000) 48.157 7.819 ( 15.028 2.438 0.000) 15.225 8.022 ( 0.823 4.768 0.000) 4.838 8.609 ( -0.284 0.487 0.000) 0.564 8.833 ( 0.631 -6.764 0.000) 6.793 8.953 ( 2.953 23.762 0.000) 23.945 9.387 ( -22.327 10.723 0.000) 24.769 9.797 ( 1.339 12.121 0.000) 12.195 9.918 ( -1.220 16.568 0.000) 16.613 10.505 ( 21.864 -3.588 0.000) 22.156 10.606 ( 5.307 1.693 0.000) 5.570 11.182 ( -3.717 -6.340 0.000) 7.349 11.312 ( -0.161 -14.036 0.000) 14.037 11.616 ( -1.041 1.036 0.000) 1.469 11.642 ( 1.036 -0.008 0.000) 1.036 12.814 ( 1.902 15.368 0.000) 15.485 12.816 ( 4.009 -6.653 0.000) 7.768 13.154 ( -2.311 15.076 0.000) 15.252 13.529 ( -5.787 -4.808 0.000) 7.523 14.332 ( 4.087 -10.580 0.000) 11.341 14.734 ( -2.206 -4.600 0.000) 5.101 15.195 ( 1.114 -8.212 0.000) 8.287 15.463 ( -7.631 -11.398 0.000) 13.717 16.525 ( 14.861 17.794 0.000) 23.183 17.651 ( -15.827 -8.053 0.000) 17.758 18.520 ( 1.913 -25.080 0.000) 25.153 18.612 ( 1.349 -13.850 0.000) 13.916 28.094 ( 3.702 18.055 0.000) 18.431 28.719 ( -15.821 14.149 0.000) 21.225 28.894 ( 0.220 4.700 0.000) 4.706 28.949 ( -0.661 3.697 0.000) 3.756 30.350 ( 15.737 6.528 0.000) 17.038 30.844 ( -1.479 1.752 0.000) 2.293 31.970 ( 0.274 -10.457 0.000) 10.461 32.012 ( -0.773 -7.501 0.000) 7.541 85.875 ( 2.501 -1.339 0.000) 2.837 86.088 ( 7.627 -5.599 0.000) 9.462 86.148 ( -4.707 -3.552 0.000) 5.897 86.376 ( 0.401 -8.023 0.000) 8.033 ======================= Grid point 17 (12/162) ======================= q-point: ( 0.40 0.19 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 240 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.788 ( 21.681 35.884 0.000) 41.926 3.183 ( 23.226 30.113 0.000) 38.029 3.259 ( -21.564 28.961 0.000) 36.108 3.764 ( -31.745 22.727 0.000) 39.042 5.526 ( 27.593 60.296 0.000) 66.310 5.985 ( 16.938 2.744 0.000) 17.159 5.989 ( -5.820 28.022 0.000) 28.620 6.269 ( -20.601 28.711 0.000) 35.338 6.983 ( -0.879 21.130 0.000) 21.148 7.157 ( -15.128 36.871 0.000) 39.854 8.011 ( 4.742 -0.440 0.000) 4.762 8.040 ( 0.598 2.613 0.000) 2.681 8.653 ( 5.063 -0.262 0.000) 5.069 8.783 ( -6.342 -2.494 0.000) 6.815 9.005 ( 2.486 21.217 0.000) 21.362 9.086 ( -7.800 15.822 0.000) 17.641 9.846 ( 2.902 13.309 0.000) 13.622 9.892 ( -1.637 14.484 0.000) 14.576 10.716 ( 5.260 2.531 0.000) 5.838 10.763 ( 3.275 -0.038 0.000) 3.275 11.166 ( 3.965 -10.303 0.000) 11.040 11.274 ( -4.470 -12.932 0.000) 13.683 11.614 ( 1.263 1.215 0.000) 1.753 11.645 ( -1.017 0.613 0.000) 1.188 12.863 ( 2.805 11.514 0.000) 11.850 12.890 ( 1.541 -0.666 0.000) 1.679 13.154 ( 4.702 9.597 0.000) 10.687 13.341 ( -11.936 -1.796 0.000) 12.070 14.478 ( 9.627 -9.875 0.000) 13.791 14.649 ( -6.810 -7.222 0.000) 9.927 15.231 ( 2.798 -9.591 0.000) 9.991 15.318 ( -6.289 -10.843 0.000) 12.535 16.878 ( 20.096 12.326 0.000) 23.575 17.282 ( -20.579 3.984 0.000) 20.961 18.568 ( 2.716 -22.339 0.000) 22.504 18.612 ( -1.408 -18.670 0.000) 18.723 28.208 ( 8.096 18.777 0.000) 20.449 28.418 ( -13.461 18.630 0.000) 22.984 28.909 ( 1.073 4.070 0.000) 4.209 28.931 ( -1.082 3.836 0.000) 3.985 30.628 ( 11.357 1.341 0.000) 11.436 30.785 ( -5.002 0.918 0.000) 5.086 31.979 ( 0.611 -9.459 0.000) 9.479 31.994 ( -0.919 -8.280 0.000) 8.331 85.945 ( 4.491 -1.650 0.000) 4.785 86.045 ( -5.472 -2.346 0.000) 5.954 86.247 ( 7.423 -9.485 0.000) 12.045 86.353 ( -3.172 -9.848 0.000) 10.346 ======================= Grid point 20 (13/162) ======================= q-point: ( 0.00 0.25 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 162 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.166 ( 0.000 42.385 0.000) 42.385 3.409 ( 0.000 40.327 0.000) 40.327 4.366 ( 0.000 23.532 0.000) 23.532 5.226 ( 0.000 14.393 0.000) 14.393 5.521 ( 0.000 8.198 0.000) 8.198 5.544 ( 0.000 5.428 0.000) 5.428 6.265 ( 0.000 61.116 0.000) 61.116 7.080 ( 0.000 -5.959 0.000) 5.959 7.550 ( 0.000 -0.130 0.000) 0.130 8.069 ( 0.000 34.149 0.000) 34.149 8.107 ( 0.000 3.002 0.000) 3.002 8.406 ( 0.000 29.520 0.000) 29.520 8.620 ( 0.000 0.181 0.000) 0.181 8.636 ( 0.000 -5.627 0.000) 5.627 9.450 ( 0.000 27.622 0.000) 27.622 9.913 ( 0.000 8.887 0.000) 8.887 10.005 ( 0.000 -0.438 0.000) 0.438 10.209 ( 0.000 22.314 0.000) 22.314 10.358 ( 0.000 26.724 0.000) 26.724 10.598 ( 0.000 4.621 0.000) 4.621 11.051 ( 0.000 -12.004 0.000) 12.004 11.123 ( 0.000 -3.985 0.000) 3.985 11.620 ( 0.000 -0.376 0.000) 0.376 11.695 ( 0.000 6.162 0.000) 6.162 12.679 ( 0.000 -3.140 0.000) 3.140 13.078 ( 0.000 11.836 0.000) 11.836 13.400 ( 0.000 8.158 0.000) 8.158 13.477 ( 0.000 -4.657 0.000) 4.657 14.130 ( 0.000 -6.464 0.000) 6.464 14.647 ( 0.000 -6.387 0.000) 6.387 15.030 ( 0.000 -7.970 0.000) 7.970 15.327 ( 0.000 -10.545 0.000) 10.545 16.699 ( 0.000 12.700 0.000) 12.700 17.485 ( 0.000 -18.147 0.000) 18.147 17.966 ( 0.000 -28.166 0.000) 28.166 18.354 ( 0.000 -14.246 0.000) 14.246 28.402 ( 0.000 17.024 0.000) 17.024 28.960 ( 0.000 5.258 0.000) 5.258 29.023 ( 0.000 3.262 0.000) 3.262 29.117 ( 0.000 8.809 0.000) 8.809 30.423 ( 0.000 14.415 0.000) 14.415 30.918 ( 0.000 4.039 0.000) 4.039 31.757 ( 0.000 -10.474 0.000) 10.474 31.870 ( 0.000 -7.920 0.000) 7.920 85.827 ( 0.000 -1.115 0.000) 1.115 85.953 ( 0.000 -2.601 0.000) 2.601 86.122 ( 0.000 -3.534 0.000) 3.534 86.249 ( 0.000 -5.113 0.000) 5.113 ======================= Grid point 21 (14/162) ======================= q-point: ( 0.20 0.25 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 246 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.256 ( 9.082 40.898 0.000) 41.894 3.503 ( 9.497 37.543 0.000) 38.725 4.200 ( -15.042 25.951 0.000) 29.995 4.749 ( -29.316 16.521 0.000) 33.651 5.695 ( 13.696 4.105 0.000) 14.298 5.959 ( 24.140 7.834 0.000) 25.379 6.364 ( 9.636 57.113 0.000) 57.920 6.944 ( -10.882 -2.441 0.000) 11.152 7.558 ( -2.029 10.739 0.000) 10.929 8.022 ( -11.754 5.004 0.000) 12.775 8.060 ( 0.167 27.389 0.000) 27.390 8.229 ( -7.983 20.663 0.000) 22.152 8.586 ( -1.428 -2.413 0.000) 2.804 8.750 ( 4.487 -0.800 0.000) 4.557 9.495 ( 2.683 27.803 0.000) 27.932 9.648 ( -15.521 16.177 0.000) 22.419 9.987 ( 2.891 6.841 0.000) 7.427 10.262 ( -6.486 19.185 0.000) 20.252 10.562 ( 20.376 11.092 0.000) 23.200 10.709 ( 7.790 9.252 0.000) 12.094 11.066 ( 1.291 -10.532 0.000) 10.611 11.079 ( -4.090 -3.300 0.000) 5.256 11.649 ( 2.367 0.835 0.000) 2.510 11.689 ( -0.539 6.620 0.000) 6.642 12.700 ( 2.513 -4.477 0.000) 5.134 13.053 ( -2.747 7.947 0.000) 8.409 13.394 ( -0.520 9.385 0.000) 9.399 13.464 ( -1.970 -1.206 0.000) 2.310 14.151 ( 3.441 -7.184 0.000) 7.966 14.617 ( -3.399 -6.666 0.000) 7.483 15.030 ( 0.085 -8.484 0.000) 8.484 15.246 ( -7.148 -10.363 0.000) 12.589 16.792 ( 8.739 8.598 0.000) 12.259 17.413 ( -6.982 -15.151 0.000) 16.683 18.017 ( 4.883 -25.925 0.000) 26.380 18.334 ( -2.184 -15.132 0.000) 15.289 28.441 ( 3.984 17.042 0.000) 17.502 28.941 ( -4.408 7.891 0.000) 9.038 29.019 ( -0.459 3.428 0.000) 3.458 29.020 ( -5.855 8.962 0.000) 10.705 30.528 ( 9.076 10.976 0.000) 14.242 30.902 ( -1.767 4.066 0.000) 4.433 31.766 ( 0.948 -10.170 0.000) 10.215 31.858 ( -1.187 -8.089 0.000) 8.175 85.850 ( 2.343 -1.179 0.000) 2.623 85.999 ( 4.384 -3.788 0.000) 5.794 86.085 ( -3.492 -2.873 0.000) 4.522 86.241 ( -1.136 -5.824 0.000) 5.934 ======================= Grid point 22 (15/162) ======================= q-point: ( 0.40 0.25 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 246 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.506 ( 15.955 36.863 0.000) 40.167 3.776 ( 18.214 30.725 0.000) 35.718 3.855 ( -18.772 31.292 0.000) 36.490 4.206 ( -25.352 22.891 0.000) 34.157 6.004 ( 16.042 1.692 0.000) 16.131 6.220 ( -1.355 3.279 0.000) 3.548 6.601 ( 12.804 43.914 0.000) 45.742 6.777 ( -5.348 15.502 0.000) 16.399 7.489 ( 0.131 24.757 0.000) 24.758 7.690 ( -17.717 15.504 0.000) 23.542 8.098 ( 2.955 13.179 0.000) 13.506 8.151 ( -2.482 11.549 0.000) 11.813 8.617 ( 4.624 -3.860 0.000) 6.024 8.732 ( -5.422 -3.347 0.000) 6.372 9.484 ( -1.684 23.845 0.000) 23.905 9.504 ( -1.644 27.267 0.000) 27.316 10.064 ( 4.490 8.760 0.000) 9.844 10.153 ( -4.764 12.575 0.000) 13.447 10.843 ( 5.785 9.321 0.000) 10.971 10.877 ( 9.037 12.474 0.000) 15.404 10.996 ( -1.901 -6.552 0.000) 6.822 11.068 ( -2.517 -6.119 0.000) 6.617 11.683 ( 0.167 6.159 0.000) 6.162 11.684 ( 0.735 3.619 0.000) 3.693 12.794 ( 7.161 -5.785 0.000) 9.206 12.953 ( -7.621 -1.435 0.000) 7.755 13.386 ( -0.012 10.967 0.000) 10.967 13.408 ( -2.535 7.577 0.000) 7.990 14.293 ( 10.313 -8.451 0.000) 13.333 14.497 ( -9.020 -7.719 0.000) 11.872 15.042 ( 1.497 -9.517 0.000) 9.633 15.108 ( -5.599 -10.280 0.000) 11.706 17.003 ( 11.913 0.254 0.000) 11.915 17.232 ( -10.980 -8.212 0.000) 13.711 18.138 ( 6.836 -21.296 0.000) 22.366 18.261 ( -5.286 -17.427 0.000) 18.211 28.558 ( 8.023 16.798 0.000) 18.616 28.750 ( -11.173 15.241 0.000) 18.898 28.994 ( 0.444 4.662 0.000) 4.684 29.007 ( -0.702 3.895 0.000) 3.958 30.711 ( 8.476 6.535 0.000) 10.703 30.841 ( -4.718 4.528 0.000) 6.540 31.792 ( 1.650 -9.421 0.000) 9.564 31.827 ( -1.800 -8.616 0.000) 8.802 85.915 ( 4.062 -1.423 0.000) 4.304 86.002 ( -4.620 -1.972 0.000) 5.023 86.102 ( 5.485 -5.778 0.000) 7.967 86.194 ( -3.664 -6.500 0.000) 7.462 ======================= Grid point 25 (16/162) ======================= q-point: ( 0.00 0.31 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 144 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.951 ( 0.000 37.737 0.000) 37.737 4.175 ( 0.000 38.070 0.000) 38.070 4.815 ( 0.000 22.126 0.000) 22.126 5.480 ( 0.000 12.203 0.000) 12.203 5.642 ( 0.000 4.595 0.000) 4.595 5.672 ( 0.000 7.398 0.000) 7.398 6.934 ( 0.000 -9.229 0.000) 9.229 7.175 ( 0.000 27.934 0.000) 27.934 7.535 ( 0.000 -0.791 0.000) 0.791 8.048 ( 0.000 -7.051 0.000) 7.051 8.327 ( 0.000 -5.832 0.000) 5.832 8.693 ( 0.000 2.463 0.000) 2.463 8.753 ( 0.000 18.471 0.000) 18.471 8.921 ( 0.000 28.199 0.000) 28.199 9.858 ( 0.000 13.737 0.000) 13.737 10.010 ( 0.000 1.413 0.000) 1.413 10.046 ( 0.000 5.262 0.000) 5.262 10.690 ( 0.000 3.760 0.000) 3.760 10.721 ( 0.000 18.363 0.000) 18.363 10.783 ( 0.000 -3.898 0.000) 3.898 11.056 ( 0.000 30.612 0.000) 30.612 11.181 ( 0.000 17.646 0.000) 17.646 11.624 ( 0.000 1.436 0.000) 1.436 11.864 ( 0.000 10.358 0.000) 10.358 12.691 ( 0.000 6.001 0.000) 6.001 13.240 ( 0.000 5.007 0.000) 5.007 13.399 ( 0.000 -3.232 0.000) 3.232 13.523 ( 0.000 5.507 0.000) 5.507 14.071 ( 0.000 0.286 0.000) 0.286 14.523 ( 0.000 -6.114 0.000) 6.114 14.876 ( 0.000 -7.783 0.000) 7.783 15.152 ( 0.000 -7.479 0.000) 7.479 16.843 ( 0.000 2.073 0.000) 2.073 17.138 ( 0.000 -16.772 0.000) 16.772 17.414 ( 0.000 -28.047 0.000) 28.047 18.033 ( 0.000 -18.520 0.000) 18.520 28.708 ( 0.000 14.028 0.000) 14.028 29.070 ( 0.000 5.900 0.000) 5.900 29.081 ( 0.000 2.673 0.000) 2.673 29.274 ( 0.000 6.957 0.000) 6.957 30.700 ( 0.000 13.693 0.000) 13.693 31.007 ( 0.000 4.917 0.000) 4.917 31.568 ( 0.000 -8.693 0.000) 8.693 31.717 ( 0.000 -7.602 0.000) 7.602 85.808 ( 0.000 -0.750 0.000) 0.750 85.904 ( 0.000 -2.344 0.000) 2.344 86.067 ( 0.000 -2.115 0.000) 2.115 86.165 ( 0.000 -3.532 0.000) 3.532 ======================= Grid point 26 (17/162) ======================= q-point: ( 0.20 0.31 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 240 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 4.019 ( 6.835 36.914 0.000) 37.541 4.223 ( 5.020 36.076 0.000) 36.424 4.701 ( -10.371 25.093 0.000) 27.151 5.065 ( -23.076 16.056 0.000) 28.112 5.788 ( 10.557 5.071 0.000) 11.711 6.051 ( 21.037 2.396 0.000) 21.173 6.845 ( -6.162 -7.442 0.000) 9.662 7.178 ( -0.457 21.979 0.000) 21.983 7.614 ( 6.369 -0.307 0.000) 6.376 7.978 ( -6.595 -4.240 0.000) 7.840 8.358 ( 3.240 -5.802 0.000) 6.645 8.608 ( -5.273 15.648 0.000) 16.512 8.758 ( -2.556 4.289 0.000) 4.993 8.810 ( -9.380 29.121 0.000) 30.595 9.899 ( 2.651 12.677 0.000) 12.951 9.949 ( -5.947 12.480 0.000) 13.825 10.066 ( 5.484 2.915 0.000) 6.210 10.596 ( -8.070 11.484 0.000) 14.036 10.805 ( 1.770 -5.505 0.000) 5.783 10.819 ( 6.073 5.401 0.000) 8.127 11.145 ( 7.484 25.265 0.000) 26.351 11.207 ( 3.059 22.968 0.000) 23.171 11.694 ( 6.220 4.992 0.000) 7.976 11.874 ( 0.712 11.681 0.000) 11.703 12.678 ( -0.507 3.670 0.000) 3.705 13.123 ( -9.662 0.750 0.000) 9.691 13.471 ( 4.805 0.654 0.000) 4.849 13.535 ( 1.039 6.008 0.000) 6.097 14.074 ( 1.384 -0.644 0.000) 1.527 14.492 ( -3.510 -5.954 0.000) 6.911 14.867 ( -0.715 -8.197 0.000) 8.228 15.068 ( -7.534 -7.886 0.000) 10.907 16.844 ( 1.066 -3.304 0.000) 3.472 17.102 ( -3.552 -15.762 0.000) 16.157 17.529 ( 10.077 -23.524 0.000) 25.592 18.009 ( -2.670 -18.353 0.000) 18.546 28.745 ( 3.764 13.851 0.000) 14.353 29.066 ( -0.554 5.875 0.000) 5.901 29.081 ( -0.003 2.969 0.000) 2.969 29.200 ( -6.695 8.349 0.000) 10.702 30.755 ( 4.950 11.773 0.000) 12.771 30.994 ( -1.385 5.190 0.000) 5.372 31.582 ( 1.373 -8.554 0.000) 8.664 31.702 ( -1.437 -7.673 0.000) 7.807 85.831 ( 2.235 -0.785 0.000) 2.369 85.935 ( 3.043 -2.805 0.000) 4.138 86.039 ( -2.736 -1.787 0.000) 3.267 86.147 ( -1.824 -3.820 0.000) 4.233 ======================= Grid point 27 (18/162) ======================= q-point: ( 0.40 0.31 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 240 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 4.206 ( 11.776 34.412 0.000) 36.371 4.379 ( 11.067 30.767 0.000) 32.697 4.459 ( -13.405 30.251 0.000) 33.088 4.661 ( -17.750 23.590 0.000) 29.522 6.034 ( 13.366 1.349 0.000) 13.434 6.240 ( -4.198 -0.409 0.000) 4.218 6.873 ( 11.122 -3.321 0.000) 11.607 7.104 ( -8.485 6.532 0.000) 10.708 7.731 ( 5.194 3.412 0.000) 6.215 7.837 ( -6.473 3.651 0.000) 7.432 8.451 ( 5.789 -3.407 0.000) 6.717 8.532 ( -2.478 17.411 0.000) 17.587 8.641 ( -5.883 26.569 0.000) 27.213 8.653 ( -6.301 2.814 0.000) 6.900 9.896 ( 0.297 14.350 0.000) 14.353 9.918 ( -0.797 12.322 0.000) 12.348 10.214 ( 9.270 9.007 0.000) 12.925 10.411 ( -10.281 13.809 0.000) 17.216 10.847 ( 2.251 -4.835 0.000) 5.333 10.876 ( -0.082 -4.097 0.000) 4.098 11.278 ( 4.412 22.627 0.000) 23.053 11.284 ( 3.254 25.023 0.000) 25.233 11.815 ( 4.993 11.222 0.000) 12.283 11.874 ( -1.148 13.526 0.000) 13.575 12.720 ( 5.813 -0.681 0.000) 5.853 12.903 ( -11.738 -1.925 0.000) 11.895 13.541 ( 1.963 4.762 0.000) 5.151 13.552 ( 0.446 6.472 0.000) 6.487 14.170 ( 8.667 -3.849 0.000) 9.483 14.366 ( -9.398 -5.501 0.000) 10.890 14.863 ( 0.766 -8.902 0.000) 8.934 14.922 ( -5.769 -8.898 0.000) 10.604 16.903 ( 4.720 -9.481 0.000) 10.590 17.009 ( -5.544 -13.247 0.000) 14.360 17.743 ( 10.664 -19.271 0.000) 22.025 17.918 ( -6.815 -18.173 0.000) 19.409 28.852 ( 7.034 13.087 0.000) 14.858 29.004 ( -7.344 10.476 0.000) 12.794 29.082 ( 0.131 3.797 0.000) 3.799 29.093 ( -1.770 5.674 0.000) 5.943 30.862 ( 5.359 8.484 0.000) 10.035 30.949 ( -3.364 6.230 0.000) 7.080 31.618 ( 2.259 -8.227 0.000) 8.531 31.665 ( -2.299 -7.891 0.000) 8.219 85.891 ( 3.761 -0.929 0.000) 3.874 85.970 ( -4.027 -1.265 0.000) 4.221 86.012 ( 4.369 -3.663 0.000) 5.701 86.093 ( -3.663 -4.068 0.000) 5.474 ======================= Grid point 30 (19/162) ======================= q-point: ( 0.00 0.38 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 162 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 4.629 ( 0.000 31.471 0.000) 31.471 4.894 ( 0.000 35.427 0.000) 35.427 5.220 ( 0.000 19.175 0.000) 19.175 5.706 ( 0.000 1.792 0.000) 1.792 5.713 ( 0.000 11.675 0.000) 11.675 5.813 ( 0.000 6.520 0.000) 6.520 6.716 ( 0.000 -12.978 0.000) 12.978 7.264 ( 0.000 -14.697 0.000) 14.697 7.536 ( 0.000 1.232 0.000) 1.232 8.021 ( 0.000 4.472 0.000) 4.472 8.140 ( 0.000 -11.224 0.000) 11.224 8.613 ( 0.000 -8.589 0.000) 8.589 9.206 ( 0.000 23.086 0.000) 23.086 9.428 ( 0.000 22.147 0.000) 22.147 9.991 ( 0.000 -2.772 0.000) 2.772 10.023 ( 0.000 4.086 0.000) 4.086 10.223 ( 0.000 12.342 0.000) 12.342 10.666 ( 0.000 -4.506 0.000) 4.506 10.723 ( 0.000 -0.369 0.000) 0.369 10.807 ( 0.000 -2.091 0.000) 2.091 11.629 ( 0.000 21.475 0.000) 21.475 11.706 ( 0.000 7.740 0.000) 7.740 11.757 ( 0.000 30.327 0.000) 30.327 12.042 ( 0.000 6.301 0.000) 6.301 12.997 ( 0.000 26.652 0.000) 26.652 13.307 ( 0.000 2.839 0.000) 2.839 13.354 ( 0.000 -1.307 0.000) 1.307 13.664 ( 0.000 9.836 0.000) 9.836 14.117 ( 0.000 3.837 0.000) 3.837 14.409 ( 0.000 -5.647 0.000) 5.647 14.725 ( 0.000 -7.744 0.000) 7.744 15.017 ( 0.000 -7.180 0.000) 7.180 16.791 ( 0.000 -6.782 0.000) 6.782 16.860 ( 0.000 -10.830 0.000) 10.830 16.893 ( 0.000 -24.494 0.000) 24.494 17.640 ( 0.000 -21.318 0.000) 21.318 28.941 ( 0.000 9.666 0.000) 9.666 29.127 ( 0.000 1.935 0.000) 1.935 29.187 ( 0.000 5.942 0.000) 5.942 29.379 ( 0.000 3.644 0.000) 3.644 30.949 ( 0.000 11.710 0.000) 11.710 31.102 ( 0.000 4.602 0.000) 4.602 31.422 ( 0.000 -6.248 0.000) 6.248 31.576 ( 0.000 -6.834 0.000) 6.834 85.798 ( 0.000 -0.261 0.000) 0.261 85.862 ( 0.000 -1.894 0.000) 1.894 86.039 ( 0.000 -0.792 0.000) 0.792 86.108 ( 0.000 -2.345 0.000) 2.345 ======================= Grid point 31 (20/162) ======================= q-point: ( 0.20 0.38 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 246 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 4.687 ( 5.769 31.258 0.000) 31.786 4.904 ( 1.375 33.305 0.000) 33.333 5.172 ( -5.056 23.122 0.000) 23.668 5.372 ( -15.413 14.981 0.000) 21.493 5.877 ( 6.400 3.569 0.000) 7.328 6.070 ( 16.548 -0.215 0.000) 16.550 6.655 ( -4.272 -11.876 0.000) 12.621 7.192 ( -7.288 -15.226 0.000) 16.881 7.608 ( 6.549 0.384 0.000) 6.561 7.987 ( -3.404 4.022 0.000) 5.269 8.169 ( 3.073 -11.311 0.000) 11.721 8.561 ( -5.240 -9.577 0.000) 10.917 9.156 ( -3.807 23.345 0.000) 23.653 9.340 ( -7.563 23.157 0.000) 24.361 10.000 ( -0.290 -2.986 0.000) 3.000 10.030 ( -0.023 2.062 0.000) 2.062 10.274 ( 6.424 14.385 0.000) 15.754 10.695 ( 0.796 -1.785 0.000) 1.955 10.723 ( 1.090 0.398 0.000) 1.160 10.815 ( 0.497 -2.615 0.000) 2.661 11.664 ( 3.643 21.753 0.000) 22.056 11.680 ( 1.726 17.718 0.000) 17.802 11.944 ( 12.251 21.409 0.000) 24.667 12.080 ( 3.489 7.430 0.000) 8.208 12.925 ( -6.130 23.259 0.000) 24.053 13.143 ( -11.010 2.249 0.000) 11.237 13.468 ( 6.498 -0.746 0.000) 6.540 13.678 ( 1.008 9.718 0.000) 9.770 14.105 ( -0.614 3.120 0.000) 3.180 14.383 ( -3.012 -5.428 0.000) 6.208 14.709 ( -1.438 -8.163 0.000) 8.289 14.919 ( -8.996 -8.348 0.000) 12.273 16.683 ( -3.135 -11.607 0.000) 12.023 16.836 ( -2.414 -10.446 0.000) 10.721 17.116 ( 14.140 -18.827 0.000) 23.546 17.621 ( -2.128 -20.997 0.000) 21.105 28.973 ( 3.265 9.388 0.000) 9.940 29.133 ( 0.668 2.314 0.000) 2.408 29.179 ( -0.799 5.632 0.000) 5.689 29.328 ( -4.848 4.617 0.000) 6.695 30.975 ( 2.341 10.541 0.000) 10.798 31.095 ( -0.702 4.966 0.000) 5.015 31.437 ( 1.461 -6.289 0.000) 6.456 31.561 ( -1.450 -6.765 0.000) 6.918 85.821 ( 2.190 -0.266 0.000) 2.206 85.888 ( 2.524 -2.063 0.000) 3.260 86.015 ( -2.376 -0.666 0.000) 2.468 86.087 ( -2.097 -2.448 0.000) 3.223 ======================= Grid point 32 (21/162) ======================= q-point: ( 0.40 0.38 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 246 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 4.840 ( 9.332 30.369 0.000) 31.770 4.964 ( 4.940 28.523 0.000) 28.948 5.029 ( -8.897 28.280 0.000) 29.646 5.117 ( -10.434 22.658 0.000) 24.945 6.046 ( 10.058 -0.450 0.000) 10.068 6.213 ( -4.051 -2.438 0.000) 4.728 6.707 ( 11.829 -12.713 0.000) 17.365 6.984 ( -13.594 -14.943 0.000) 20.201 7.755 ( 7.722 0.404 0.000) 7.733 7.893 ( -6.101 2.245 0.000) 6.501 8.265 ( 6.703 -11.405 0.000) 13.229 8.420 ( -8.434 -11.040 0.000) 13.893 9.116 ( 0.692 24.776 0.000) 24.785 9.191 ( -6.510 24.748 0.000) 25.590 9.991 ( 0.195 -1.485 0.000) 1.498 10.012 ( -1.504 -0.456 0.000) 1.572 10.452 ( 10.227 12.299 0.000) 15.996 10.626 ( -6.738 6.983 0.000) 9.704 10.782 ( 2.847 -1.818 0.000) 3.378 10.815 ( -0.653 -2.460 0.000) 2.545 11.743 ( 3.101 21.360 0.000) 21.584 11.746 ( 3.165 22.516 0.000) 22.737 12.134 ( 5.567 18.248 0.000) 19.078 12.152 ( 2.742 11.736 0.000) 12.052 12.832 ( -1.244 14.085 0.000) 14.140 12.923 ( -9.814 5.096 0.000) 11.058 13.600 ( 6.414 2.061 0.000) 6.737 13.680 ( -1.500 7.852 0.000) 7.994 14.132 ( 4.409 -0.618 0.000) 4.452 14.273 ( -8.114 -4.565 0.000) 9.310 14.689 ( 0.113 -9.101 0.000) 9.102 14.746 ( -6.458 -9.756 0.000) 11.700 16.691 ( 3.096 -10.342 0.000) 10.796 16.769 ( -4.141 -9.920 0.000) 10.749 17.371 ( 11.279 -19.148 0.000) 22.223 17.543 ( -6.218 -20.140 0.000) 21.078 29.063 ( 5.564 8.364 0.000) 10.046 29.153 ( -2.331 5.472 0.000) 5.948 29.153 ( 1.441 3.408 0.000) 3.700 29.215 ( -5.688 5.844 0.000) 8.155 31.027 ( 2.709 8.170 0.000) 8.607 31.072 ( -1.741 6.138 0.000) 6.380 31.475 ( 2.360 -6.413 0.000) 6.833 31.523 ( -2.353 -6.595 0.000) 7.002 85.879 ( 3.608 -0.309 0.000) 3.621 85.953 ( -3.714 -0.447 0.000) 3.741 85.953 ( 3.889 -2.386 0.000) 4.563 86.030 ( -3.635 -2.543 0.000) 4.437 ======================= Grid point 35 (22/162) ======================= q-point: ( 0.00 0.44 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 144 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 5.170 ( 0.000 23.721 0.000) 23.721 5.537 ( 0.000 28.304 0.000) 28.304 5.550 ( 0.000 14.158 0.000) 14.158 5.696 ( 0.000 -3.474 0.000) 3.474 5.921 ( 0.000 6.025 0.000) 6.025 5.936 ( 0.000 11.296 0.000) 11.296 6.440 ( 0.000 -14.757 0.000) 14.757 6.832 ( 0.000 -26.615 0.000) 26.615 7.593 ( 0.000 4.848 0.000) 4.848 7.920 ( 0.000 -10.929 0.000) 10.929 8.125 ( 0.000 5.430 0.000) 5.430 8.418 ( 0.000 -10.156 0.000) 10.156 9.567 ( 0.000 14.029 0.000) 14.029 9.775 ( 0.000 13.575 0.000) 13.575 9.913 ( 0.000 -5.254 0.000) 5.254 10.044 ( 0.000 -1.519 0.000) 1.519 10.466 ( 0.000 10.906 0.000) 10.906 10.622 ( 0.000 -0.319 0.000) 0.319 10.689 ( 0.000 -2.589 0.000) 2.589 10.738 ( 0.000 -4.557 0.000) 4.557 11.893 ( 0.000 8.116 0.000) 8.116 11.932 ( 0.000 14.330 0.000) 14.330 12.084 ( 0.000 -1.536 0.000) 1.536 12.170 ( 0.000 10.428 0.000) 10.428 13.348 ( 0.000 0.673 0.000) 0.673 13.362 ( 0.000 2.205 0.000) 2.205 13.661 ( 0.000 37.674 0.000) 37.674 13.899 ( 0.000 13.087 0.000) 13.087 14.220 ( 0.000 7.079 0.000) 7.079 14.293 ( 0.000 -6.631 0.000) 6.631 14.568 ( 0.000 -8.554 0.000) 8.554 14.813 ( 0.000 -15.721 0.000) 15.721 16.515 ( 0.000 -12.344 0.000) 12.344 16.611 ( 0.000 -10.514 0.000) 10.514 16.751 ( 0.000 0.421 0.000) 0.421 17.224 ( 0.000 -20.395 0.000) 20.395 29.084 ( 0.000 5.138 0.000) 5.138 29.154 ( 0.000 0.699 0.000) 0.699 29.296 ( 0.000 5.130 0.000) 5.130 29.414 ( 0.000 -0.103 0.000) 0.103 31.154 ( 0.000 9.278 0.000) 9.278 31.183 ( 0.000 3.736 0.000) 3.736 31.322 ( 0.000 -4.171 0.000) 4.171 31.447 ( 0.000 -6.497 0.000) 6.497 85.799 ( 0.000 0.274 0.000) 0.274 85.831 ( 0.000 -1.365 0.000) 1.365 86.034 ( 0.000 0.226 0.000) 0.226 86.071 ( 0.000 -1.563 0.000) 1.563 ======================= Grid point 36 (23/162) ======================= q-point: ( 0.20 0.44 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 240 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 5.231 ( 5.925 24.060 0.000) 24.778 5.469 ( -2.228 21.911 0.000) 22.024 5.616 ( -5.642 8.232 0.000) 9.980 5.635 ( 2.345 25.592 0.000) 25.699 5.909 ( 0.438 0.039 0.000) 0.439 6.058 ( 9.180 0.014 0.000) 9.180 6.394 ( -3.851 -14.190 0.000) 14.703 6.772 ( -5.993 -25.632 0.000) 26.324 7.646 ( 5.128 3.801 0.000) 6.383 7.949 ( 3.040 -10.822 0.000) 11.241 8.071 ( -5.195 4.510 0.000) 6.880 8.355 ( -6.177 -10.440 0.000) 12.130 9.532 ( -2.339 15.242 0.000) 15.420 9.705 ( -6.012 14.463 0.000) 15.663 9.914 ( -0.104 -5.748 0.000) 5.749 10.016 ( -2.691 -2.991 0.000) 4.024 10.516 ( 4.819 9.601 0.000) 10.743 10.669 ( 3.676 -0.149 0.000) 3.679 10.716 ( 2.068 -1.484 0.000) 2.546 10.748 ( 0.947 -4.046 0.000) 4.156 11.946 ( 5.404 8.900 0.000) 10.412 12.003 ( 6.684 16.645 0.000) 17.937 12.138 ( 5.298 -0.907 0.000) 5.375 12.276 ( 8.395 8.698 0.000) 12.089 13.225 ( -7.534 5.938 0.000) 9.593 13.442 ( 4.995 -2.459 0.000) 5.568 13.524 ( -12.211 34.144 0.000) 36.262 13.919 ( 0.711 14.228 0.000) 14.246 14.195 ( -2.201 6.600 0.000) 6.957 14.266 ( -2.991 -6.994 0.000) 7.606 14.543 ( -2.216 -8.903 0.000) 9.175 14.691 ( -10.639 -16.449 0.000) 19.590 16.492 ( 1.518 -5.335 0.000) 5.547 16.733 ( -1.923 0.691 0.000) 2.043 16.779 ( 11.811 -15.778 0.000) 19.709 17.211 ( -1.633 -20.253 0.000) 20.319 29.111 ( 2.656 4.831 0.000) 5.513 29.168 ( 1.414 1.070 0.000) 1.773 29.282 ( -1.474 4.725 0.000) 4.949 29.379 ( -3.406 0.573 0.000) 3.454 31.161 ( 0.634 8.532 0.000) 8.556 31.184 ( 0.045 4.101 0.000) 4.101 31.334 ( 1.222 -4.367 0.000) 4.535 31.436 ( -1.152 -6.248 0.000) 6.353 85.821 ( 2.200 0.292 0.000) 2.219 85.854 ( 2.333 -1.430 0.000) 2.736 86.011 ( -2.252 0.260 0.000) 2.267 86.048 ( -2.193 -1.595 0.000) 2.712 ======================= Grid point 37 (24/162) ======================= q-point: ( 0.40 0.44 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 240 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 5.384 ( 8.945 24.920 0.000) 26.477 5.457 ( 0.736 21.501 0.000) 21.514 5.520 ( -3.557 17.698 0.000) 18.052 5.575 ( -7.347 27.232 0.000) 28.206 5.999 ( 7.782 -4.619 0.000) 9.050 6.141 ( -4.155 -4.798 0.000) 6.348 6.405 ( 8.127 -17.484 0.000) 19.281 6.608 ( -10.338 -22.498 0.000) 24.760 7.778 ( 7.892 2.518 0.000) 8.284 7.938 ( -7.967 2.911 0.000) 8.483 8.044 ( 6.675 -10.660 0.000) 12.577 8.200 ( -8.767 -10.649 0.000) 13.794 9.517 ( 1.302 16.429 0.000) 16.481 9.585 ( -5.365 15.923 0.000) 16.802 9.917 ( 0.908 -5.579 0.000) 5.652 9.956 ( -2.903 -4.730 0.000) 5.550 10.626 ( 5.522 5.780 0.000) 7.994 10.700 ( -1.405 1.799 0.000) 2.282 10.756 ( 1.716 -1.272 0.000) 2.136 10.766 ( 0.543 -2.726 0.000) 2.780 12.083 ( 6.893 11.683 0.000) 13.564 12.128 ( 3.439 16.875 0.000) 17.222 12.272 ( 7.507 1.321 0.000) 7.622 12.373 ( -0.680 5.096 0.000) 5.142 13.124 ( -0.283 14.710 0.000) 14.712 13.259 ( -12.611 26.824 0.000) 29.641 13.612 ( 12.888 -2.843 0.000) 13.198 13.863 ( -8.703 8.370 0.000) 12.075 14.153 ( -1.477 3.988 0.000) 4.253 14.173 ( -4.525 -4.849 0.000) 6.633 14.501 ( -1.463 -10.135 0.000) 10.240 14.519 ( -4.500 -13.559 0.000) 14.287 16.570 ( 5.445 -0.620 0.000) 5.480 16.671 ( -4.364 0.849 0.000) 4.445 16.999 ( 9.825 -18.486 0.000) 20.935 17.147 ( -5.240 -19.723 0.000) 20.408 29.180 ( 3.959 3.902 0.000) 5.559 29.209 ( 2.976 2.058 0.000) 3.618 29.242 ( -2.484 3.776 0.000) 4.520 29.293 ( -4.945 1.985 0.000) 5.328 31.175 ( 0.625 6.850 0.000) 6.878 31.183 ( -0.212 5.188 0.000) 5.192 31.366 ( 1.943 -4.906 0.000) 5.277 31.405 ( -1.900 -5.624 0.000) 5.936 85.879 ( 3.580 0.322 0.000) 3.594 85.915 ( 3.708 -1.557 0.000) 4.022 85.952 ( -3.610 0.313 0.000) 3.624 85.990 ( -3.624 -1.623 0.000) 3.971 ======================= Grid point 40 (25/162) ======================= q-point: ( 0.00 -0.50 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 90 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 5.537 ( 0.000 -13.421 0.000) 13.421 5.537 ( 0.000 13.421 0.000) 13.421 5.746 ( 0.000 -4.547 0.000) 4.547 5.746 ( 0.000 4.547 0.000) 4.547 6.166 ( 0.000 -12.787 0.000) 12.787 6.166 ( 0.000 12.787 0.000) 12.787 6.282 ( 0.000 -28.298 0.000) 28.298 6.282 ( 0.000 28.298 0.000) 28.298 7.726 ( 0.000 -8.617 0.000) 8.617 7.726 ( 0.000 8.617 0.000) 8.617 8.245 ( 0.000 -7.348 0.000) 7.348 8.245 ( 0.000 7.348 0.000) 7.348 9.781 ( 0.000 -8.485 0.000) 8.485 9.781 ( 0.000 8.485 0.000) 8.485 9.968 ( 0.000 -6.515 0.000) 6.515 9.968 ( 0.000 6.515 0.000) 6.515 10.632 ( 0.000 -6.534 0.000) 6.534 10.632 ( 0.000 6.534 0.000) 6.534 10.641 ( 0.000 -1.999 0.000) 1.999 10.641 ( 0.000 1.999 0.000) 1.999 12.014 ( 0.000 -4.972 0.000) 4.972 12.014 ( 0.000 4.972 0.000) 4.972 12.177 ( 0.000 -8.170 0.000) 8.170 12.177 ( 0.000 8.170 0.000) 8.170 13.371 ( 0.000 -1.049 0.000) 1.049 13.371 ( 0.000 1.049 0.000) 1.049 14.129 ( 0.000 -9.578 0.000) 9.578 14.129 ( 0.000 9.578 0.000) 9.578 14.356 ( 0.000 -30.466 0.000) 30.466 14.356 ( 0.000 30.466 0.000) 30.466 14.389 ( 0.000 -9.546 0.000) 9.546 14.389 ( 0.000 9.546 0.000) 9.546 16.445 ( 0.000 -4.371 0.000) 4.371 16.445 ( 0.000 4.371 0.000) 4.371 16.886 ( 0.000 -13.065 0.000) 13.065 16.886 ( 0.000 13.065 0.000) 13.065 29.147 ( 0.000 -1.554 0.000) 1.554 29.147 ( 0.000 1.554 0.000) 1.554 29.380 ( 0.000 -3.200 0.000) 3.200 29.380 ( 0.000 3.200 0.000) 3.200 31.251 ( 0.000 -3.328 0.000) 3.328 31.251 ( 0.000 3.328 0.000) 3.328 31.315 ( 0.000 -7.313 0.000) 7.313 31.315 ( 0.000 7.313 0.000) 7.313 85.809 ( 0.000 -0.818 0.000) 0.818 85.809 ( 0.000 0.818 0.000) 0.818 86.046 ( 0.000 -0.949 0.000) 0.949 86.046 ( 0.000 0.949 0.000) 0.949 ======================= Grid point 42 (26/162) ======================= q-point: ( 0.20 -0.50 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 138 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 5.593 ( 5.339 -11.426 0.000) 12.612 5.593 ( 5.339 11.426 0.000) 12.612 5.766 ( 1.779 -9.432 0.000) 9.598 5.766 ( 1.779 9.432 0.000) 9.598 6.146 ( -1.945 -9.745 0.000) 9.937 6.146 ( -1.945 9.745 0.000) 9.937 6.235 ( -4.474 -28.502 0.000) 28.851 6.235 ( -4.474 28.502 0.000) 28.851 7.762 ( 3.663 -7.977 0.000) 8.778 7.762 ( 3.663 7.977 0.000) 8.778 8.181 ( -6.185 -7.133 0.000) 9.441 8.181 ( -6.185 7.133 0.000) 9.441 9.769 ( -0.811 -9.400 0.000) 9.435 9.769 ( -0.811 9.400 0.000) 9.435 9.916 ( -4.495 -7.549 0.000) 8.785 9.916 ( -4.495 7.549 0.000) 8.785 10.657 ( 2.347 -5.503 0.000) 5.982 10.657 ( 2.347 5.503 0.000) 5.982 10.683 ( 3.320 -1.432 0.000) 3.615 10.683 ( 3.320 1.432 0.000) 3.615 12.075 ( 6.093 -4.976 0.000) 7.867 12.075 ( 6.093 4.976 0.000) 7.867 12.269 ( 7.528 -8.482 0.000) 11.341 12.269 ( 7.528 8.482 0.000) 11.341 13.353 ( -0.637 -6.359 0.000) 6.391 13.353 ( -0.637 6.359 0.000) 6.391 14.065 ( -9.473 -15.820 0.000) 18.439 14.065 ( -9.473 15.820 0.000) 18.439 14.269 ( -4.687 -23.655 0.000) 24.115 14.269 ( -4.687 23.655 0.000) 24.115 14.360 ( -2.658 -9.589 0.000) 9.950 14.360 ( -2.658 9.589 0.000) 9.950 16.527 ( 7.405 -8.611 0.000) 11.357 16.527 ( 7.405 8.611 0.000) 11.357 16.873 ( -1.586 -13.197 0.000) 13.292 16.873 ( -1.586 13.197 0.000) 13.292 29.168 ( 2.062 -1.241 0.000) 2.406 29.168 ( 2.062 1.241 0.000) 2.406 29.356 ( -2.327 -2.696 0.000) 3.562 29.356 ( -2.327 2.696 0.000) 3.562 31.258 ( 0.721 -3.635 0.000) 3.706 31.258 ( 0.721 3.635 0.000) 3.706 31.310 ( -0.481 -6.848 0.000) 6.865 31.310 ( -0.481 6.848 0.000) 6.865 85.832 ( 2.248 -0.853 0.000) 2.405 85.832 ( 2.248 0.853 0.000) 2.405 86.024 ( -2.221 -0.961 0.000) 2.420 86.024 ( -2.221 0.961 0.000) 2.420 ======================= Grid point 44 (27/162) ======================= q-point: ( 0.40 -0.50 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 138 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 5.719 ( 6.368 -2.990 0.000) 7.035 5.719 ( 6.368 2.990 0.000) 7.035 5.790 ( -0.393 -11.721 0.000) 11.728 5.790 ( -0.393 11.721 0.000) 11.728 6.107 ( -1.201 -7.419 0.000) 7.516 6.107 ( -1.201 7.419 0.000) 7.516 6.136 ( -4.350 -24.646 0.000) 25.027 6.136 ( -4.350 24.646 0.000) 25.027 7.869 ( 7.105 -6.910 0.000) 9.911 7.869 ( 7.105 6.910 0.000) 9.911 8.028 ( -8.653 -6.692 0.000) 10.939 8.028 ( -8.653 6.692 0.000) 10.939 9.770 ( 1.335 -9.860 0.000) 9.949 9.770 ( 1.335 9.860 0.000) 9.949 9.825 ( -4.133 -9.050 0.000) 9.949 9.825 ( -4.133 9.050 0.000) 9.949 10.708 ( 2.360 -3.275 0.000) 4.037 10.708 ( 2.360 3.275 0.000) 4.037 10.728 ( 0.669 -1.435 0.000) 1.583 10.728 ( 0.669 1.435 0.000) 1.583 12.235 ( 9.123 -4.716 0.000) 10.270 12.235 ( 9.123 4.716 0.000) 10.270 12.356 ( -1.116 -6.292 0.000) 6.390 12.356 ( -1.116 6.292 0.000) 6.390 13.432 ( 10.711 -14.633 0.000) 18.134 13.432 ( 10.711 14.633 0.000) 18.134 13.750 ( -19.241 -19.986 0.000) 27.743 13.750 ( -19.241 19.986 0.000) 27.743 14.253 ( 1.544 -12.102 0.000) 12.200 14.253 ( 1.544 12.102 0.000) 12.200 14.301 ( -3.055 -9.942 0.000) 10.401 14.301 ( -3.055 9.942 0.000) 10.401 16.688 ( 7.936 -12.106 0.000) 14.476 16.688 ( 7.936 12.106 0.000) 14.476 16.813 ( -4.686 -13.205 0.000) 14.012 16.813 ( -4.686 13.205 0.000) 14.012 29.224 ( 3.461 -0.676 0.000) 3.526 29.224 ( 3.461 0.676 0.000) 3.526 29.296 ( -3.624 -1.510 0.000) 3.926 29.296 ( -3.624 1.510 0.000) 3.926 31.276 ( 1.055 -4.504 0.000) 4.626 31.276 ( 1.055 4.504 0.000) 4.626 31.296 ( -0.908 -5.724 0.000) 5.796 31.296 ( -0.908 5.724 0.000) 5.796 85.891 ( 3.624 -0.923 0.000) 3.740 85.891 ( 3.624 0.923 0.000) 3.740 85.965 ( -3.608 -0.965 0.000) 3.734 85.965 ( -3.608 0.965 0.000) 3.734 ======================= Grid point 85 (28/162) ======================= q-point: ( 0.00 0.00 0.09) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 162 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.748 ( 0.000 0.000 38.286) 38.286 0.841 ( 0.000 0.000 42.734) 42.734 1.404 ( 0.000 0.000 71.464) 71.464 3.281 ( 0.000 0.000 16.482) 16.482 3.749 ( 0.000 0.000 5.207) 5.207 4.060 ( 0.000 0.000 -1.331) 1.331 5.268 ( 0.000 0.000 -2.053) 2.053 5.393 ( 0.000 0.000 -13.446) 13.446 6.694 ( 0.000 0.000 21.522) 21.522 7.046 ( 0.000 0.000 -12.064) 12.064 7.262 ( 0.000 0.000 -3.554) 3.554 7.962 ( 0.000 0.000 6.185) 6.185 8.376 ( 0.000 0.000 -0.168) 0.168 8.492 ( 0.000 0.000 -0.740) 0.740 9.116 ( 0.000 0.000 0.104) 0.104 9.152 ( 0.000 0.000 -0.116) 0.116 9.215 ( 0.000 0.000 6.670) 6.670 9.719 ( 0.000 0.000 -4.076) 4.076 9.864 ( 0.000 0.000 2.463) 2.463 10.664 ( 0.000 0.000 0.880) 0.880 11.428 ( 0.000 0.000 -7.191) 7.191 11.603 ( 0.000 0.000 -1.640) 1.640 11.949 ( 0.000 0.000 -6.858) 6.858 12.074 ( 0.000 0.000 0.060) 0.060 12.105 ( 0.000 0.000 -0.131) 0.131 12.189 ( 0.000 0.000 -0.123) 0.123 12.190 ( 0.000 0.000 -0.091) 0.091 13.474 ( 0.000 0.000 -17.981) 17.981 14.026 ( 0.000 0.000 14.744) 14.744 14.742 ( 0.000 0.000 0.121) 0.121 14.966 ( 0.000 0.000 -22.260) 22.260 16.104 ( 0.000 0.000 7.157) 7.157 16.154 ( 0.000 0.000 36.275) 36.275 18.330 ( 0.000 0.000 -2.812) 2.812 19.353 ( 0.000 0.000 -6.885) 6.885 19.754 ( 0.000 0.000 -3.055) 3.055 27.424 ( 0.000 0.000 3.241) 3.241 27.498 ( 0.000 0.000 3.358) 3.358 28.720 ( 0.000 0.000 -2.146) 2.146 28.788 ( 0.000 0.000 -2.181) 2.181 29.725 ( 0.000 0.000 2.550) 2.550 30.816 ( 0.000 0.000 -2.665) 2.665 32.253 ( 0.000 0.000 -1.017) 1.017 32.318 ( 0.000 0.000 -4.858) 4.858 85.954 ( 0.000 0.000 -6.921) 6.921 85.957 ( 0.000 0.000 5.822) 5.822 86.717 ( 0.000 0.000 24.797) 24.797 90.830 ( 0.000 0.000 -5.611) 5.611 ======================= Grid point 86 (29/162) ======================= q-point: ( 0.20 0.00 0.09) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 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| 1.153 ( 33.700 0.000 23.936) 41.335 1.261 ( 30.706 0.000 29.981) 42.915 2.015 ( 54.052 0.000 46.757) 71.468 3.072 ( -18.583 0.000 15.928) 24.475 3.289 ( -31.709 0.000 4.946) 32.093 4.417 ( 21.208 0.000 -0.406) 21.212 5.214 ( -5.446 0.000 -1.942) 5.782 5.394 ( -14.341 0.000 -13.319) 19.572 6.138 ( -21.179 0.000 17.009) 27.163 6.996 ( -11.578 0.000 -5.047) 12.631 7.701 ( 25.802 0.000 -6.715) 26.662 8.059 ( 11.724 0.000 6.575) 13.442 8.386 ( 1.020 0.000 -0.215) 1.042 8.480 ( -1.192 0.000 -0.676) 1.370 9.027 ( -14.373 0.000 19.169) 23.959 9.121 ( 0.436 0.000 0.073) 0.442 9.149 ( -0.256 0.000 -0.102) 0.276 9.150 ( -6.558 0.000 5.403) 8.496 10.649 ( 6.577 0.000 -6.425) 9.194 10.953 ( 10.018 0.000 -22.925) 25.018 11.440 ( 4.328 0.000 -16.861) 17.407 11.731 ( -2.091 0.000 -18.722) 18.839 12.079 ( 0.416 0.000 0.043) 0.418 12.104 ( -0.130 0.000 -0.112) 0.172 12.188 ( -0.144 0.000 -0.121) 0.188 12.189 ( -0.132 0.000 -0.095) 0.163 12.245 ( 36.828 0.000 -22.316) 43.062 13.476 ( -3.964 0.000 -20.588) 20.966 14.154 ( 12.608 0.000 8.077) 14.973 14.698 ( -3.872 0.000 -4.178) 5.697 15.075 ( 9.894 0.000 -17.292) 19.923 15.824 ( -15.377 0.000 9.696) 18.178 16.414 ( 14.561 0.000 34.488) 37.436 17.739 ( -40.390 0.000 51.332) 65.317 19.335 ( -1.042 0.000 -8.217) 8.282 19.488 ( -9.555 0.000 -0.822) 9.590 27.431 ( 0.670 0.000 3.251) 3.320 27.491 ( -0.728 0.000 3.345) 3.424 28.727 ( 0.673 0.000 -2.148) 2.251 28.782 ( -0.615 0.000 -2.176) 2.262 30.406 ( 33.475 0.000 -33.879) 47.627 30.824 ( 0.720 0.000 -4.053) 4.116 32.249 ( 0.139 0.000 -1.648) 1.654 32.314 ( -0.631 0.000 -4.542) 4.585 85.877 ( -0.968 0.000 -0.214) 0.992 86.025 ( 0.056 0.000 -7.115) 7.115 86.907 ( 17.176 0.000 25.363) 30.632 89.128 ( -91.970 0.000 82.953) 123.854 ======================= Grid point 87 (30/162) ======================= q-point: ( 0.40 0.00 0.09) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 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| 1.878 ( 38.428 0.000 13.135) 40.610 1.895 ( 32.954 0.000 21.687) 39.450 2.500 ( -25.932 0.000 17.828) 31.469 2.617 ( -36.477 0.000 7.813) 37.304 3.317 ( 61.930 0.000 23.210) 66.137 4.544 ( -59.378 0.000 10.040) 60.221 4.787 ( 16.369 0.000 -1.052) 16.403 5.054 ( -10.919 0.000 -1.607) 11.037 6.262 ( 20.124 0.000 0.724) 20.137 6.676 ( -20.076 0.000 -3.435) 20.367 8.075 ( 14.854 0.000 -5.956) 16.004 8.255 ( 0.535 0.000 -1.924) 1.997 8.414 ( 1.720 0.000 -0.345) 1.754 8.450 ( -1.824 0.000 -0.519) 1.897 8.897 ( 1.785 0.000 15.858) 15.959 9.019 ( -7.180 0.000 8.229) 10.921 9.131 ( 0.597 0.000 0.004) 0.597 9.142 ( -0.488 0.000 -0.061) 0.492 10.763 ( 6.217 0.000 -3.516) 7.142 10.901 ( -7.351 0.000 -7.547) 10.535 11.530 ( 4.399 0.000 -18.243) 18.765 11.626 ( -5.715 0.000 -17.595) 18.500 12.089 ( 0.569 0.000 -0.002) 0.569 12.099 ( -0.388 0.000 -0.062) 0.393 12.185 ( -0.059 0.000 -0.117) 0.131 12.186 ( -0.116 0.000 -0.107) 0.158 12.865 ( 24.883 0.000 -25.475) 35.612 13.266 ( -16.386 0.000 -19.202) 25.243 14.414 ( 11.858 0.000 -2.498) 12.119 14.596 ( -6.900 0.000 -5.816) 9.024 15.301 ( 12.236 0.000 -10.183) 15.919 15.545 ( -13.047 0.000 -0.832) 13.073 16.724 ( 17.496 0.000 46.068) 49.278 17.120 ( -24.060 0.000 57.195) 62.050 19.337 ( 1.335 0.000 -10.040) 10.128 19.383 ( -3.277 0.000 -8.001) 8.646 27.449 ( 1.111 0.000 3.279) 3.462 27.472 ( -1.147 0.000 3.314) 3.507 28.744 ( 1.057 0.000 -2.155) 2.400 28.765 ( -1.021 0.000 -2.166) 2.395 30.766 ( 7.780 0.000 -19.812) 21.285 30.831 ( -0.533 0.000 -8.960) 8.975 32.264 ( 1.291 0.000 -3.133) 3.389 32.293 ( -1.409 0.000 -3.994) 4.235 85.905 ( 3.203 0.000 -4.282) 5.347 85.979 ( -3.803 0.000 -6.822) 7.810 87.319 ( 24.594 0.000 34.698) 42.530 87.921 ( -40.089 0.000 57.979) 70.489 ======================= Grid point 90 (31/162) ======================= q-point: ( 0.00 0.06 0.09) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 264 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.208 ( 0.000 31.783 28.387) 42.614 1.247 ( 0.000 25.140 39.127) 46.508 2.073 ( 0.000 66.987 38.420) 77.223 3.370 ( 0.000 9.170 14.839) 17.444 3.985 ( 0.000 21.788 5.794) 22.545 4.306 ( 0.000 22.888 -1.416) 22.932 5.349 ( 0.000 3.591 -7.853) 8.636 5.650 ( 0.000 29.907 -6.207) 30.544 6.736 ( 0.000 4.920 19.510) 20.121 7.078 ( 0.000 4.968 -10.859) 11.941 7.248 ( 0.000 -1.427 -3.511) 3.790 7.963 ( 0.000 0.356 5.250) 5.262 8.518 ( 0.000 2.530 -0.211) 2.539 8.674 ( 0.000 4.803 -3.748) 6.092 9.118 ( 0.000 1.124 -1.730) 2.063 9.237 ( 0.000 8.243 -0.318) 8.249 9.247 ( 0.000 8.267 2.411) 8.611 9.871 ( 0.000 0.779 2.899) 3.002 9.971 ( 0.000 11.593 -10.822) 15.859 10.635 ( 0.000 -2.797 0.448) 2.833 11.395 ( 0.000 -3.011 -5.897) 6.621 11.539 ( 0.000 -2.935 -5.739) 6.446 11.782 ( 0.000 -9.843 -3.737) 10.529 11.930 ( 0.000 -12.675 1.390) 12.751 12.210 ( 0.000 10.037 -0.403) 10.045 12.443 ( 0.000 18.426 -3.267) 18.713 12.683 ( 0.000 23.098 -18.701) 29.719 13.561 ( 0.000 5.822 -14.603) 15.721 14.196 ( 0.000 15.120 -2.159) 15.273 14.686 ( 0.000 -5.700 0.413) 5.715 15.015 ( 0.000 2.612 -26.063) 26.194 16.028 ( 0.000 -7.529 6.144) 9.718 16.203 ( 0.000 5.106 35.150) 35.519 18.267 ( 0.000 -6.425 -2.696) 6.968 19.234 ( 0.000 -11.829 -6.458) 13.477 19.246 ( 0.000 -28.972 18.599) 34.428 27.515 ( 0.000 9.007 3.106) 9.527 28.123 ( 0.000 33.645 -26.959) 43.114 28.738 ( 0.000 1.794 -1.806) 2.545 28.815 ( 0.000 2.726 -1.926) 3.338 29.778 ( 0.000 5.372 2.252) 5.825 30.811 ( 0.000 -0.382 -2.624) 2.652 32.222 ( 0.000 -3.080 -1.054) 3.255 32.267 ( 0.000 -5.041 -4.488) 6.749 85.917 ( 0.000 -3.369 5.281) 6.264 85.947 ( 0.000 -0.662 -6.649) 6.682 86.674 ( 0.000 -4.184 23.794) 24.159 88.660 ( 0.000 -110.198 104.388) 151.791 ======================= Grid point 91 (32/162) ======================= q-point: ( 0.20 0.06 0.09) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 440 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.449 ( 22.921 18.135 28.514) 40.832 1.576 ( 27.674 29.850 22.785) 46.648 2.524 ( 40.828 51.424 31.906) 73.002 3.147 ( -19.104 8.776 14.946) 25.795 3.533 ( -30.991 22.351 5.823) 38.651 4.663 ( 21.540 23.169 -0.723) 31.643 5.393 ( -1.853 10.164 -7.664) 12.864 5.578 ( -13.514 25.157 -6.918) 29.383 6.175 ( -23.027 6.263 17.077) 29.345 6.995 ( -11.829 0.450 -4.531) 12.675 7.698 ( 24.486 0.045 -6.561) 25.350 8.036 ( 8.177 -1.641 5.925) 10.230 8.515 ( -0.163 3.460 0.155) 3.467 8.622 ( -4.668 9.153 -3.112) 10.736 8.963 ( -14.714 4.848 7.286) 17.120 9.117 ( -5.099 -2.360 6.157) 8.336 9.251 ( 0.665 10.279 -0.683) 10.323 9.364 ( -7.024 14.908 6.141) 17.586 10.623 ( 8.494 -2.451 -6.618) 11.043 10.821 ( 16.357 -10.481 -13.131) 23.449 11.384 ( 2.449 -4.902 -10.358) 11.718 11.577 ( 0.741 -7.581 -10.191) 12.723 11.787 ( 2.662 -12.379 -0.095) 12.662 11.938 ( 0.410 -12.600 1.321) 12.676 12.223 ( 1.391 10.363 -0.620) 10.474 12.398 ( -3.736 17.193 -3.365) 17.913 12.794 ( 10.565 18.549 -17.578) 27.653 13.548 ( -4.182 4.597 -14.284) 15.577 14.300 ( 9.826 12.588 -5.016) 16.739 14.679 ( -0.923 -3.004 -2.805) 4.213 15.079 ( 6.609 -0.252 -21.582) 22.573 15.790 ( -15.221 -3.963 5.876) 16.790 16.437 ( 15.675 2.945 34.653) 38.147 17.804 ( -34.332 4.322 32.861) 47.720 19.194 ( -0.383 -14.477 -5.830) 15.611 19.277 ( -0.324 -15.892 -1.078) 15.932 27.528 ( 1.328 9.568 3.077) 10.138 27.845 ( -14.895 26.932 -4.811) 31.151 28.747 ( 0.768 2.007 -1.946) 2.899 28.806 ( -0.732 2.414 -1.869) 3.140 30.301 ( 30.705 -6.996 -19.196) 36.881 30.814 ( 0.104 -0.912 -3.821) 3.929 32.218 ( -0.098 -3.173 -1.550) 3.533 32.263 ( -0.531 -4.978 -4.118) 6.482 85.867 ( -0.542 -0.925 -0.250) 1.101 86.003 ( 0.572 -2.040 -7.073) 7.383 86.831 ( 14.455 -7.275 25.095) 29.860 88.204 ( -33.958 -62.955 85.844) 111.739 ======================= Grid point 92 (33/162) ======================= q-point: ( 0.40 0.06 0.09) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 440 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.991 ( 30.248 10.748 20.285) 37.973 2.195 ( 33.261 25.904 13.256) 44.193 2.593 ( -27.364 10.445 16.891) 33.811 2.886 ( -34.199 23.998 9.080) 42.754 3.600 ( 56.941 30.144 19.733) 67.382 4.721 ( -53.754 18.646 8.430) 57.518 5.052 ( 16.016 25.350 -1.498) 30.023 5.325 ( -11.064 25.523 -2.061) 27.894 6.268 ( 19.464 2.047 1.710) 19.646 6.675 ( -19.916 0.547 -2.908) 20.134 8.021 ( 11.554 -3.252 -3.830) 12.599 8.167 ( -0.714 -6.301 -1.162) 6.447 8.526 ( 1.170 6.059 0.022) 6.171 8.550 ( -1.926 9.937 -1.670) 10.259 8.851 ( 3.295 -2.024 12.810) 13.381 8.990 ( -7.920 -2.133 7.576) 11.165 9.274 ( 1.545 12.168 0.117) 12.266 9.304 ( -1.527 13.856 1.781) 14.053 10.744 ( 6.043 -1.812 -3.000) 6.985 10.867 ( -5.519 -3.301 -6.597) 9.214 11.473 ( 4.224 -5.569 -16.164) 17.611 11.541 ( -3.093 -6.462 -14.613) 16.275 11.878 ( 4.412 -16.980 1.297) 17.591 11.932 ( -1.316 -14.192 1.313) 14.313 12.263 ( 2.604 11.464 -1.347) 11.833 12.324 ( -3.559 14.010 -2.459) 14.663 13.058 ( 15.460 10.183 -14.273) 23.376 13.359 ( -13.971 5.722 -12.195) 19.407 14.503 ( 9.167 7.332 -8.629) 14.569 14.633 ( -4.180 2.366 -7.829) 9.185 15.261 ( 11.377 -3.889 -12.531) 17.366 15.506 ( -13.522 -4.137 -3.357) 14.533 16.778 ( 19.365 5.461 42.000) 46.570 17.210 ( -25.532 8.035 46.107) 53.313 19.210 ( 1.634 -12.450 -9.399) 15.685 19.249 ( -2.089 -12.633 -7.189) 14.685 27.569 ( 2.939 11.604 2.886) 12.313 27.652 ( -6.096 16.540 1.853) 17.724 28.766 ( 1.118 2.139 -1.934) 3.092 28.788 ( -1.084 2.253 -1.919) 3.152 30.691 ( 10.634 -6.245 -15.149) 19.534 30.800 ( -2.113 -2.749 -7.807) 8.542 32.225 ( 0.861 -3.842 -2.669) 4.757 32.246 ( -1.108 -4.561 -3.538) 5.878 85.898 ( 3.081 -0.728 -4.232) 5.285 85.967 ( -3.410 -1.206 -6.724) 7.636 87.175 ( 19.825 -13.415 33.283) 40.997 87.612 ( -25.610 -26.448 53.658) 65.073 ======================= Grid point 95 (34/162) ======================= q-point: ( 0.00 0.12 0.09) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 267 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.786 ( 0.000 31.896 30.022) 43.803 1.918 ( 0.000 39.030 15.712) 42.074 3.530 ( 0.000 68.645 20.433) 71.622 3.640 ( 0.000 26.061 10.424) 28.068 4.490 ( 0.000 27.011 6.659) 27.820 4.799 ( 0.000 22.786 -4.830) 23.293 5.462 ( 0.000 9.448 0.891) 9.490 6.428 ( 0.000 45.142 -8.282) 45.895 6.948 ( 0.000 19.446 13.971) 23.944 7.213 ( 0.000 -1.458 -2.782) 3.141 7.240 ( 0.000 10.983 -10.013) 14.862 7.977 ( 0.000 1.139 2.749) 2.976 8.581 ( 0.000 3.503 0.639) 3.560 8.695 ( 0.000 2.846 3.456) 4.477 9.057 ( 0.000 -5.366 5.683) 7.816 9.445 ( 0.000 12.164 -0.979) 12.204 9.523 ( 0.000 15.986 -5.220) 16.817 9.900 ( 0.000 2.399 3.857) 4.542 10.090 ( 0.000 2.599 -1.283) 2.898 10.570 ( 0.000 -3.242 -0.535) 3.286 11.325 ( 0.000 -3.970 -2.708) 4.805 11.461 ( 0.000 -6.825 -9.956) 12.071 11.632 ( 0.000 -5.254 -3.441) 6.281 11.693 ( 0.000 -9.003 3.363) 9.611 12.468 ( 0.000 15.703 -0.668) 15.717 12.818 ( 0.000 19.097 -3.671) 19.447 12.880 ( 0.000 1.223 -1.978) 2.326 13.616 ( 0.000 -0.266 -5.340) 5.346 14.483 ( 0.000 11.477 -16.049) 19.730 14.530 ( 0.000 -9.855 1.060) 9.912 15.015 ( 0.000 -2.438 -23.607) 23.733 15.826 ( 0.000 -12.680 3.494) 13.153 16.362 ( 0.000 11.218 30.528) 32.524 18.085 ( 0.000 -12.046 -2.382) 12.279 18.840 ( 0.000 -15.051 7.523) 16.827 18.912 ( 0.000 -20.511 -5.373) 21.203 27.756 ( 0.000 15.090 2.750) 15.339 28.571 ( 0.000 15.663 -16.287) 22.596 28.789 ( 0.000 3.379 -0.971) 3.516 28.890 ( 0.000 4.729 -0.898) 4.813 29.929 ( 0.000 9.947 1.549) 10.066 30.808 ( 0.000 0.349 -2.539) 2.563 32.131 ( 0.000 -8.649 -3.556) 9.352 32.136 ( 0.000 -5.584 -1.115) 5.694 85.852 ( 0.000 -2.849 2.448) 3.756 85.929 ( 0.000 -1.130 -5.906) 6.013 86.564 ( 0.000 -6.738 21.078) 22.129 87.331 ( 0.000 -39.506 65.206) 76.240 ======================= Grid point 96 (35/162) ======================= q-point: ( 0.20 0.12 0.09) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 441 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.926 ( 14.967 30.020 23.029) 40.688 2.184 ( 23.533 33.012 16.412) 43.737 3.381 ( -21.047 18.305 12.108) 30.408 3.808 ( 24.538 70.384 17.245) 76.508 4.031 ( -30.901 25.621 6.905) 40.731 5.165 ( 21.676 22.718 -5.017) 31.798 5.614 ( 11.636 14.645 -0.433) 18.710 6.211 ( -28.671 32.404 -0.350) 43.269 6.528 ( -13.941 33.088 4.490) 36.184 7.038 ( -11.548 5.596 -0.823) 12.859 7.712 ( 21.325 1.520 -6.657) 22.392 8.011 ( 3.390 -0.493 3.102) 4.621 8.590 ( 1.051 2.610 0.411) 2.843 8.694 ( 0.624 5.568 4.591) 7.243 9.025 ( -4.061 -3.892 5.002) 7.527 9.190 ( -20.586 10.893 2.317) 23.406 9.510 ( 1.399 14.816 -1.779) 14.988 9.650 ( -4.541 14.253 4.407) 15.594 10.563 ( 15.857 -3.556 -5.813) 17.260 10.644 ( 10.434 -6.429 -1.758) 12.381 11.287 ( -1.966 -4.838 -3.016) 6.031 11.460 ( -0.899 -6.868 -11.080) 13.066 11.604 ( -0.771 -7.005 -2.431) 7.454 11.714 ( 0.553 -7.837 2.758) 8.327 12.487 ( 1.963 15.811 -1.103) 15.971 12.756 ( -5.229 17.679 -4.381) 18.949 12.956 ( 7.139 1.875 -0.970) 7.444 13.585 ( -4.747 -0.914 -4.617) 6.685 14.497 ( 3.289 0.967 -8.031) 8.732 14.593 ( 4.199 -1.120 -6.284) 7.640 15.044 ( 3.295 -3.313 -22.376) 22.858 15.655 ( -13.556 -9.755 0.637) 16.713 16.554 ( 16.141 9.119 30.234) 35.465 17.830 ( -21.801 -2.651 12.183) 25.114 18.858 ( 1.490 -17.941 -4.437) 18.541 18.938 ( 1.221 -19.224 -2.778) 19.462 27.782 ( 2.619 15.697 2.654) 16.134 28.322 ( -17.850 20.858 -6.326) 28.172 28.802 ( 0.955 3.559 -1.358) 3.927 28.871 ( -1.115 4.134 -0.917) 4.378 30.235 ( 22.091 0.892 -6.211) 22.965 30.799 ( -1.095 -0.208 -3.312) 3.495 32.126 ( -0.373 -7.206 -2.694) 7.703 32.133 ( -0.293 -6.938 -1.943) 7.210 85.844 ( 0.460 -1.336 -0.769) 1.609 85.958 ( 0.855 -2.270 -6.693) 7.119 86.654 ( 8.713 -10.029 23.392) 26.902 87.261 ( -6.722 -34.061 56.830) 66.596 ======================= Grid point 97 (36/162) ======================= q-point: ( 0.40 0.12 0.09) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 441 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.333 ( 25.076 24.052 16.040) 38.270 2.712 ( 20.919 26.587 10.880) 35.537 2.908 ( -17.193 20.774 15.094) 30.903 3.396 ( -32.985 25.574 10.379) 43.009 4.468 ( 40.309 55.414 13.133) 69.771 5.268 ( -33.796 35.142 3.455) 48.878 5.650 ( 10.241 31.744 -3.427) 33.530 5.850 ( -4.104 21.059 -0.721) 21.467 6.473 ( 7.541 23.363 2.054) 24.635 6.748 ( -16.796 9.732 1.092) 19.443 7.980 ( 7.839 -1.116 -3.566) 8.684 8.064 ( -0.281 -3.635 -0.389) 3.666 8.635 ( 3.846 3.474 -0.351) 5.195 8.719 ( -1.414 7.344 0.438) 7.492 8.878 ( -2.641 4.532 8.324) 9.839 8.965 ( -6.686 1.748 8.886) 11.257 9.555 ( 2.695 15.367 -0.503) 15.610 9.600 ( -1.883 15.599 1.136) 15.753 10.705 ( 5.484 -1.663 -1.877) 6.030 10.788 ( -1.052 -4.129 -4.351) 6.089 11.324 ( 5.122 -8.846 -7.945) 12.946 11.415 ( -3.566 -7.445 -11.599) 14.237 11.630 ( 3.046 -8.080 -0.398) 8.645 11.694 ( -2.618 -7.852 1.955) 8.505 12.546 ( 4.027 16.288 -2.249) 16.929 12.643 ( -5.711 17.109 -3.647) 18.402 13.150 ( 12.263 0.304 -0.967) 12.305 13.406 ( -12.605 -0.862 -2.315) 12.845 14.594 ( 4.968 -1.230 -7.415) 9.010 14.644 ( 0.253 -0.284 -8.008) 8.017 15.160 ( 8.889 -6.100 -16.605) 19.798 15.383 ( -13.279 -8.293 -7.537) 17.376 16.925 ( 21.091 8.746 30.211) 37.868 17.367 ( -23.801 6.346 25.823) 35.687 18.895 ( 2.153 -18.691 -8.010) 20.449 18.934 ( -1.458 -18.648 -5.890) 19.610 27.864 ( 5.991 17.576 2.151) 18.693 28.029 ( -11.411 20.409 0.240) 23.384 28.824 ( 1.244 3.674 -1.302) 4.092 28.849 ( -1.245 3.811 -1.196) 4.184 30.588 ( 12.773 -3.135 -8.061) 15.426 30.750 ( -4.621 -1.778 -5.526) 7.420 32.121 ( 0.016 -6.862 -2.352) 7.254 32.126 ( -0.394 -7.240 -2.318) 7.612 85.879 ( 2.813 -1.072 -4.091) 5.080 85.937 ( -2.594 -1.675 -6.336) 7.048 86.866 ( 11.832 -16.532 29.214) 35.591 87.089 ( -10.463 -24.435 41.129) 48.971 ======================= Grid point 100 (37/162) ======================= q-point: ( 0.00 0.19 0.09) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 264 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.476 ( 0.000 37.736 16.404) 41.147 2.694 ( 0.000 39.905 9.258) 40.965 3.986 ( 0.000 20.542 7.376) 21.826 4.956 ( 0.000 22.265 6.283) 23.134 5.049 ( 0.000 71.501 13.634) 72.789 5.104 ( 0.000 10.074 -11.090) 14.982 5.690 ( 0.000 11.107 14.552) 18.307 7.093 ( 0.000 3.149 -8.662) 9.216 7.278 ( 0.000 31.685 -3.758) 31.907 7.448 ( 0.000 8.427 -5.719) 10.184 7.656 ( 0.000 45.166 5.766) 45.533 8.016 ( 0.000 3.060 -0.360) 3.081 8.636 ( 0.000 1.672 1.355) 2.152 8.806 ( 0.000 0.946 1.389) 1.681 9.016 ( 0.000 9.842 7.717) 12.507 9.680 ( 0.000 11.592 -1.810) 11.732 9.826 ( 0.000 14.204 -5.944) 15.397 9.979 ( 0.000 6.370 3.497) 7.267 10.133 ( 0.000 3.819 4.779) 6.117 10.536 ( 0.000 0.378 -1.104) 1.167 11.238 ( 0.000 -4.993 0.743) 5.048 11.261 ( 0.000 -12.078 -5.653) 13.336 11.583 ( 0.000 0.396 -4.497) 4.515 11.602 ( 0.000 -1.919 -1.002) 2.165 12.792 ( 0.000 16.648 -0.371) 16.652 12.836 ( 0.000 -4.304 5.266) 6.801 13.161 ( 0.000 15.496 -2.071) 15.634 13.573 ( 0.000 -3.578 -0.302) 3.590 14.322 ( 0.000 -10.774 1.486) 10.876 14.598 ( 0.000 0.625 -13.777) 13.791 14.945 ( 0.000 -4.152 -20.124) 20.548 15.558 ( 0.000 -14.096 0.146) 14.097 16.613 ( 0.000 13.204 20.881) 24.706 17.806 ( 0.000 -16.152 -1.987) 16.274 18.459 ( 0.000 -25.362 -3.964) 25.670 18.580 ( 0.000 -12.846 -0.916) 12.878 28.080 ( 0.000 17.431 2.228) 17.573 28.814 ( 0.000 9.970 -8.621) 13.181 28.868 ( 0.000 4.675 0.007) 4.675 28.998 ( 0.000 6.420 0.794) 6.469 30.156 ( 0.000 13.021 0.805) 13.046 30.832 ( 0.000 2.191 -2.464) 3.297 31.943 ( 0.000 -10.238 -2.419) 10.520 32.010 ( 0.000 -7.205 -1.063) 7.283 85.811 ( 0.000 -1.475 -0.239) 1.494 85.905 ( 0.000 -1.296 -4.871) 5.041 86.425 ( 0.000 -7.283 17.336) 18.804 86.789 ( 0.000 -19.822 36.077) 41.164 ======================= Grid point 101 (38/162) ======================= q-point: ( 0.20 0.19 0.09) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 440 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.585 ( 11.026 36.377 13.740) 40.418 2.859 ( 16.045 35.672 10.096) 40.396 3.775 ( -19.051 22.124 6.934) 30.009 4.470 ( -30.871 19.284 6.914) 37.050 5.201 ( 15.644 69.167 12.086) 71.936 5.447 ( 19.114 8.779 -9.256) 22.980 5.930 ( 17.789 14.281 11.476) 25.536 6.833 ( -26.634 23.346 1.118) 35.435 7.030 ( -7.989 20.330 -8.564) 23.462 7.510 ( -10.579 39.909 4.673) 41.551 7.770 ( 14.061 5.867 -4.285) 15.827 8.032 ( 1.122 3.081 0.219) 3.287 8.613 ( -0.642 0.167 0.563) 0.870 8.834 ( 1.222 0.411 1.552) 2.018 9.036 ( 1.284 13.865 6.587) 15.404 9.400 ( -19.560 11.327 1.912) 22.683 9.784 ( 1.690 12.485 -1.440) 12.681 9.931 ( -2.108 14.962 1.541) 15.188 10.494 ( 19.829 -2.127 -1.394) 19.992 10.598 ( 5.371 1.557 -0.948) 5.671 11.189 ( -3.945 -5.231 0.653) 6.585 11.263 ( -0.186 -11.841 -5.601) 13.100 11.546 ( -1.222 0.543 -5.139) 5.310 11.637 ( 1.081 -1.172 -0.816) 1.791 12.801 ( 1.299 13.917 -0.469) 13.986 12.874 ( 3.052 -2.147 4.020) 5.485 13.138 ( -1.515 15.410 -1.351) 15.544 13.533 ( -5.103 -3.648 0.130) 6.274 14.345 ( 3.703 -10.306 1.069) 11.004 14.618 ( 1.041 -1.378 -10.985) 11.120 14.963 ( 1.972 -4.668 -19.767) 20.406 15.431 ( -11.154 -12.451 -2.583) 16.915 16.759 ( 13.311 10.409 19.897) 26.104 17.694 ( -10.923 -10.964 3.599) 15.889 18.460 ( 0.884 -23.506 -5.558) 24.171 18.588 ( 0.006 -15.660 -2.509) 15.860 28.114 ( 3.552 17.747 2.095) 18.220 28.668 ( -12.679 14.994 -4.603) 20.168 28.883 ( 0.965 4.689 -0.592) 4.823 28.963 ( -1.954 5.169 0.757) 5.578 30.327 ( 13.914 7.864 -1.953) 16.101 30.815 ( -1.857 1.978 -2.828) 3.919 31.947 ( 0.415 -9.896 -2.276) 10.162 32.000 ( -0.875 -7.395 -1.148) 7.535 85.820 ( 1.223 -0.995 -1.620) 2.261 85.919 ( 0.601 -1.754 -5.680) 5.975 86.463 ( 3.950 -9.248 19.505) 21.945 86.764 ( -2.609 -19.080 33.509) 38.648 ======================= Grid point 102 (39/162) ======================= q-point: ( 0.40 0.19 0.09) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 440 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.893 ( 19.761 32.071 9.544) 38.861 3.253 ( 11.357 28.873 6.772) 31.757 3.367 ( -8.884 25.766 11.277) 29.495 3.857 ( -30.800 22.133 9.972) 39.217 5.611 ( 24.043 57.435 8.312) 62.817 5.795 ( 13.050 11.957 -8.434) 19.606 6.141 ( 0.388 11.153 1.488) 11.258 6.291 ( -25.113 38.312 5.088) 46.091 6.979 ( 6.281 24.828 1.049) 25.632 7.233 ( -15.981 34.583 6.229) 38.603 7.973 ( 6.406 0.860 -3.520) 7.359 8.039 ( -0.915 1.322 -0.798) 1.795 8.654 ( 5.035 -0.653 0.080) 5.078 8.784 ( -6.575 -1.280 0.416) 6.711 9.061 ( 2.050 17.132 5.328) 18.058 9.139 ( -6.957 14.835 5.946) 17.431 9.839 ( 3.206 13.087 -0.890) 13.503 9.892 ( -2.126 14.007 0.096) 14.168 10.705 ( 4.787 2.466 -1.291) 5.538 10.738 ( 3.873 0.182 -2.749) 4.753 11.154 ( 1.979 -8.313 -1.391) 8.658 11.229 ( -3.623 -10.550 -4.957) 12.207 11.563 ( 2.906 0.479 -4.042) 5.001 11.625 ( -2.394 -0.284 -1.727) 2.965 12.846 ( 3.096 12.131 -1.134) 12.571 12.901 ( -1.418 5.810 0.114) 5.981 13.173 ( 6.589 6.424 1.853) 9.387 13.363 ( -11.017 -1.830 1.761) 11.306 14.476 ( 8.212 -8.736 -0.703) 12.010 14.600 ( -3.569 -4.969 -5.630) 8.314 15.033 ( 5.614 -6.845 -16.951) 19.124 15.198 ( -11.104 -10.160 -9.695) 17.903 17.072 ( 17.597 5.192 17.167) 25.127 17.415 ( -16.649 -1.987 11.938) 20.583 18.502 ( 3.072 -21.205 -6.469) 22.382 18.562 ( -2.587 -18.620 -4.998) 19.452 28.222 ( 7.561 18.459 1.485) 20.002 28.413 ( -11.937 18.451 -0.344) 21.979 28.905 ( 1.261 4.544 -0.377) 4.731 28.931 ( -1.423 4.546 -0.046) 4.764 30.586 ( 11.160 2.902 -3.951) 12.189 30.747 ( -5.490 1.720 -3.663) 6.821 31.959 ( 0.851 -9.018 -1.892) 9.254 31.979 ( -1.139 -8.034 -1.441) 8.241 85.859 ( 2.535 -0.895 -3.827) 4.676 85.906 ( -1.858 -1.408 -5.591) 6.058 86.569 ( 6.346 -13.437 23.222) 27.569 86.687 ( -5.214 -16.934 28.053) 33.180 ======================= Grid point 105 (40/162) ======================= q-point: ( 0.00 0.25 0.09) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 267 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.223 ( 0.000 38.039 6.268) 38.552 3.465 ( 0.000 38.901 5.657) 39.310 4.403 ( 0.000 21.844 3.635) 22.145 5.270 ( 0.000 7.942 -11.701) 14.142 5.282 ( 0.000 13.569 5.527) 14.651 5.848 ( 0.000 5.457 16.982) 17.838 6.362 ( 0.000 59.056 9.456) 59.808 7.024 ( 0.000 -5.880 -5.519) 8.064 7.541 ( 0.000 1.943 -0.668) 2.055 7.995 ( 0.000 34.728 -6.824) 35.392 8.083 ( 0.000 2.440 -2.511) 3.501 8.392 ( 0.000 21.056 -2.503) 21.204 8.683 ( 0.000 7.782 6.777) 10.320 8.708 ( 0.000 -4.525 7.292) 8.582 9.424 ( 0.000 23.414 -2.772) 23.578 9.897 ( 0.000 9.675 -1.723) 9.827 10.010 ( 0.000 5.074 0.846) 5.144 10.204 ( 0.000 19.521 -0.430) 19.526 10.380 ( 0.000 23.380 1.779) 23.447 10.591 ( 0.000 4.811 -0.773) 4.872 11.030 ( 0.000 -10.986 -2.455) 11.257 11.142 ( 0.000 -4.135 1.935) 4.565 11.581 ( 0.000 -0.454 -3.050) 3.084 11.648 ( 0.000 6.219 -4.804) 7.859 12.752 ( 0.000 -3.370 6.792) 7.582 13.086 ( 0.000 12.678 0.625) 12.693 13.407 ( 0.000 9.502 0.602) 9.521 13.497 ( 0.000 -3.833 1.916) 4.285 14.142 ( 0.000 -6.784 1.288) 6.905 14.545 ( 0.000 -4.944 -10.009) 11.163 14.859 ( 0.000 -4.695 -15.670) 16.358 15.299 ( 0.000 -11.938 -2.936) 12.294 16.829 ( 0.000 8.015 11.625) 14.120 17.468 ( 0.000 -18.098 -1.716) 18.179 17.941 ( 0.000 -27.264 -2.362) 27.366 18.312 ( 0.000 -14.952 -4.029) 15.485 28.417 ( 0.000 16.647 1.539) 16.718 28.967 ( 0.000 5.898 -4.577) 7.466 28.969 ( 0.000 5.627 0.871) 5.694 29.141 ( 0.000 8.027 1.553) 8.176 30.425 ( 0.000 14.219 0.259) 14.221 30.894 ( 0.000 4.080 -2.391) 4.729 31.743 ( 0.000 -9.966 -1.352) 10.057 31.862 ( 0.000 -7.737 -0.825) 7.781 85.792 ( 0.000 -0.460 -1.242) 1.324 85.880 ( 0.000 -1.185 -3.724) 3.908 86.289 ( 0.000 -6.408 13.269) 14.735 86.484 ( 0.000 -12.389 20.586) 24.027 ======================= Grid point 106 (41/162) ======================= q-point: ( 0.20 0.25 0.09) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 441 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.309 ( 8.533 37.010 5.471) 38.373 3.562 ( 9.875 36.087 6.161) 37.918 4.230 ( -15.381 24.122 2.945) 28.760 4.804 ( -27.306 15.620 5.525) 31.940 5.573 ( 15.785 5.968 -7.780) 18.582 6.112 ( 16.150 5.642 10.301) 19.969 6.451 ( 9.053 54.135 8.546) 55.548 6.941 ( -5.239 -1.004 0.327) 5.344 7.529 ( -3.126 12.991 -2.741) 13.640 7.981 ( -4.661 19.197 -3.850) 20.126 8.034 ( -2.263 10.570 -2.460) 11.086 8.284 ( -7.665 21.642 3.995) 23.304 8.589 ( -3.115 -1.814 1.387) 3.863 8.791 ( 1.843 -0.576 4.001) 4.443 9.463 ( 1.976 23.141 -2.798) 23.393 9.688 ( -12.705 18.791 3.707) 22.984 9.977 ( 2.528 6.997 -0.919) 7.496 10.254 ( -5.641 18.563 -0.765) 19.417 10.555 ( 17.896 10.527 -0.888) 20.781 10.702 ( 7.953 9.259 -0.787) 12.232 11.038 ( 0.433 -9.985 -2.545) 10.314 11.099 ( -3.643 -3.533 1.625) 5.328 11.590 ( 0.933 2.848 -4.910) 5.752 11.661 ( 0.986 4.685 -3.005) 5.652 12.769 ( 2.095 -4.359 6.421) 8.038 13.070 ( -1.955 9.340 1.376) 9.641 13.397 ( -0.905 10.462 0.128) 10.502 13.477 ( -2.597 -1.183 1.312) 3.141 14.163 ( 3.439 -7.455 1.217) 8.300 14.541 ( -1.022 -5.584 -7.714) 9.578 14.865 ( 0.733 -5.331 -15.261) 16.182 15.196 ( -9.306 -11.038 -4.704) 15.185 16.910 ( 7.591 4.105 10.663) 13.717 17.425 ( -4.638 -15.804 1.068) 16.506 17.979 ( 4.001 -25.034 -3.693) 25.619 18.291 ( -2.325 -15.531 -4.210) 16.258 28.454 ( 3.821 16.655 1.389) 17.144 28.909 ( -6.046 9.451 -3.521) 11.759 28.982 ( 0.670 5.344 0.013) 5.385 29.079 ( -4.215 7.067 2.687) 8.656 30.519 ( 8.218 11.296 -0.830) 13.994 30.877 ( -1.855 4.215 -2.481) 5.231 31.753 ( 1.013 -9.699 -1.288) 9.836 31.849 ( -1.228 -7.885 -0.860) 8.027 85.807 ( 1.501 -0.340 -1.884) 2.432 85.890 ( 0.552 -1.221 -4.420) 4.619 86.300 ( 1.258 -7.405 14.739) 16.543 86.465 ( -1.861 -12.245 19.790) 23.346 ======================= Grid point 107 (42/162) ======================= q-point: ( 0.40 0.25 0.09) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 441 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.544 ( 15.110 33.879 3.601) 37.270 3.830 ( 9.502 29.985 3.977) 31.705 3.899 ( -9.238 28.380 6.208) 30.485 4.283 ( -25.015 21.823 8.025) 34.153 5.905 ( 17.138 3.069 -7.623) 19.006 6.184 ( -8.852 3.410 -4.144) 10.352 6.706 ( 14.679 41.031 9.607) 44.624 6.903 ( -2.677 18.418 11.337) 21.793 7.473 ( 3.298 22.788 -1.485) 23.073 7.721 ( -17.279 11.728 2.382) 21.019 8.082 ( 4.136 13.754 -1.278) 14.419 8.166 ( -4.612 14.637 1.853) 15.458 8.611 ( 4.855 -4.006 -0.697) 6.333 8.736 ( -6.437 -3.398 0.322) 7.286 9.481 ( 1.596 23.602 0.465) 23.661 9.543 ( -4.240 24.907 3.487) 25.504 10.052 ( 4.627 8.708 -1.096) 9.922 10.147 ( -5.048 12.502 -0.537) 13.493 10.827 ( 7.177 10.789 -2.766) 13.250 10.846 ( 6.664 10.690 -2.348) 12.815 11.006 ( -1.965 -6.440 0.860) 6.788 11.047 ( -2.604 -6.195 -1.956) 6.999 11.623 ( 2.424 5.395 -4.649) 7.523 11.665 ( -1.110 4.628 -2.745) 5.494 12.850 ( 6.319 -4.883 5.268) 9.567 12.989 ( -6.489 0.282 3.379) 7.321 13.383 ( -0.132 11.263 -0.476) 11.274 13.409 ( -3.026 6.720 0.123) 7.371 14.300 ( 9.641 -8.412 0.614) 12.810 14.473 ( -6.542 -7.198 -2.768) 10.113 14.897 ( 2.938 -6.993 -13.627) 15.595 15.005 ( -8.442 -9.275 -9.516) 15.743 17.093 ( 10.314 -3.524 8.374) 13.745 17.288 ( -8.988 -10.559 5.293) 14.842 18.090 ( 6.722 -20.495 -4.775) 22.091 18.215 ( -5.459 -17.163 -4.603) 18.589 28.565 ( 7.492 16.380 0.755) 18.028 28.739 ( -9.789 14.723 -0.943) 17.705 28.999 ( 1.038 5.024 0.664) 5.173 29.025 ( -1.721 5.049 1.519) 5.546 30.689 ( 8.056 7.155 -2.162) 10.989 30.815 ( -4.713 4.950 -2.574) 7.303 31.781 ( 1.746 -9.044 -1.133) 9.280 31.818 ( -1.882 -8.345 -0.968) 8.609 85.847 ( 2.285 -0.362 -3.316) 4.043 85.885 ( -1.262 -0.792 -4.638) 4.872 86.344 ( 3.218 -9.725 16.864) 19.731 86.413 ( -3.365 -11.521 18.268) 21.858 ======================= Grid point 110 (43/162) ======================= q-point: ( 0.00 0.31 0.09) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 264 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.939 ( 0.000 34.846 -0.829) 34.856 4.207 ( 0.000 37.010 3.295) 37.157 4.826 ( 0.000 21.099 1.147) 21.130 5.427 ( 0.000 8.069 -10.734) 13.428 5.515 ( 0.000 10.759 3.223) 11.232 5.924 ( 0.000 2.719 14.416) 14.670 6.874 ( 0.000 -9.597 -6.004) 11.320 7.201 ( 0.000 21.336 2.688) 21.505 7.595 ( 0.000 6.128 5.889) 8.499 8.037 ( 0.000 -6.560 -1.193) 6.668 8.295 ( 0.000 -4.502 -3.135) 5.486 8.660 ( 0.000 9.753 -3.613) 10.400 8.805 ( 0.000 16.512 5.371) 17.364 8.961 ( 0.000 19.899 4.460) 20.392 9.773 ( 0.000 12.447 -6.996) 14.279 10.008 ( 0.000 1.865 -0.143) 1.871 10.116 ( 0.000 6.647 5.351) 8.534 10.654 ( 0.000 9.650 -3.346) 10.213 10.733 ( 0.000 15.029 0.663) 15.043 10.785 ( 0.000 -3.540 0.204) 3.546 11.039 ( 0.000 30.141 -1.841) 30.198 11.166 ( 0.000 13.439 -1.224) 13.494 11.591 ( 0.000 1.981 -3.033) 3.622 11.817 ( 0.000 10.350 -4.929) 11.464 12.749 ( 0.000 4.617 5.583) 7.245 13.269 ( 0.000 6.135 2.555) 6.645 13.434 ( 0.000 -2.319 3.579) 4.265 13.544 ( 0.000 5.548 2.056) 5.917 14.080 ( 0.000 0.407 1.157) 1.227 14.437 ( 0.000 -5.724 -8.654) 10.376 14.760 ( 0.000 -5.374 -10.996) 12.239 15.102 ( 0.000 -8.248 -5.046) 9.669 16.905 ( 0.000 -0.397 5.698) 5.712 17.119 ( 0.000 -17.162 -1.898) 17.267 17.409 ( 0.000 -26.806 -0.431) 26.809 17.988 ( 0.000 -18.231 -4.324) 18.737 28.716 ( 0.000 13.696 0.795) 13.719 29.058 ( 0.000 3.725 -2.103) 4.278 29.084 ( 0.000 6.053 1.422) 6.218 29.291 ( 0.000 6.757 1.478) 6.916 30.700 ( 0.000 13.629 -0.019) 13.629 30.985 ( 0.000 4.986 -2.278) 5.482 31.563 ( 0.000 -8.332 -0.502) 8.347 31.714 ( 0.000 -7.309 -0.363) 7.318 85.790 ( 0.000 0.147 -0.948) 0.959 85.859 ( 0.000 -0.939 -2.530) 2.698 86.179 ( 0.000 -4.830 9.313) 10.491 86.287 ( 0.000 -8.048 11.133) 13.737 ======================= Grid point 111 (44/162) ======================= q-point: ( 0.20 0.31 0.09) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 440 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 4.007 ( 6.833 34.173 -0.889) 34.861 4.259 ( 5.406 35.078 3.698) 35.685 4.703 ( -11.030 24.010 0.260) 26.424 5.096 ( -20.921 14.502 2.957) 25.626 5.690 ( 11.773 6.073 -6.712) 14.851 6.166 ( 13.972 0.603 7.906) 16.065 6.814 ( -1.876 -7.513 -1.943) 7.984 7.241 ( 2.239 17.417 5.101) 18.286 7.639 ( 3.814 4.345 3.036) 6.530 7.967 ( -6.711 -4.871 -1.169) 8.375 8.337 ( 4.071 -4.244 -2.088) 6.240 8.606 ( -3.997 15.936 -1.224) 16.475 8.773 ( -4.305 13.769 2.500) 14.641 8.845 ( -9.857 16.898 3.392) 19.855 9.816 ( 3.025 12.645 -5.331) 14.052 10.023 ( -5.873 10.227 4.308) 12.556 10.063 ( 5.431 5.302 0.027) 7.590 10.582 ( -7.125 11.567 -1.476) 13.665 10.809 ( 2.421 -4.412 0.501) 5.058 10.833 ( 6.209 5.938 1.056) 8.656 11.097 ( 5.193 25.375 -4.494) 26.288 11.192 ( 2.934 19.794 -1.740) 20.086 11.657 ( 5.899 5.449 -3.508) 8.763 11.829 ( 0.916 11.329 -4.673) 12.289 12.737 ( -0.377 2.576 5.751) 6.313 13.164 ( -8.973 1.522 3.804) 9.864 13.495 ( 3.955 2.021 2.182) 4.948 13.550 ( 0.467 6.013 1.397) 6.191 14.081 ( 1.272 -0.796 0.800) 1.701 14.427 ( -1.588 -5.751 -6.546) 8.857 14.755 ( -0.336 -5.899 -10.711) 12.232 15.011 ( -8.401 -8.019 -5.694) 12.934 16.894 ( 0.264 -6.073 4.480) 7.551 17.109 ( -2.063 -15.625 0.814) 15.781 17.507 ( 9.153 -22.688 -2.092) 24.554 17.965 ( -2.570 -18.052 -4.261) 18.725 28.751 ( 3.559 13.491 0.610) 13.966 29.045 ( -1.552 5.034 -2.348) 5.767 29.087 ( 0.340 5.519 1.390) 5.701 29.229 ( -5.438 7.444 2.403) 9.527 30.749 ( 4.508 11.891 -0.525) 12.728 30.972 ( -1.320 5.316 -2.218) 5.910 31.577 ( 1.388 -8.208 -0.491) 8.339 31.699 ( -1.456 -7.381 -0.378) 7.533 85.806 ( 1.604 0.219 -1.351) 2.109 85.871 ( 0.851 -0.748 -3.139) 3.338 86.175 ( -0.211 -5.411 10.224) 11.569 86.270 ( -1.691 -8.055 11.063) 13.788 ======================= Grid point 112 (45/162) ======================= q-point: ( 0.40 0.31 0.09) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 440 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 4.193 ( 11.727 32.211 -1.106) 34.298 4.417 ( 6.512 30.086 2.319) 30.870 4.457 ( -8.661 28.280 1.688) 29.625 4.713 ( -17.490 22.204 5.293) 28.756 5.953 ( 14.244 1.979 -6.826) 15.919 6.202 ( -9.153 -0.486 -4.274) 10.113 6.967 ( 15.227 -4.897 9.256) 18.480 7.213 ( -6.954 4.600 9.571) 12.693 7.716 ( 3.930 4.962 -1.096) 6.424 7.817 ( -7.064 2.649 -1.910) 7.783 8.448 ( 6.969 -1.577 -0.202) 7.148 8.550 ( -1.735 15.823 1.126) 15.957 8.647 ( -6.730 26.108 1.191) 26.988 8.660 ( -7.076 3.215 0.496) 7.788 9.872 ( 3.007 12.921 -1.648) 13.369 9.937 ( -3.513 11.731 1.224) 12.307 10.211 ( 9.275 10.013 -0.111) 13.649 10.407 ( -10.086 13.905 -0.289) 17.181 10.859 ( 2.584 -4.810 1.190) 5.588 10.892 ( -0.159 -3.771 1.592) 4.097 11.210 ( 5.160 24.110 -6.013) 25.378 11.251 ( 1.357 22.939 -4.155) 23.351 11.775 ( 5.039 11.162 -3.993) 12.881 11.833 ( -0.997 12.685 -4.164) 13.388 12.779 ( 5.653 -1.012 5.801) 8.163 12.955 ( -11.218 -1.672 5.093) 12.433 13.549 ( 1.385 6.020 0.520) 6.199 13.558 ( 0.171 6.820 0.371) 6.832 14.174 ( 8.145 -4.192 0.361) 9.168 14.344 ( -7.326 -5.715 -2.317) 9.576 14.761 ( 1.485 -6.922 -9.760) 12.057 14.840 ( -7.088 -7.679 -7.782) 13.029 16.940 ( 4.184 -11.353 3.474) 12.589 17.035 ( -4.937 -14.195 2.593) 15.251 17.709 ( 10.243 -18.629 -3.384) 21.527 17.877 ( -6.575 -17.778 -3.991) 19.371 28.850 ( 6.332 12.572 -0.164) 14.077 28.978 ( -5.716 9.493 -2.024) 11.264 29.098 ( 0.862 5.090 1.826) 5.476 29.132 ( -3.220 6.042 3.065) 7.501 30.848 ( 4.972 8.777 -1.392) 10.183 30.929 ( -3.169 6.479 -1.969) 7.476 31.614 ( 2.287 -7.910 -0.461) 8.247 31.661 ( -2.329 -7.594 -0.417) 7.954 85.846 ( 2.121 0.269 -2.490) 3.282 85.876 ( -0.659 -0.092 -3.616) 3.677 86.184 ( 1.411 -6.859 11.408) 13.385 86.226 ( -2.532 -7.834 11.216) 13.913 ======================= Grid point 115 (46/162) ======================= q-point: ( 0.00 0.38 0.09) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 267 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 4.574 ( 0.000 30.088 -5.289) 30.549 4.902 ( 0.000 33.714 0.817) 33.724 5.210 ( 0.000 17.762 -0.939) 17.787 5.578 ( 0.000 7.373 -8.348) 11.137 5.717 ( 0.000 10.264 0.265) 10.267 5.955 ( 0.000 0.128 9.838) 9.838 6.647 ( 0.000 -13.513 -7.177) 15.301 7.238 ( 0.000 -11.632 -0.797) 11.660 7.649 ( 0.000 -2.699 9.674) 10.043 8.015 ( 0.000 5.539 -0.664) 5.579 8.133 ( 0.000 -9.768 -0.630) 9.788 8.633 ( 0.000 -8.086 1.882) 8.302 9.228 ( 0.000 21.747 2.083) 21.847 9.404 ( 0.000 21.274 -2.130) 21.381 9.955 ( 0.000 6.283 -5.913) 8.628 9.993 ( 0.000 -2.871 0.219) 2.879 10.278 ( 0.000 10.227 4.509) 11.177 10.677 ( 0.000 -4.164 1.198) 4.333 10.709 ( 0.000 -0.058 -1.310) 1.311 10.827 ( 0.000 -1.816 1.996) 2.698 11.603 ( 0.000 20.753 -2.596) 20.915 11.687 ( 0.000 28.488 -7.019) 29.340 11.690 ( 0.000 9.222 -1.842) 9.404 12.005 ( 0.000 7.779 -4.094) 8.790 13.008 ( 0.000 22.720 1.307) 22.758 13.353 ( 0.000 3.414 4.276) 5.472 13.417 ( 0.000 1.265 6.291) 6.417 13.676 ( 0.000 8.829 1.107) 8.898 14.128 ( 0.000 3.687 1.334) 3.921 14.328 ( 0.000 -5.435 -8.175) 9.817 14.650 ( 0.000 -5.993 -7.306) 9.449 14.961 ( 0.000 -7.075 -5.632) 9.043 16.811 ( 0.000 -15.153 -3.147) 15.477 16.820 ( 0.000 -7.925 2.586) 8.336 16.931 ( 0.000 -19.543 2.250) 19.673 17.605 ( 0.000 -20.723 -3.435) 21.005 28.944 ( 0.000 9.638 0.405) 9.647 29.119 ( 0.000 2.483 -0.780) 2.602 29.200 ( 0.000 5.707 1.345) 5.863 29.392 ( 0.000 3.410 1.200) 3.615 30.949 ( 0.000 11.755 -0.046) 11.755 31.081 ( 0.000 4.767 -2.031) 5.182 31.422 ( 0.000 -6.097 0.010) 6.097 31.579 ( 0.000 -6.534 0.224) 6.538 85.796 ( 0.000 0.434 -0.054) 0.437 85.843 ( 0.000 -0.738 -1.241) 1.444 86.102 ( 0.000 -2.998 5.673) 6.416 86.161 ( 0.000 -4.942 5.113) 7.111 ======================= Grid point 116 (47/162) ======================= q-point: ( 0.20 0.38 0.09) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 441 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 4.634 ( 5.941 29.877 -5.117) 30.888 4.920 ( 2.017 32.006 1.591) 32.109 5.154 ( -5.767 21.822 -1.735) 22.638 5.372 ( -13.428 13.752 -0.231) 19.222 5.802 ( 6.755 5.016 -5.606) 10.110 6.150 ( 11.666 -2.150 5.805) 13.206 6.605 ( -1.260 -13.332 -4.720) 14.199 7.215 ( -3.810 -14.672 2.153) 15.311 7.672 ( 2.803 -1.047 6.304) 6.978 7.971 ( -3.864 4.379 -1.380) 6.001 8.176 ( 3.992 -9.326 0.582) 10.161 8.583 ( -5.118 -9.225 2.050) 10.747 9.168 ( -4.530 22.330 0.948) 22.805 9.321 ( -7.075 22.587 -1.427) 23.712 9.957 ( 0.446 1.492 -4.035) 4.325 10.033 ( 1.059 -1.465 0.283) 1.830 10.301 ( 4.357 13.098 2.453) 14.020 10.704 ( -1.290 1.602 0.075) 2.058 10.716 ( 3.422 -2.486 0.131) 4.232 10.832 ( 0.378 -2.645 1.760) 3.199 11.618 ( 2.521 21.144 -4.399) 21.743 11.659 ( 1.971 20.138 -2.852) 20.434 11.885 ( 11.770 18.331 -5.708) 22.520 12.042 ( 3.393 9.100 -4.169) 10.568 12.946 ( -5.174 20.154 2.319) 20.936 13.196 ( -10.846 3.196 5.166) 12.431 13.520 ( 5.814 0.751 5.022) 7.719 13.687 ( 0.870 9.079 0.785) 9.154 14.108 ( -1.131 2.778 0.266) 3.011 14.320 ( -1.369 -5.246 -6.000) 8.087 14.635 ( -1.256 -6.521 -7.174) 9.776 14.865 ( -8.818 -7.753 -5.270) 12.870 16.695 ( -2.857 -12.462 1.024) 12.827 16.844 ( -2.101 -10.900 0.833) 11.132 17.108 ( 12.987 -18.259 -0.724) 22.418 17.587 ( -2.060 -20.438 -3.401) 20.821 28.975 ( 3.018 9.373 0.196) 9.849 29.122 ( 0.237 3.077 -1.031) 3.253 29.195 ( -0.416 5.300 1.583) 5.547 29.345 ( -4.397 4.154 1.599) 6.256 30.972 ( 2.087 10.675 -0.313) 10.881 31.076 ( -0.559 5.162 -1.894) 5.527 31.437 ( 1.468 -6.138 0.008) 6.311 31.564 ( -1.489 -6.486 0.191) 6.657 85.814 ( 1.775 0.558 -0.340) 1.891 85.859 ( 1.421 -0.448 -1.720) 2.275 86.088 ( -1.218 -3.420 6.204) 7.188 86.143 ( -1.779 -5.052 5.301) 7.536 ======================= Grid point 117 (48/162) ======================= q-point: ( 0.40 0.38 0.09) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 441 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 4.792 ( 9.796 29.062 -4.510) 30.998 4.984 ( -1.150 25.474 0.162) 25.500 5.001 ( -3.367 29.180 -0.837) 29.386 5.140 ( -9.784 21.215 2.309) 23.476 5.976 ( 10.515 0.090 -6.337) 12.277 6.174 ( -7.922 -2.494 -4.378) 9.388 6.759 ( 15.283 -15.094 5.032) 22.062 7.052 ( -12.635 -16.745 6.098) 21.846 7.761 ( 5.825 1.080 1.096) 6.025 7.877 ( -5.584 2.961 -1.157) 6.425 8.284 ( 7.048 -10.157 1.636) 12.470 8.443 ( -8.514 -10.526 2.014) 13.687 9.117 ( 0.256 24.169 -0.053) 24.170 9.183 ( -6.018 24.153 -0.542) 24.898 9.971 ( 1.251 -0.636 -1.899) 2.362 10.009 ( -2.355 -1.347 -0.269) 2.726 10.455 ( 9.622 11.944 0.255) 15.340 10.624 ( -6.788 7.279 -0.244) 9.956 10.791 ( 3.336 -2.186 1.003) 4.113 10.831 ( -0.815 -2.671 1.593) 3.215 11.692 ( 3.575 22.653 -4.972) 23.466 11.710 ( 1.856 22.124 -4.180) 22.591 12.070 ( 5.914 16.020 -6.252) 18.185 12.106 ( 1.838 13.109 -5.088) 14.181 12.876 ( -0.060 12.670 4.566) 13.468 12.979 ( -9.826 5.320 5.570) 12.485 13.630 ( 5.039 3.003 2.744) 6.476 13.691 ( -1.056 7.850 0.890) 7.971 14.127 ( 3.958 -1.050 -0.501) 4.126 14.247 ( -6.321 -4.648 -2.469) 8.226 14.621 ( 0.605 -7.645 -6.533) 10.074 14.690 ( -6.972 -8.397 -5.308) 12.137 16.704 ( 3.001 -11.086 1.256) 11.553 16.780 ( -4.040 -10.665 1.060) 11.454 17.348 ( 10.690 -18.686 -2.345) 21.655 17.512 ( -5.953 -19.651 -3.137) 20.771 29.053 ( 4.531 8.320 -0.728) 9.502 29.117 ( -1.313 5.339 -1.771) 5.777 29.193 ( 0.660 4.358 2.478) 5.057 29.246 ( -4.802 4.882 2.636) 7.338 31.018 ( 2.379 8.417 -0.904) 8.793 31.057 ( -1.474 6.390 -1.494) 6.726 31.476 ( 2.396 -6.241 0.033) 6.685 31.524 ( -2.409 -6.370 0.108) 6.811 85.857 ( 2.182 0.849 -1.365) 2.711 85.881 ( 0.130 0.554 -2.477) 2.541 86.072 ( 0.120 -4.711 7.080) 8.504 86.100 ( -2.310 -5.246 6.134) 8.395 ======================= Grid point 120 (49/162) ======================= q-point: ( 0.00 0.44 0.09) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 264 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 5.108 ( 0.000 24.343 -6.351) 25.158 5.444 ( 0.000 16.101 -7.145) 17.615 5.500 ( 0.000 11.712 -4.758) 12.642 5.763 ( 0.000 14.593 2.970) 14.892 5.913 ( 0.000 -3.489 0.478) 3.521 5.919 ( 0.000 10.233 -1.994) 10.425 6.373 ( 0.000 -13.305 -6.525) 14.819 6.856 ( 0.000 -25.116 2.791) 25.271 7.649 ( 0.000 3.487 5.297) 6.342 7.943 ( 0.000 -9.470 2.307) 9.747 8.136 ( 0.000 6.059 1.137) 6.164 8.440 ( 0.000 -10.337 2.120) 10.552 9.568 ( 0.000 13.327 0.021) 13.327 9.744 ( 0.000 13.450 -3.085) 13.799 9.910 ( 0.000 -5.508 -0.186) 5.511 10.007 ( 0.000 -0.747 -3.717) 3.791 10.486 ( 0.000 9.484 1.785) 9.651 10.639 ( 0.000 0.117 1.916) 1.920 10.679 ( 0.000 -2.591 -0.714) 2.688 10.765 ( 0.000 -4.085 2.421) 4.748 11.885 ( 0.000 7.518 -1.417) 7.650 11.904 ( 0.000 14.386 -2.774) 14.652 12.014 ( 0.000 3.217 -7.155) 7.845 12.145 ( 0.000 7.105 -2.862) 7.660 13.364 ( 0.000 5.318 1.245) 5.462 13.416 ( 0.000 2.521 5.246) 5.820 13.696 ( 0.000 32.024 4.135) 32.290 13.881 ( 0.000 11.151 -1.821) 11.298 14.219 ( 0.000 5.966 0.113) 5.967 14.219 ( 0.000 -5.935 -7.402) 9.488 14.523 ( 0.000 -7.095 -4.353) 8.324 14.769 ( 0.000 -14.479 -4.223) 15.082 16.513 ( 0.000 -11.225 -0.202) 11.227 16.625 ( 0.000 -10.947 1.254) 11.019 16.751 ( 0.000 -0.606 -0.005) 0.606 17.201 ( 0.000 -19.830 -2.321) 19.966 29.090 ( 0.000 5.256 0.568) 5.287 29.154 ( 0.000 1.050 0.043) 1.051 29.303 ( 0.000 4.798 0.677) 4.845 29.421 ( 0.000 -0.368 0.716) 0.805 31.155 ( 0.000 9.219 0.018) 9.219 31.167 ( 0.000 4.021 -1.539) 4.306 31.323 ( 0.000 -4.127 0.137) 4.129 31.455 ( 0.000 -6.332 0.669) 6.368 85.806 ( 0.000 0.553 0.731) 0.917 85.830 ( 0.000 -0.661 0.037) 0.662 86.062 ( 0.000 -1.136 2.687) 2.918 86.089 ( 0.000 -2.586 1.840) 3.174 ======================= Grid point 121 (50/162) ======================= q-point: ( 0.20 0.44 0.09) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 440 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 5.168 ( 5.926 24.531 -6.346) 26.022 5.436 ( -0.424 18.588 -3.300) 18.883 5.508 ( 0.055 10.808 -6.615) 12.671 5.700 ( -4.846 23.927 1.858) 24.483 5.870 ( 0.112 0.955 -3.588) 3.714 6.082 ( 9.707 -4.287 2.513) 10.906 6.325 ( -3.488 -13.760 -6.809) 15.744 6.806 ( -5.217 -25.149 3.505) 25.922 7.689 ( 4.007 3.404 4.194) 6.726 7.965 ( 1.940 -8.025 1.710) 8.431 8.091 ( -3.954 3.665 1.885) 5.711 8.378 ( -5.982 -10.580 2.284) 12.367 9.529 ( -2.674 14.668 -0.550) 14.920 9.681 ( -5.561 14.334 -2.108) 15.519 9.903 ( -0.397 -5.501 -1.367) 5.682 9.996 ( -1.778 -3.151 -1.702) 3.998 10.522 ( 3.965 8.750 0.545) 9.622 10.682 ( 3.835 -0.400 1.020) 3.988 10.710 ( 1.964 -1.227 0.060) 2.316 10.770 ( 0.511 -3.397 2.003) 3.977 11.930 ( 4.642 8.599 -2.306) 10.040 11.964 ( 5.927 16.104 -3.875) 17.593 12.091 ( 6.370 1.525 -5.296) 8.423 12.229 ( 7.018 7.709 -4.776) 11.466 13.266 ( -6.838 7.393 3.631) 10.705 13.446 ( -0.885 10.956 1.268) 11.065 13.591 ( -6.298 18.414 6.287) 20.451 13.908 ( 1.121 13.067 -1.057) 13.157 14.176 ( -2.516 2.194 -3.757) 5.026 14.219 ( -1.711 -3.159 -2.656) 4.468 14.497 ( -2.344 -7.668 -4.484) 9.186 14.657 ( -9.853 -14.955 -3.178) 18.189 16.497 ( 1.496 -5.483 0.544) 5.709 16.726 ( -0.809 -0.916 -0.661) 1.389 16.781 ( 9.813 -14.555 0.151) 17.554 17.187 ( -1.621 -19.709 -2.334) 19.913 29.115 ( 2.528 5.027 0.457) 5.645 29.167 ( 1.306 1.503 -0.040) 1.991 29.289 ( -1.338 4.293 0.783) 4.564 29.387 ( -3.265 0.207 0.849) 3.380 31.161 ( 0.531 8.608 -0.070) 8.625 31.170 ( 0.227 4.410 -1.363) 4.622 31.335 ( 1.210 -4.395 0.101) 4.560 31.442 ( -1.252 -6.127 0.579) 6.281 85.827 ( 2.066 0.698 0.629) 2.270 85.851 ( 2.044 -0.457 -0.146) 2.099 86.041 ( -1.983 -1.376 2.850) 3.734 86.068 ( -2.050 -2.731 1.951) 3.933 ======================= Grid point 122 (51/162) ======================= q-point: ( 0.40 0.44 0.09) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 440 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 5.320 ( 8.530 24.313 -6.563) 26.588 5.426 ( -1.420 19.589 -3.967) 20.037 5.499 ( -0.010 17.468 -1.588) 17.540 5.572 ( -7.349 25.403 0.074) 26.445 5.946 ( 7.167 -2.802 -5.111) 9.238 6.103 ( -7.220 -4.523 -4.173) 9.487 6.414 ( 12.054 -19.345 1.317) 22.831 6.649 ( -10.645 -23.465 3.885) 26.058 7.798 ( 6.807 3.321 2.184) 7.882 7.935 ( -6.270 3.374 0.441) 7.134 8.086 ( 5.282 -9.552 3.581) 11.487 8.229 ( -8.375 -10.616 2.741) 13.797 9.507 ( 1.012 16.037 -1.028) 16.101 9.569 ( -4.998 15.682 -1.417) 16.521 9.905 ( 0.927 -5.533 -1.348) 5.770 9.944 ( -2.876 -5.007 -1.036) 5.866 10.624 ( 5.550 5.732 -0.186) 7.981 10.707 ( -2.287 2.229 0.568) 3.244 10.757 ( 2.639 -1.800 0.286) 3.208 10.780 ( 0.109 -2.549 1.352) 2.887 12.046 ( 5.743 11.818 -4.207) 13.796 12.079 ( 3.437 16.358 -4.944) 17.431 12.227 ( 6.954 2.074 -5.057) 8.845 12.315 ( -0.273 5.308 -6.044) 8.048 13.173 ( -0.494 14.880 4.825) 15.650 13.284 ( -10.570 25.345 3.009) 27.626 13.656 ( 10.372 -2.238 4.185) 11.406 13.866 ( -7.336 7.784 0.150) 10.697 14.135 ( -1.234 1.315 -2.524) 3.102 14.154 ( -3.494 -2.562 -1.134) 4.478 14.455 ( -1.027 -9.554 -4.303) 10.529 14.489 ( -5.147 -12.131 -2.725) 13.456 16.572 ( 5.180 -1.114 0.161) 5.301 16.669 ( -4.230 0.263 -0.244) 4.245 16.984 ( 9.291 -18.080 -1.521) 20.384 17.125 ( -5.051 -19.235 -2.187) 20.007 29.178 ( 3.299 4.499 -0.132) 5.580 29.200 ( 1.610 3.225 -0.597) 3.654 29.260 ( -0.920 2.507 1.538) 3.081 29.307 ( -4.457 1.254 1.316) 4.814 31.171 ( 0.380 7.115 -0.399) 7.136 31.174 ( 0.074 5.524 -0.911) 5.599 31.368 ( 2.028 -4.979 0.144) 5.378 31.409 ( -2.045 -5.610 0.355) 5.982 85.878 ( 2.707 1.276 0.007) 2.993 85.896 ( 1.639 0.846 -0.914) 2.058 85.998 ( -1.567 -2.768 3.570) 4.781 86.017 ( -2.731 -3.279 2.601) 4.998 ======================= Grid point 125 (52/162) ======================= q-point: ( 0.00 -0.50 0.09) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 150 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 5.474 ( 0.000 -10.351 -6.046) 11.988 5.474 ( 0.000 10.351 -6.046) 11.988 5.699 ( 0.000 -10.541 -5.369) 11.829 5.699 ( 0.000 10.541 -5.369) 11.829 6.098 ( 0.000 -5.606 -6.131) 8.308 6.098 ( 0.000 5.606 -6.131) 8.308 6.337 ( 0.000 -24.057 5.277) 24.629 6.337 ( 0.000 24.057 5.277) 24.629 7.768 ( 0.000 -8.107 4.072) 9.072 7.768 ( 0.000 8.107 4.072) 9.072 8.263 ( 0.000 -7.528 1.828) 7.747 8.263 ( 0.000 7.528 1.828) 7.747 9.775 ( 0.000 -8.440 -0.618) 8.463 9.775 ( 0.000 8.440 -0.618) 8.463 9.936 ( 0.000 -6.506 -3.127) 7.219 9.936 ( 0.000 6.506 -3.127) 7.219 10.617 ( 0.000 -4.121 -0.425) 4.143 10.617 ( 0.000 4.121 -0.425) 4.143 10.680 ( 0.000 -4.003 2.987) 4.995 10.680 ( 0.000 4.003 2.987) 4.995 11.988 ( 0.000 -3.715 -3.235) 4.926 11.988 ( 0.000 3.715 -3.235) 4.926 12.142 ( 0.000 -7.706 -3.514) 8.470 12.142 ( 0.000 7.706 -3.514) 8.470 13.423 ( 0.000 -1.742 5.189) 5.474 13.423 ( 0.000 1.742 5.189) 5.474 14.073 ( 0.000 -7.791 -5.662) 9.631 14.073 ( 0.000 7.791 -5.662) 9.631 14.317 ( 0.000 -16.279 -2.677) 16.497 14.317 ( 0.000 16.279 -2.677) 16.497 14.393 ( 0.000 -3.810 -0.443) 3.836 14.393 ( 0.000 3.810 -0.443) 3.836 16.453 ( 0.000 -4.622 0.751) 4.683 16.453 ( 0.000 4.622 0.751) 4.683 16.873 ( 0.000 -12.533 -1.305) 12.601 16.873 ( 0.000 12.533 -1.305) 12.601 29.153 ( 0.000 -1.403 0.555) 1.509 29.153 ( 0.000 1.403 0.555) 1.509 29.383 ( 0.000 -3.251 0.366) 3.271 29.383 ( 0.000 3.251 0.366) 3.271 31.238 ( 0.000 -3.021 -1.077) 3.207 31.238 ( 0.000 3.021 -1.077) 3.207 31.326 ( 0.000 -6.732 0.945) 6.799 31.326 ( 0.000 6.732 0.945) 6.799 85.817 ( 0.000 -0.621 0.821) 1.030 85.817 ( 0.000 0.621 0.821) 1.030 86.058 ( 0.000 -0.672 1.148) 1.330 86.058 ( 0.000 0.672 1.148) 1.330 ======================= Grid point 127 (53/162) ======================= q-point: ( 0.20 -0.50 0.09) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 248 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 5.527 ( 5.088 -8.943 -6.334) 12.082 5.527 ( 5.088 8.943 -6.334) 12.082 5.728 ( 2.416 -13.357 -4.619) 14.338 5.728 ( 2.416 13.357 -4.619) 14.338 6.076 ( -1.731 -2.189 -5.668) 6.317 6.076 ( -1.731 2.189 -5.668) 6.317 6.291 ( -4.517 -24.084 4.946) 24.998 6.291 ( -4.517 24.084 4.946) 24.998 7.801 ( 3.385 -7.679 3.815) 9.219 7.801 ( 3.385 7.679 3.815) 9.219 8.200 ( -6.005 -7.339 1.999) 9.691 8.200 ( -6.005 7.339 1.999) 9.691 9.758 ( -1.120 -9.233 -1.090) 9.364 9.758 ( -1.120 9.233 -1.090) 9.364 9.894 ( -3.912 -7.641 -2.143) 8.847 9.894 ( -3.912 7.641 -2.143) 8.847 10.644 ( 2.737 -4.151 -0.693) 5.020 10.644 ( 2.737 4.151 -0.693) 5.020 10.713 ( 2.416 -2.053 2.489) 4.031 10.713 ( 2.416 2.053 2.489) 4.031 12.046 ( 5.812 -3.937 -3.416) 7.807 12.046 ( 5.812 3.937 -3.416) 7.807 12.224 ( 6.756 -7.694 -4.529) 11.196 12.224 ( 6.756 7.694 -4.529) 11.196 13.407 ( -0.564 -6.483 5.345) 8.421 13.407 ( -0.564 6.483 5.345) 8.421 14.028 ( -7.118 -13.521 -3.886) 15.766 14.028 ( -7.118 13.521 -3.886) 15.766 14.239 ( -4.942 -19.334 -2.428) 20.103 14.239 ( -4.942 19.334 -2.428) 20.103 14.353 ( -3.264 -5.767 -0.824) 6.678 14.353 ( -3.264 5.767 -0.824) 6.678 16.529 ( 6.906 -8.392 0.172) 10.869 16.529 ( 6.906 8.392 0.172) 10.869 16.859 ( -1.597 -12.669 -1.333) 12.839 16.859 ( -1.597 12.669 -1.333) 12.839 29.173 ( 2.048 -1.097 0.539) 2.385 29.173 ( 2.048 1.097 0.539) 2.385 29.360 ( -2.310 -2.760 0.385) 3.620 29.360 ( -2.310 2.760 0.385) 3.620 31.248 ( 0.948 -3.341 -0.880) 3.583 31.248 ( 0.948 3.341 -0.880) 3.583 31.319 ( -0.708 -6.333 0.750) 6.416 31.319 ( -0.708 6.333 0.750) 6.416 85.840 ( 2.280 -0.644 0.851) 2.517 85.840 ( 2.280 0.644 0.851) 2.517 86.035 ( -2.255 -0.688 1.115) 2.608 86.035 ( -2.255 0.688 1.115) 2.608 ======================= Grid point 129 (54/162) ======================= q-point: ( 0.40 -0.50 0.09) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 248 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 5.650 ( 6.675 -5.220 -6.694) 10.799 5.650 ( 6.675 5.220 -6.694) 10.799 5.746 ( -1.991 -10.030 -5.305) 11.520 5.746 ( -1.991 10.030 -5.305) 11.520 6.073 ( 2.698 -10.394 -1.814) 10.891 6.073 ( 2.698 10.394 -1.814) 10.891 6.176 ( -6.614 -21.603 3.098) 22.804 6.176 ( -6.614 21.603 3.098) 22.804 7.901 ( 6.709 -6.963 3.181) 10.179 7.901 ( 6.709 6.963 3.181) 10.179 8.053 ( -8.320 -6.901 2.487) 11.092 8.053 ( -8.320 6.901 2.487) 11.092 9.756 ( 1.245 -9.532 -1.415) 9.717 9.756 ( 1.245 9.532 -1.415) 9.717 9.810 ( -4.010 -8.879 -1.477) 9.854 9.810 ( -4.010 8.879 -1.477) 9.854 10.707 ( 2.985 -3.274 -0.046) 4.431 10.707 ( 2.985 3.274 -0.046) 4.431 10.740 ( -0.115 -1.613 1.142) 1.980 10.740 ( -0.115 1.613 1.142) 1.980 12.196 ( 8.371 -4.272 -4.398) 10.377 12.196 ( 8.371 4.272 -4.398) 10.377 12.304 ( -0.806 -5.933 -5.523) 8.146 12.304 ( -0.806 5.933 -5.523) 8.146 13.477 ( 9.408 -13.950 4.519) 17.422 13.477 ( 9.408 13.950 4.519) 17.422 13.759 ( -17.124 -18.548 1.015) 25.264 13.759 ( -17.124 18.548 1.015) 25.264 14.222 ( 2.027 -9.576 -2.815) 10.185 14.222 ( 2.027 9.576 -2.815) 10.185 14.282 ( -3.672 -7.311 -1.759) 8.368 14.282 ( -3.672 7.311 -1.759) 8.368 16.680 ( 7.547 -11.663 -0.745) 13.912 16.680 ( 7.547 11.663 -0.745) 13.912 16.801 ( -4.554 -12.695 -1.244) 13.545 16.801 ( -4.554 12.695 -1.244) 13.545 29.229 ( 3.435 -0.643 0.495) 3.530 29.229 ( 3.435 0.643 0.495) 3.530 29.300 ( -3.597 -1.593 0.435) 3.958 29.300 ( -3.597 1.593 0.435) 3.958 31.272 ( 1.416 -4.205 -0.374) 4.452 31.272 ( 1.416 4.205 -0.374) 4.452 31.299 ( -1.268 -5.341 0.245) 5.495 31.299 ( -1.268 5.341 0.245) 5.495 85.901 ( 3.676 -0.687 0.930) 3.854 85.901 ( 3.676 0.687 0.930) 3.854 85.975 ( -3.661 -0.706 1.031) 3.869 85.975 ( -3.661 0.706 1.031) 3.869 ======================= Grid point 170 (55/162) ======================= q-point: ( 0.00 0.00 0.18) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 162 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.462 ( 0.000 0.000 35.735) 35.735 1.629 ( 0.000 0.000 38.993) 38.993 2.717 ( 0.000 0.000 64.121) 64.121 3.664 ( 0.000 0.000 21.113) 21.113 3.891 ( 0.000 0.000 9.372) 9.372 4.017 ( 0.000 0.000 -3.344) 3.344 5.180 ( 0.000 0.000 -7.319) 7.319 5.208 ( 0.000 0.000 -4.099) 4.099 6.797 ( 0.000 0.000 -12.768) 12.768 7.049 ( 0.000 0.000 5.139) 5.139 7.253 ( 0.000 0.000 11.323) 11.323 8.022 ( 0.000 0.000 -0.827) 0.827 8.372 ( 0.000 0.000 -0.197) 0.197 8.473 ( 0.000 0.000 -1.259) 1.259 9.118 ( 0.000 0.000 0.130) 0.130 9.148 ( 0.000 0.000 -0.249) 0.249 9.429 ( 0.000 0.000 15.138) 15.138 9.619 ( 0.000 0.000 -5.549) 5.549 9.905 ( 0.000 0.000 0.784) 0.784 10.664 ( 0.000 0.000 -1.683) 1.683 11.273 ( 0.000 0.000 -6.822) 6.822 11.564 ( 0.000 0.000 -2.365) 2.365 11.815 ( 0.000 0.000 -6.291) 6.291 12.076 ( 0.000 0.000 0.121) 0.121 12.101 ( 0.000 0.000 -0.199) 0.199 12.186 ( 0.000 0.000 -0.196) 0.196 12.187 ( 0.000 0.000 -0.172) 0.172 13.073 ( 0.000 0.000 -22.910) 22.910 14.337 ( 0.000 0.000 16.837) 16.837 14.626 ( 0.000 0.000 -13.131) 13.131 14.705 ( 0.000 0.000 -4.285) 4.285 16.273 ( 0.000 0.000 8.908) 8.908 16.844 ( 0.000 0.000 34.377) 34.377 18.256 ( 0.000 0.000 -4.551) 4.551 19.192 ( 0.000 0.000 -8.754) 8.754 19.668 ( 0.000 0.000 -5.794) 5.794 27.516 ( 0.000 0.000 6.252) 6.252 27.592 ( 0.000 0.000 6.224) 6.224 28.659 ( 0.000 0.000 -4.190) 4.190 28.724 ( 0.000 0.000 -4.472) 4.472 29.800 ( 0.000 0.000 5.278) 5.278 30.747 ( 0.000 0.000 -4.311) 4.311 32.200 ( 0.000 0.000 -6.796) 6.796 32.222 ( 0.000 0.000 -2.175) 2.175 85.898 ( 0.000 0.000 1.033) 1.033 86.102 ( 0.000 0.000 8.705) 8.705 87.246 ( 0.000 0.000 29.182) 29.182 90.664 ( 0.000 0.000 -11.725) 11.725 ======================= Grid point 171 (56/162) ======================= q-point: ( 0.20 0.00 0.18) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 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| 1.687 ( 21.241 0.000 29.734) 36.541 1.837 ( 19.424 0.000 29.636) 35.434 3.050 ( 28.038 0.000 54.300) 61.111 3.415 ( -29.000 0.000 7.639) 29.989 3.444 ( -16.181 0.000 21.544) 26.943 4.407 ( 20.305 0.000 -0.520) 20.311 5.158 ( -5.122 0.000 -3.881) 6.427 5.237 ( -1.055 0.000 -2.835) 3.025 6.380 ( -22.119 0.000 6.610) 23.086 6.923 ( -12.167 0.000 -0.847) 12.196 7.611 ( 20.601 0.000 -2.216) 20.720 8.118 ( 7.977 0.000 -1.069) 8.048 8.381 ( 0.887 0.000 -0.288) 0.932 8.462 ( -1.021 0.000 -1.143) 1.532 9.122 ( 0.359 0.000 0.079) 0.368 9.146 ( -0.217 0.000 -0.225) 0.313 9.312 ( -6.674 0.000 11.583) 13.368 9.373 ( -11.744 0.000 14.384) 18.569 10.318 ( 21.610 0.000 -19.322) 28.989 10.691 ( 1.001 0.000 -6.454) 6.531 11.249 ( -1.278 0.000 -5.706) 5.847 11.472 ( -7.474 0.000 -8.214) 11.105 12.038 ( 19.791 0.000 -7.222) 21.067 12.080 ( 0.373 0.000 0.095) 0.385 12.101 ( -0.080 0.000 -0.166) 0.185 12.184 ( -0.143 0.000 -0.198) 0.244 12.186 ( -0.143 0.000 -0.178) 0.228 13.042 ( -4.429 0.000 -23.438) 23.853 14.371 ( 3.159 0.000 12.171) 12.574 14.563 ( -3.321 0.000 -8.371) 9.006 14.874 ( 13.556 0.000 -6.094) 14.863 15.984 ( -21.496 0.000 7.353) 22.718 17.129 ( 21.780 0.000 36.466) 42.475 18.218 ( -5.066 0.000 8.131) 9.580 19.150 ( -3.794 0.000 -9.981) 10.678 19.456 ( -16.367 0.000 -2.440) 16.548 27.523 ( 0.682 0.000 6.249) 6.286 27.584 ( -0.744 0.000 6.225) 6.270 28.665 ( 0.651 0.000 -4.216) 4.266 28.718 ( -0.588 0.000 -4.444) 4.483 30.057 ( 20.807 0.000 -6.603) 21.830 30.725 ( -2.404 0.000 -5.809) 6.287 32.195 ( -0.318 0.000 -5.403) 5.412 32.221 ( -0.323 0.000 -3.308) 3.324 85.892 ( -0.231 0.000 2.325) 2.336 86.051 ( -4.316 0.000 6.931) 8.165 87.460 ( 20.542 0.000 29.892) 36.270 89.968 ( -58.033 0.000 16.137) 60.235 ======================= Grid point 172 (57/162) ======================= q-point: ( 0.40 0.00 0.18) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 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| 2.209 ( 30.196 0.000 20.057) 36.251 2.312 ( 27.572 0.000 19.933) 34.022 2.820 ( -31.418 0.000 12.629) 33.861 2.868 ( -27.869 0.000 17.707) 33.018 3.943 ( 46.641 0.000 39.275) 60.974 4.757 ( 15.385 0.000 -2.068) 15.523 4.828 ( -39.180 0.000 18.712) 43.419 5.008 ( -10.259 0.000 -3.214) 10.751 6.301 ( 12.051 0.000 3.489) 12.546 6.623 ( -17.501 0.000 -0.737) 17.517 7.954 ( 15.203 0.000 -6.381) 16.488 8.176 ( -5.093 0.000 -6.025) 7.889 8.405 ( 1.491 0.000 -0.532) 1.583 8.436 ( -1.573 0.000 -0.857) 1.791 9.131 ( 0.498 0.000 -0.037) 0.500 9.140 ( -0.412 0.000 -0.151) 0.439 9.233 ( -1.551 0.000 15.628) 15.705 9.246 ( -1.669 0.000 14.801) 14.895 10.588 ( 7.100 0.000 -16.966) 18.392 10.670 ( -2.644 0.000 -12.017) 12.305 11.254 ( 1.942 0.000 -7.527) 7.773 11.329 ( -5.930 0.000 -9.713) 11.380 12.089 ( 0.494 0.000 0.021) 0.495 12.097 ( -0.307 0.000 -0.080) 0.317 12.182 ( -0.053 0.000 -0.199) 0.206 12.183 ( -0.130 0.000 -0.192) 0.231 12.475 ( 22.463 0.000 -16.134) 27.657 12.854 ( -15.088 0.000 -21.526) 26.287 14.441 ( 3.529 0.000 3.183) 4.752 14.504 ( -2.940 0.000 -3.824) 4.824 15.190 ( 17.966 0.000 -3.185) 18.246 15.565 ( -20.462 0.000 1.871) 20.547 17.584 ( 23.552 0.000 40.406) 46.769 18.001 ( -17.426 0.000 33.235) 37.527 19.101 ( 0.652 0.000 -13.370) 13.386 19.198 ( -9.031 0.000 -9.925) 13.419 27.541 ( 1.131 0.000 6.240) 6.342 27.565 ( -1.169 0.000 6.231) 6.340 28.682 ( 1.018 0.000 -4.285) 4.404 28.703 ( -0.980 0.000 -4.372) 4.481 30.428 ( 15.070 0.000 -13.073) 19.950 30.638 ( -6.974 0.000 -9.770) 12.004 32.195 ( 0.422 0.000 -4.402) 4.422 32.208 ( -0.806 0.000 -3.987) 4.067 85.905 ( 1.894 0.000 3.591) 4.060 85.965 ( -4.003 0.000 4.513) 6.033 88.007 ( 35.040 0.000 33.229) 48.291 88.846 ( -51.258 0.000 34.760) 61.933 ======================= Grid point 175 (58/162) ======================= q-point: ( 0.00 0.06 0.18) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 264 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.823 ( 0.000 18.867 33.507) 38.454 1.932 ( 0.000 33.070 32.867) 46.625 3.000 ( 0.000 33.578 52.201) 62.068 3.720 ( 0.000 5.891 19.390) 20.265 4.141 ( 0.000 23.166 10.621) 25.484 4.263 ( 0.000 22.465 -3.042) 22.671 5.206 ( 0.000 6.273 -5.505) 8.346 5.537 ( 0.000 29.381 -5.816) 29.951 6.841 ( 0.000 5.152 -12.670) 13.677 7.062 ( 0.000 1.869 4.165) 4.566 7.234 ( 0.000 -1.706 10.847) 10.980 8.008 ( 0.000 -1.182 -1.291) 1.750 8.516 ( 0.000 4.023 0.074) 4.023 8.603 ( 0.000 15.173 -2.960) 15.460 9.102 ( 0.000 0.661 1.000) 1.198 9.225 ( 0.000 7.441 -0.961) 7.503 9.434 ( 0.000 1.222 14.912) 14.962 9.768 ( 0.000 12.341 -10.100) 15.947 9.926 ( 0.000 2.235 1.935) 2.957 10.626 ( 0.000 -3.667 -1.986) 4.170 11.260 ( 0.000 -1.054 -6.490) 6.575 11.450 ( 0.000 -8.504 -3.706) 9.277 11.708 ( 0.000 -7.518 -3.368) 8.238 11.958 ( 0.000 -10.331 1.426) 10.429 12.199 ( 0.000 9.448 -0.708) 9.474 12.382 ( 0.000 16.232 -2.763) 16.466 12.441 ( 0.000 20.513 -7.913) 21.987 13.231 ( 0.000 12.878 -19.516) 23.382 14.333 ( 0.000 -0.263 12.325) 12.328 14.614 ( 0.000 -1.150 -15.181) 15.224 14.658 ( 0.000 -4.750 -3.620) 5.972 16.172 ( 0.000 -10.055 7.421) 12.497 16.869 ( 0.000 2.455 32.749) 32.841 18.196 ( 0.000 -6.121 -4.366) 7.519 19.085 ( 0.000 -10.771 -8.105) 13.480 19.402 ( 0.000 -22.731 0.829) 22.746 27.603 ( 0.000 8.640 6.009) 10.525 27.868 ( 0.000 23.121 -3.398) 23.369 28.685 ( 0.000 2.673 -3.623) 4.502 28.758 ( 0.000 3.354 -4.113) 5.307 29.845 ( 0.000 4.598 4.768) 6.624 30.743 ( 0.000 -0.301 -4.263) 4.274 32.158 ( 0.000 -4.198 -6.322) 7.589 32.191 ( 0.000 -3.122 -2.171) 3.803 85.893 ( 0.000 -0.449 0.977) 1.075 86.058 ( 0.000 -4.242 8.557) 9.551 87.183 ( 0.000 -6.270 28.069) 28.760 89.774 ( 0.000 -72.827 23.985) 76.675 ======================= Grid point 176 (59/162) ======================= q-point: ( 0.20 0.06 0.18) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 440 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.970 ( 14.610 15.587 26.914) 34.362 2.116 ( 17.691 30.838 29.246) 46.036 3.295 ( 17.262 26.527 39.193) 50.376 3.501 ( -8.808 9.043 23.791) 26.933 3.695 ( -26.779 24.461 11.212) 37.963 4.648 ( 20.353 22.199 -0.667) 30.124 5.276 ( 1.774 8.925 -3.216) 9.652 5.480 ( -7.033 27.041 -4.494) 28.299 6.416 ( -22.219 4.766 6.530) 23.644 6.936 ( -12.083 1.920 -0.210) 12.236 7.603 ( 20.451 -0.737 -2.878) 20.666 8.078 ( 5.415 -3.307 -1.708) 6.571 8.517 ( 0.165 4.772 0.108) 4.776 8.575 ( -2.451 14.430 -1.798) 14.747 9.080 ( -1.554 -1.523 4.870) 5.334 9.234 ( 1.120 8.601 -0.972) 8.728 9.316 ( -7.521 0.341 12.952) 14.982 9.507 ( -10.184 11.217 7.392) 16.857 10.341 ( 20.411 2.251 -16.937) 26.618 10.660 ( 1.911 -3.030 -5.611) 6.657 11.234 ( -1.700 -1.253 -5.636) 6.019 11.393 ( -5.420 -6.490 -7.045) 11.006 11.769 ( 5.629 -13.096 -1.709) 14.357 11.962 ( 0.135 -10.372 1.111) 10.433 12.209 ( 1.063 9.568 -0.804) 9.660 12.335 ( -2.895 14.308 -2.779) 14.860 12.546 ( 9.051 21.630 -8.933) 25.091 13.205 ( -3.802 13.096 -19.998) 24.205 14.368 ( 3.174 -0.249 8.224) 8.819 14.548 ( -3.056 -1.495 -9.262) 9.867 14.821 ( 12.673 -5.161 -6.771) 15.267 15.908 ( -20.614 -7.806 5.813) 22.796 17.127 ( 20.609 -0.019 34.458) 40.151 18.161 ( -4.617 -5.680 7.169) 10.246 19.038 ( -4.122 -11.205 -8.960) 14.927 19.265 ( -10.927 -17.016 -0.905) 20.243 27.615 ( 1.222 9.112 5.944) 10.948 27.804 ( -5.024 19.401 0.927) 20.062 28.693 ( 0.694 2.722 -3.701) 4.647 28.750 ( -0.713 3.158 -4.017) 5.159 30.074 ( 18.827 2.013 -4.869) 19.550 30.719 ( -2.561 -0.439 -5.555) 6.133 32.156 ( -0.097 -3.915 -5.517) 6.765 32.186 ( -0.498 -3.348 -2.721) 4.343 85.886 ( -0.317 -0.546 2.296) 2.381 86.019 ( -3.344 -3.046 6.528) 7.942 87.369 ( 17.912 -8.893 28.998) 35.225 89.330 ( -38.762 -54.499 32.760) 74.470 ======================= Grid point 177 (60/162) ======================= q-point: ( 0.40 0.06 0.18) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 440 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.362 ( 24.062 9.922 17.652) 31.448 2.554 ( 23.586 24.419 21.421) 40.143 2.926 ( -24.561 11.206 15.657) 31.208 3.149 ( -28.361 26.024 17.133) 42.133 4.134 ( 43.988 21.003 33.809) 59.322 4.954 ( -28.318 14.131 13.918) 34.574 5.014 ( 8.251 23.676 -1.203) 25.101 5.268 ( -11.090 24.629 -3.746) 27.269 6.326 ( 11.347 3.799 4.319) 12.722 6.638 ( -17.238 2.445 0.226) 17.412 7.924 ( 13.135 -2.298 -5.911) 14.586 8.108 ( -4.346 -5.092 -5.012) 8.363 8.519 ( 0.080 6.727 -0.460) 6.744 8.533 ( -1.453 10.301 -0.518) 10.416 9.090 ( 2.945 -2.039 9.408) 10.067 9.176 ( -5.557 1.421 8.185) 9.995 9.299 ( 4.050 8.452 4.533) 10.411 9.381 ( -4.161 11.279 6.867) 13.845 10.597 ( 6.533 0.903 -14.814) 16.216 10.662 ( -1.470 -0.718 -10.851) 10.974 11.226 ( 1.122 -2.539 -7.315) 7.825 11.282 ( -4.723 -4.138 -9.138) 11.088 11.883 ( 4.970 -15.671 -0.717) 16.456 11.949 ( -1.815 -12.308 0.384) 12.447 12.239 ( 1.898 10.039 -1.121) 10.278 12.282 ( -2.480 11.589 -1.748) 11.979 12.779 ( 14.107 19.085 -13.595) 27.350 13.049 ( -11.960 14.805 -18.044) 26.226 14.437 ( 3.415 -0.344 0.283) 3.444 14.495 ( -2.644 -0.798 -5.659) 6.297 15.124 ( 17.596 -6.547 -3.693) 19.135 15.496 ( -20.349 -6.949 0.936) 21.523 17.562 ( 22.591 -2.036 37.080) 43.468 17.960 ( -16.407 -4.133 29.861) 34.322 18.989 ( 0.856 -10.984 -12.532) 16.686 19.077 ( -7.488 -11.540 -9.469) 16.701 27.651 ( 2.457 10.705 5.635) 12.345 27.713 ( -3.916 14.000 4.523) 15.224 28.710 ( 1.075 2.815 -3.817) 4.863 28.732 ( -1.060 2.945 -3.925) 5.020 30.420 ( 14.567 -0.431 -10.973) 18.243 30.629 ( -7.135 -0.719 -8.807) 11.357 32.159 ( 0.455 -3.637 -4.361) 5.696 32.173 ( -0.817 -3.549 -3.519) 5.064 85.897 ( 1.655 -0.814 3.423) 3.889 85.949 ( -3.411 -1.555 4.156) 5.597 87.841 ( 29.709 -15.826 32.682) 46.917 88.523 ( -39.639 -29.570 36.922) 61.717 ======================= Grid point 180 (61/162) ======================= q-point: ( 0.00 0.12 0.18) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 267 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.310 ( 0.000 29.641 23.708) 37.956 2.448 ( 0.000 22.331 35.972) 42.340 3.892 ( 0.000 11.601 15.228) 19.144 4.030 ( 0.000 65.143 28.059) 70.929 4.674 ( 0.000 28.383 12.871) 31.165 4.701 ( 0.000 17.463 -4.599) 18.058 5.484 ( 0.000 23.093 1.238) 23.126 6.255 ( 0.000 39.972 -9.672) 41.126 7.019 ( 0.000 13.172 -12.061) 17.860 7.147 ( 0.000 3.623 -3.765) 5.225 7.235 ( 0.000 8.480 14.620) 16.901 7.983 ( 0.000 -1.148 -2.530) 2.778 8.607 ( 0.000 4.791 2.375) 5.347 8.783 ( 0.000 5.198 5.358) 7.465 9.145 ( 0.000 1.008 1.740) 2.011 9.413 ( 0.000 10.967 -2.501) 11.249 9.533 ( 0.000 9.921 8.456) 13.036 9.990 ( 0.000 4.047 4.809) 6.285 10.000 ( 0.000 10.234 -8.021) 13.003 10.539 ( 0.000 -4.485 -3.119) 5.463 11.245 ( 0.000 -0.306 -5.268) 5.277 11.279 ( 0.000 -8.906 -8.133) 12.061 11.574 ( 0.000 -5.966 -1.776) 6.225 11.762 ( 0.000 -8.804 3.710) 9.554 12.449 ( 0.000 15.555 -1.291) 15.609 12.740 ( 0.000 19.510 -3.914) 19.899 12.786 ( 0.000 12.533 -7.281) 14.494 13.457 ( 0.000 8.574 -11.374) 14.244 14.335 ( 0.000 0.645 0.911) 1.117 14.527 ( 0.000 -8.384 -1.773) 8.569 14.582 ( 0.000 -2.124 -18.897) 19.016 15.902 ( 0.000 -16.854 3.445) 17.202 16.937 ( 0.000 4.274 27.656) 27.985 18.022 ( 0.000 -11.537 -3.871) 12.169 18.790 ( 0.000 -18.863 -6.499) 19.951 18.942 ( 0.000 -22.315 2.426) 22.446 27.835 ( 0.000 14.449 5.340) 15.404 28.317 ( 0.000 20.829 -8.616) 22.540 28.759 ( 0.000 4.756 -2.127) 5.210 28.851 ( 0.000 6.138 -3.014) 6.838 29.977 ( 0.000 8.807 3.472) 9.467 30.742 ( 0.000 0.431 -4.177) 4.199 32.043 ( 0.000 -7.325 -5.103) 8.928 32.105 ( 0.000 -5.590 -2.167) 5.995 85.881 ( 0.000 -0.777 0.812) 1.123 85.958 ( 0.000 -5.356 7.453) 9.178 87.016 ( 0.000 -10.360 24.994) 27.056 88.428 ( 0.000 -58.752 42.760) 72.665 ======================= Grid point 181 (62/162) ======================= q-point: ( 0.20 0.12 0.18) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 441 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.367 ( 8.337 24.591 21.732) 33.860 2.663 ( 18.221 25.080 30.667) 43.606 3.644 ( -21.614 12.811 13.729) 28.632 4.190 ( -7.994 37.535 13.783) 40.777 4.292 ( 3.856 48.880 26.538) 55.753 5.085 ( 19.741 17.646 -2.394) 26.586 5.603 ( 7.318 25.743 -0.658) 26.771 6.145 ( -12.963 36.572 -6.072) 39.273 6.613 ( -17.935 15.574 2.893) 23.929 7.058 ( -10.686 13.963 2.961) 17.831 7.595 ( 19.275 0.499 -4.776) 19.864 8.017 ( 2.437 -2.418 -2.596) 4.304 8.607 ( 0.175 3.466 1.500) 3.781 8.787 ( -0.347 7.464 4.181) 8.562 9.100 ( -4.216 1.914 3.255) 5.660 9.341 ( -7.849 4.712 11.879) 14.997 9.473 ( 0.296 13.751 -1.408) 13.826 9.742 ( -7.566 12.231 4.286) 15.007 10.395 ( 17.912 2.901 -10.753) 21.092 10.588 ( 3.787 -3.746 -4.236) 6.805 11.212 ( -2.743 -0.788 -4.811) 5.594 11.256 ( -2.617 -7.231 -8.282) 11.302 11.561 ( 0.401 -8.433 -1.647) 8.601 11.768 ( -0.256 -8.498 2.836) 8.962 12.462 ( 1.364 15.637 -1.435) 15.762 12.665 ( -4.757 17.798 -4.559) 18.979 12.889 ( 7.645 12.678 -5.926) 15.946 13.431 ( -3.657 8.314 -11.511) 14.663 14.368 ( 3.019 0.326 -1.375) 3.334 14.500 ( -1.337 -3.719 -8.370) 9.256 14.690 ( 9.722 -7.493 -10.592) 16.213 15.688 ( -18.120 -14.180 1.972) 23.093 17.137 ( 17.175 1.024 28.391) 33.198 18.001 ( -3.148 -10.608 4.588) 11.979 18.738 ( -4.018 -18.589 -6.955) 20.250 18.894 ( -4.505 -19.599 -1.872) 20.197 27.857 ( 2.311 14.978 5.163) 16.011 28.216 ( -8.534 20.777 -3.591) 22.747 28.767 ( 0.779 4.797 -2.301) 5.377 28.837 ( -1.165 5.634 -2.737) 6.371 30.147 ( 14.437 5.622 -2.233) 15.653 30.716 ( -2.758 0.382 -5.001) 5.724 32.046 ( 0.335 -7.081 -4.723) 8.519 32.096 ( -0.797 -5.736 -2.326) 6.240 85.871 ( -0.525 -1.021 2.368) 2.632 85.947 ( -1.289 -3.922 4.992) 6.478 87.141 ( 12.152 -13.620 26.175) 31.911 88.254 ( -16.341 -50.085 40.907) 66.700 ======================= Grid point 182 (63/162) ======================= q-point: ( 0.40 0.12 0.18) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 441 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.645 ( 19.154 19.282 15.127) 31.105 2.989 ( -1.041 20.026 15.131) 25.120 3.277 ( 1.358 21.640 22.881) 31.523 3.699 ( -27.159 26.756 20.036) 43.068 4.808 ( 32.471 46.826 21.022) 60.737 5.355 ( -8.124 23.991 4.921) 25.803 5.577 ( 0.832 31.072 -3.706) 31.303 5.814 ( -14.604 26.446 -2.768) 30.337 6.541 ( 8.524 20.448 5.012) 22.714 6.797 ( -14.857 17.281 4.110) 23.158 7.884 ( 10.628 -1.598 -6.084) 12.350 8.021 ( -3.207 -3.364 -4.253) 6.300 8.633 ( 2.979 4.025 0.226) 5.013 8.724 ( -5.534 7.712 0.129) 9.493 9.084 ( 3.820 1.889 11.913) 12.652 9.198 ( -6.801 2.392 14.175) 15.903 9.537 ( 5.022 14.178 -1.452) 15.111 9.634 ( -4.644 13.870 2.108) 14.778 10.620 ( 5.101 1.440 -9.714) 11.066 10.644 ( 1.474 -0.974 -8.029) 8.221 11.172 ( -0.708 -2.784 -6.184) 6.819 11.193 ( -2.776 -4.667 -9.069) 10.571 11.625 ( 5.454 -10.326 -0.368) 11.684 11.727 ( -4.062 -9.271 1.428) 10.222 12.504 ( 2.852 16.059 -2.005) 16.433 12.574 ( -4.274 16.961 -3.162) 17.775 13.074 ( 10.969 10.183 -7.125) 16.577 13.291 ( -10.176 8.472 -9.733) 16.433 14.432 ( 2.944 -0.204 -6.182) 6.850 14.475 ( -1.537 -1.297 -9.021) 9.243 14.949 ( 16.256 -10.778 -5.618) 20.298 15.305 ( -19.628 -12.181 -1.652) 23.159 17.510 ( 19.479 -3.228 28.453) 34.633 17.845 ( -13.329 -7.511 21.508) 26.394 18.704 ( 1.685 -17.210 -10.907) 20.445 18.787 ( -5.730 -17.201 -8.429) 19.994 27.926 ( 4.835 16.561 4.378) 17.799 28.049 ( -7.664 18.940 2.013) 20.531 28.787 ( 1.209 4.899 -2.503) 5.633 28.812 ( -1.308 5.126 -2.626) 5.906 30.430 ( 12.781 1.828 -7.107) 14.738 30.624 ( -7.054 0.511 -6.796) 9.808 32.058 ( 0.804 -6.570 -3.812) 7.638 32.077 ( -1.091 -6.091 -2.884) 6.828 85.876 ( 1.157 -1.285 2.989) 3.453 85.911 ( -2.114 -2.158 3.113) 4.338 87.457 ( 19.266 -21.767 29.876) 41.684 87.865 ( -21.591 -34.282 35.678) 53.985 ======================= Grid point 185 (64/162) ======================= q-point: ( 0.00 0.19 0.18) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 264 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.902 ( 0.000 24.925 26.510) 36.387 2.940 ( 0.000 34.130 15.792) 37.606 4.162 ( 0.000 15.740 10.219) 18.767 4.932 ( 0.000 8.445 -6.616) 10.728 5.110 ( 0.000 23.100 9.065) 24.815 5.392 ( 0.000 63.676 20.602) 66.926 5.948 ( 0.000 18.728 11.528) 21.991 6.879 ( 0.000 15.779 -12.449) 20.098 7.230 ( 0.000 16.803 -1.193) 16.845 7.317 ( 0.000 15.250 -7.056) 16.804 7.734 ( 0.000 36.660 1.590) 36.695 7.976 ( 0.000 0.768 -3.965) 4.039 8.693 ( 0.000 4.534 5.100) 6.824 8.895 ( 0.000 5.569 7.652) 9.464 9.141 ( 0.000 1.917 4.085) 4.513 9.628 ( 0.000 10.733 -3.656) 11.338 9.782 ( 0.000 14.280 2.483) 14.494 10.069 ( 0.000 3.912 5.473) 6.727 10.169 ( 0.000 8.038 -1.483) 8.174 10.492 ( 0.000 0.742 -3.748) 3.820 11.108 ( 0.000 -8.520 -9.012) 12.402 11.242 ( 0.000 -0.644 -1.233) 1.391 11.486 ( 0.000 -2.316 -4.201) 4.797 11.623 ( 0.000 -5.547 2.852) 6.237 12.776 ( 0.000 17.150 -1.349) 17.202 12.917 ( 0.000 1.710 1.857) 2.525 13.112 ( 0.000 17.878 -2.793) 18.095 13.548 ( 0.000 1.226 -2.858) 3.110 14.346 ( 0.000 -9.598 0.678) 9.622 14.347 ( 0.000 -0.151 -9.440) 9.441 14.539 ( 0.000 -1.819 -19.974) 20.056 15.548 ( 0.000 -18.521 -1.714) 18.600 17.021 ( 0.000 3.886 19.810) 20.188 17.754 ( 0.000 -15.635 -3.229) 15.965 18.371 ( 0.000 -23.489 -4.504) 23.917 18.551 ( 0.000 -18.086 -2.062) 18.203 28.143 ( 0.000 16.536 4.309) 17.088 28.658 ( 0.000 14.155 -6.695) 15.659 28.866 ( 0.000 6.089 -0.218) 6.093 28.993 ( 0.000 8.207 -1.195) 8.293 30.182 ( 0.000 11.991 1.948) 12.148 30.767 ( 0.000 2.259 -4.117) 4.696 31.883 ( 0.000 -8.832 -3.557) 9.522 31.979 ( 0.000 -7.035 -2.058) 7.330 85.864 ( 0.000 -0.898 0.554) 1.055 85.866 ( 0.000 -3.893 5.185) 6.484 86.797 ( 0.000 -11.634 20.653) 23.705 87.507 ( 0.000 -37.098 34.265) 50.501 ======================= Grid point 186 (65/162) ======================= q-point: ( 0.20 0.19 0.18) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 440 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.896 ( 4.812 28.773 16.819) 33.674 3.166 ( 16.838 27.406 21.630) 38.761 3.938 ( -18.849 17.244 9.430) 27.232 4.653 ( -23.200 17.675 11.296) 31.277 5.324 ( 17.108 9.683 -2.536) 19.821 5.508 ( 12.112 63.151 17.758) 66.709 6.080 ( 6.881 17.168 3.507) 18.825 6.841 ( -11.902 35.656 -8.428) 38.523 6.900 ( -7.913 11.611 4.255) 14.681 7.554 ( 0.890 24.440 -1.413) 24.497 7.693 ( 4.440 17.731 -2.750) 18.484 8.005 ( 1.544 2.483 -3.264) 4.383 8.643 ( -2.620 0.951 2.978) 4.079 8.909 ( -1.233 3.193 5.649) 6.605 9.143 ( 0.517 6.298 3.958) 7.456 9.496 ( -10.871 10.674 8.277) 17.338 9.744 ( 1.047 13.128 -2.293) 13.368 9.975 ( -4.231 11.857 2.661) 12.868 10.435 ( 15.135 1.135 -4.990) 15.977 10.561 ( 5.821 2.315 -3.160) 7.016 11.110 ( -0.077 -7.624 -8.948) 11.756 11.198 ( -4.218 -1.461 -0.302) 4.474 11.450 ( -1.213 -2.312 -4.268) 5.003 11.642 ( 0.357 -4.436 1.551) 4.713 12.786 ( 1.065 16.371 -1.242) 16.452 12.923 ( -0.213 5.257 0.203) 5.265 13.114 ( 1.227 14.018 -1.279) 14.129 13.515 ( -4.180 0.858 -2.760) 5.082 14.346 ( 2.375 -5.455 -2.836) 6.591 14.407 ( 3.067 -3.542 -7.412) 8.768 14.573 ( 4.129 -3.786 -17.989) 18.841 15.382 ( -14.932 -16.324 -2.731) 22.291 17.157 ( 12.218 0.563 19.701) 23.189 17.753 ( -0.988 -14.571 1.899) 14.728 18.340 ( -2.057 -21.912 -6.063) 22.828 18.524 ( -2.964 -17.996 -3.874) 18.645 28.174 ( 3.132 16.819 4.059) 17.583 28.578 ( -7.382 16.063 -3.925) 18.109 28.874 ( 0.801 6.063 -0.418) 6.130 28.965 ( -2.141 7.332 -0.657) 7.667 30.295 ( 9.893 9.350 -0.965) 13.646 30.743 ( -2.582 2.443 -4.478) 5.717 31.891 ( 0.770 -8.611 -3.351) 9.272 31.969 ( -1.053 -7.157 -2.123) 7.539 85.845 ( -0.476 -1.675 3.065) 3.525 85.882 ( 0.227 -2.373 1.947) 3.079 86.865 ( 6.721 -14.095 21.695) 26.730 87.436 ( -6.926 -34.158 32.537) 47.680 ======================= Grid point 187 (66/162) ======================= q-point: ( 0.40 0.19 0.18) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 440 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.095 ( 14.921 26.069 10.651) 31.869 3.407 ( -8.799 23.266 8.254) 26.208 3.694 ( 11.752 21.347 22.347) 33.064 4.148 ( -26.677 19.864 19.486) 38.549 5.669 ( 16.352 9.497 -4.454) 19.428 5.806 ( 11.657 43.583 9.997) 46.210 6.088 ( 0.243 21.417 -3.621) 21.722 6.412 ( -23.682 41.148 4.796) 47.717 7.050 ( 14.469 26.984 6.233) 31.246 7.353 ( -14.778 33.350 5.639) 36.911 7.881 ( 8.597 2.528 -5.917) 10.738 7.995 ( -3.056 1.899 -3.849) 5.269 8.658 ( 4.537 -1.241 0.454) 4.725 8.797 ( -8.439 -0.499 0.640) 8.478 9.198 ( 5.014 10.911 8.982) 14.995 9.320 ( -7.302 10.896 12.330) 18.002 9.808 ( 4.654 12.915 -2.351) 13.928 9.898 ( -4.118 12.783 0.306) 13.434 10.636 ( 5.417 0.888 -7.061) 8.944 10.664 ( 2.845 3.459 -4.385) 6.267 11.098 ( -0.703 -5.305 -7.387) 9.122 11.115 ( -2.978 -3.301 -2.208) 4.964 11.495 ( 5.400 -2.576 -2.692) 6.560 11.604 ( -4.352 -3.241 -0.244) 5.432 12.822 ( 2.718 15.156 -1.413) 15.462 12.885 ( -3.230 12.809 -1.555) 13.301 13.200 ( 7.512 5.003 -0.009) 9.026 13.376 ( -9.248 1.172 -1.356) 9.420 14.410 ( 2.944 -3.015 -7.211) 8.352 14.439 ( 0.052 -2.387 -9.565) 9.859 14.737 ( 12.888 -9.722 -10.331) 19.166 15.047 ( -17.679 -13.374 -5.316) 22.796 17.429 ( 14.179 -5.484 18.174) 23.694 17.665 ( -8.762 -11.123 12.590) 18.948 18.344 ( 3.078 -19.264 -9.210) 21.573 18.437 ( -5.412 -17.973 -7.355) 20.160 28.265 ( 6.210 17.466 3.047) 18.786 28.413 ( -8.582 17.677 0.513) 19.657 28.896 ( 1.330 6.069 -0.608) 6.243 28.926 ( -1.750 6.359 -0.614) 6.624 30.501 ( 9.929 5.460 -4.310) 12.123 30.659 ( -6.112 3.268 -5.037) 8.568 31.912 ( 1.385 -8.080 -2.860) 8.682 31.942 ( -1.562 -7.525 -2.382) 8.046 85.850 ( 0.904 -1.297 2.356) 2.837 85.872 ( -1.078 -1.660 1.665) 2.586 87.041 ( 10.650 -20.053 24.477) 33.387 87.257 ( -10.745 -27.403 28.533) 40.994 ======================= Grid point 190 (67/162) ======================= q-point: ( 0.00 0.25 0.18) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 267 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.415 ( 0.000 27.156 13.666) 30.401 3.621 ( 0.000 35.196 10.343) 36.684 4.496 ( 0.000 18.220 5.816) 19.126 5.085 ( 0.000 7.762 -7.634) 10.886 5.413 ( 0.000 10.991 7.147) 13.111 6.161 ( 0.000 4.826 14.490) 15.272 6.589 ( 0.000 53.752 13.103) 55.326 6.895 ( 0.000 -6.082 -6.724) 9.067 7.541 ( 0.000 7.713 1.172) 7.801 7.839 ( 0.000 34.973 -8.753) 36.051 8.012 ( 0.000 2.120 -4.767) 5.217 8.298 ( 0.000 13.903 -6.953) 15.545 8.869 ( 0.000 14.560 12.085) 18.922 8.899 ( 0.000 -2.828 11.753) 12.089 9.348 ( 0.000 16.001 -4.642) 16.661 9.842 ( 0.000 11.597 -4.284) 12.363 10.047 ( 0.000 11.205 2.939) 11.584 10.194 ( 0.000 11.853 -0.596) 11.868 10.405 ( 0.000 19.583 0.305) 19.585 10.567 ( 0.000 6.067 -1.717) 6.306 10.950 ( 0.000 -7.436 -5.616) 9.318 11.195 ( 0.000 -3.909 3.312) 5.123 11.516 ( 0.000 5.328 -8.722) 10.221 11.543 ( 0.000 -2.573 -0.377) 2.601 12.899 ( 0.000 -2.241 7.486) 7.814 13.088 ( 0.000 14.106 -0.676) 14.122 13.413 ( 0.000 12.412 -0.191) 12.414 13.539 ( 0.000 -1.309 1.878) 2.289 14.180 ( 0.000 -6.469 2.635) 6.985 14.307 ( 0.000 -3.843 -13.031) 13.586 14.521 ( 0.000 -0.341 -17.479) 17.482 15.211 ( 0.000 -15.318 -6.297) 16.561 17.068 ( 0.000 0.394 11.747) 11.753 17.423 ( 0.000 -17.850 -2.679) 18.050 17.892 ( 0.000 -25.189 -2.356) 25.299 18.217 ( 0.000 -16.656 -5.380) 17.503 28.460 ( 0.000 15.555 2.959) 15.834 28.878 ( 0.000 8.708 -4.248) 9.689 28.992 ( 0.000 6.729 1.532) 6.901 29.163 ( 0.000 8.920 0.681) 8.946 30.434 ( 0.000 13.546 0.718) 13.565 30.831 ( 0.000 4.206 -4.011) 5.812 31.709 ( 0.000 -8.724 -2.032) 8.957 31.838 ( 0.000 -7.290 -1.695) 7.484 85.810 ( 0.000 -1.794 2.826) 3.347 85.847 ( 0.000 -0.779 0.253) 0.819 86.575 ( 0.000 -10.807 15.866) 19.197 86.921 ( 0.000 -24.109 22.656) 33.084 ======================= Grid point 191 (68/162) ======================= q-point: ( 0.20 0.25 0.18) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 441 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.462 ( 5.255 28.680 10.102) 30.857 3.740 ( 11.211 31.140 12.212) 35.278 4.307 ( -15.562 20.283 5.044) 26.058 4.937 ( -18.380 12.292 7.257) 23.272 5.470 ( 11.465 6.439 -2.307) 13.351 6.246 ( 0.148 3.676 2.600) 4.505 6.662 ( 8.885 48.211 12.359) 50.557 6.981 ( 10.259 0.223 3.875) 10.969 7.473 ( -6.466 19.735 -2.277) 20.892 7.893 ( 2.201 22.851 -4.940) 23.482 7.970 ( -2.207 5.340 -4.040) 7.050 8.295 ( -0.411 15.444 -3.845) 15.921 8.701 ( -10.678 6.816 10.646) 16.548 8.884 ( -4.827 -2.379 4.777) 7.196 9.415 ( 4.894 18.296 -1.213) 18.978 9.771 ( -7.106 17.640 4.089) 19.452 9.958 ( 0.254 8.278 -0.662) 8.308 10.235 ( -3.643 15.570 -1.151) 16.032 10.516 ( 11.721 10.206 -3.502) 15.931 10.675 ( 7.952 9.133 -2.139) 12.297 10.963 ( 1.126 -7.231 -5.087) 8.912 11.143 ( -4.709 -3.498 2.906) 6.546 11.479 ( -0.393 4.588 -6.974) 8.357 11.598 ( 2.289 0.394 -2.441) 3.369 12.908 ( 1.235 -2.433 7.030) 7.541 13.089 ( -0.206 11.953 0.228) 11.957 13.390 ( -1.967 12.329 -0.973) 12.523 13.506 ( -3.731 -0.342 1.259) 3.953 14.194 ( 2.988 -7.379 1.534) 8.108 14.349 ( 2.769 -3.703 -10.578) 11.544 14.532 ( 1.451 -1.091 -17.256) 17.352 15.084 ( -11.779 -13.522 -6.682) 19.137 17.133 ( 6.089 -3.742 11.224) 13.306 17.444 ( 0.959 -16.575 0.732) 16.619 17.895 ( 1.201 -23.153 -4.387) 23.596 18.190 ( -2.899 -16.563 -5.821) 17.794 28.493 ( 3.351 15.533 2.669) 16.113 28.837 ( -4.210 10.470 -3.358) 11.774 29.000 ( 0.706 6.632 1.430) 6.821 29.120 ( -3.544 8.426 1.555) 9.272 30.503 ( 6.176 11.635 -0.723) 13.193 30.812 ( -1.974 4.577 -4.054) 6.425 31.721 ( 1.142 -8.557 -1.972) 8.856 31.825 ( -1.284 -7.396 -1.702) 7.697 85.813 ( 0.467 -1.212 2.296) 2.638 85.852 ( 0.238 -0.941 0.299) 1.016 86.605 ( 3.028 -12.319 16.544) 20.848 86.887 ( -3.407 -22.981 21.904) 31.930 ======================= Grid point 192 (69/162) ======================= q-point: ( 0.40 0.25 0.18) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 441 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.632 ( 12.035 28.246 5.392) 31.172 3.892 ( -9.336 26.070 3.075) 27.861 4.125 ( 11.377 22.925 16.249) 30.316 4.509 ( -22.668 17.788 14.904) 32.441 5.770 ( 16.928 3.053 -5.907) 18.187 6.084 ( -14.005 2.196 -5.704) 15.281 6.906 ( 14.100 42.620 10.080) 46.009 7.142 ( -5.202 23.406 11.728) 26.692 7.434 ( 11.738 14.439 -2.436) 18.767 7.741 ( -13.974 4.920 -1.100) 14.856 8.066 ( 7.706 17.865 0.132) 19.457 8.225 ( -7.486 20.707 3.127) 22.240 8.603 ( 2.575 -3.852 1.100) 4.762 8.735 ( -8.855 -4.556 -0.535) 9.972 9.515 ( 5.620 20.140 3.440) 21.190 9.636 ( -6.511 20.267 6.178) 22.166 10.026 ( 5.316 9.383 -1.591) 10.901 10.137 ( -5.645 12.381 -0.434) 13.614 10.721 ( 7.948 9.284 -7.677) 14.433 10.787 ( 1.844 9.932 -4.891) 11.223 10.986 ( 1.375 -5.783 -2.519) 6.456 11.043 ( -4.637 -3.582 1.553) 6.062 11.523 ( 4.326 4.947 -5.559) 8.607 11.600 ( -2.371 2.768 -3.428) 5.004 12.963 ( 4.491 -1.230 5.588) 7.274 13.056 ( -3.711 5.006 2.917) 6.881 13.363 ( 0.072 10.678 -1.652) 10.806 13.411 ( -4.615 4.734 -0.115) 6.612 14.301 ( 6.240 -7.197 -1.542) 9.649 14.374 ( -0.845 -4.480 -7.429) 8.716 14.603 ( 6.770 -4.298 -14.261) 16.361 14.815 ( -13.944 -9.782 -8.500) 19.036 17.276 ( 7.810 -10.622 9.630) 16.327 17.409 ( -4.901 -14.873 6.725) 17.042 17.970 ( 6.222 -18.629 -7.192) 20.916 18.100 ( -6.149 -16.621 -6.801) 18.982 28.588 ( 6.137 15.199 1.589) 16.468 28.722 ( -7.018 13.676 -0.696) 15.387 29.020 ( 1.409 6.563 1.451) 6.868 29.058 ( -2.536 7.072 1.761) 7.717 30.637 ( 6.800 8.297 -2.865) 11.103 30.750 ( -4.481 5.845 -3.895) 8.331 31.751 ( 1.920 -8.150 -1.845) 8.574 31.791 ( -2.008 -7.706 -1.743) 8.152 85.830 ( 1.068 -0.687 1.341) 1.847 85.848 ( -0.679 -0.762 0.558) 1.163 86.689 ( 5.235 -15.969 18.142) 24.729 86.797 ( -5.425 -19.974 20.111) 28.860 ======================= Grid point 195 (70/162) ======================= q-point: ( 0.00 0.31 0.18) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 264 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.944 ( 0.000 26.713 2.106) 26.795 4.300 ( 0.000 34.060 6.367) 34.650 4.860 ( 0.000 18.538 2.442) 18.698 5.241 ( 0.000 8.245 -8.787) 12.050 5.582 ( 0.000 7.001 2.995) 7.615 6.199 ( 0.000 -0.122 13.365) 13.365 6.719 ( 0.000 -11.796 -9.279) 15.009 7.286 ( 0.000 12.962 6.477) 14.490 7.734 ( 0.000 15.224 7.377) 16.917 8.003 ( 0.000 -4.554 -1.889) 4.930 8.217 ( 0.000 -0.617 -4.648) 4.689 8.560 ( 0.000 18.142 -6.329) 19.214 8.946 ( 0.000 10.941 8.384) 13.784 9.089 ( 0.000 8.600 8.365) 11.997 9.628 ( 0.000 12.061 -7.222) 14.058 10.006 ( 0.000 3.684 -0.060) 3.684 10.215 ( 0.000 7.320 4.625) 8.658 10.562 ( 0.000 15.747 -6.288) 16.956 10.736 ( 0.000 14.557 -0.490) 14.565 10.790 ( 0.000 -2.393 0.220) 2.403 10.980 ( 0.000 29.241 -4.464) 29.580 11.153 ( 0.000 3.589 0.362) 3.607 11.531 ( 0.000 1.740 -2.718) 3.228 11.672 ( 0.000 9.985 -10.131) 14.224 12.884 ( 0.000 2.298 7.885) 8.214 13.310 ( 0.000 8.531 1.046) 8.595 13.524 ( 0.000 0.379 5.135) 5.149 13.588 ( 0.000 5.968 1.882) 6.257 14.124 ( 0.000 0.821 3.528) 3.623 14.216 ( 0.000 -5.054 -13.031) 13.977 14.510 ( 0.000 -0.995 -13.541) 13.578 14.965 ( 0.000 -9.758 -8.836) 13.164 17.023 ( 0.000 -5.074 5.729) 7.653 17.073 ( 0.000 -17.528 -2.481) 17.703 17.403 ( 0.000 -24.405 -0.052) 24.405 17.884 ( 0.000 -17.736 -6.027) 18.732 28.739 ( 0.000 12.802 1.615) 12.903 29.013 ( 0.000 5.488 -2.348) 5.969 29.123 ( 0.000 6.439 2.559) 6.929 29.322 ( 0.000 6.899 1.646) 7.092 30.700 ( 0.000 13.356 0.010) 13.356 30.925 ( 0.000 5.273 -3.713) 6.449 31.550 ( 0.000 -7.411 -0.748) 7.449 31.701 ( 0.000 -6.604 -1.011) 6.681 85.793 ( 0.000 -0.073 1.278) 1.280 85.835 ( 0.000 -0.438 0.023) 0.439 86.382 ( 0.000 -8.907 11.261) 14.358 86.535 ( 0.000 -15.974 13.489) 20.908 ======================= Grid point 196 (71/162) ======================= q-point: ( 0.20 0.31 0.18) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 440 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 4.006 ( 6.165 26.998 1.317) 27.725 4.363 ( 6.206 32.132 7.005) 33.467 4.715 ( -12.019 21.114 1.176) 24.324 5.154 ( -12.263 10.210 2.181) 16.106 5.590 ( 6.898 5.941 -3.251) 9.667 6.263 ( -1.596 -0.936 1.111) 2.158 6.808 ( 12.928 -11.423 1.458) 17.313 7.344 ( 4.679 10.720 6.060) 13.173 7.730 ( -0.459 13.962 5.144) 14.887 7.941 ( -6.081 -4.412 -0.582) 7.536 8.283 ( 6.150 -0.940 -3.353) 7.067 8.544 ( -1.097 20.190 -4.755) 20.771 8.854 ( -8.840 6.550 3.742) 11.621 8.946 ( -11.463 13.563 8.398) 19.644 9.722 ( 6.861 11.417 -3.966) 13.898 10.054 ( 3.221 2.552 0.254) 4.117 10.112 ( -5.475 14.046 3.709) 15.525 10.535 ( -4.079 12.268 -3.565) 13.411 10.820 ( 4.096 -0.461 0.328) 4.135 10.843 ( 6.313 8.940 -0.463) 10.954 10.990 ( 1.738 23.948 -6.180) 24.793 11.149 ( -0.254 10.542 -2.059) 10.744 11.578 ( 4.320 5.546 -4.539) 8.368 11.696 ( 1.964 9.511 -8.819) 13.118 12.877 ( -0.035 1.043 8.180) 8.246 13.244 ( -6.440 4.187 3.707) 8.529 13.536 ( 0.580 4.520 1.529) 4.807 13.577 ( -0.996 6.154 0.958) 6.307 14.100 ( 0.514 -2.199 0.168) 2.264 14.272 ( 2.946 -3.638 -7.413) 8.768 14.509 ( 0.161 -1.598 -13.435) 13.531 14.869 ( -8.954 -8.443 -8.376) 14.887 16.982 ( -0.480 -12.067 3.856) 12.677 17.135 ( 1.287 -14.539 1.913) 14.721 17.458 ( 6.261 -20.964 -2.651) 22.039 17.861 ( -2.543 -17.482 -6.131) 18.699 28.769 ( 3.017 12.559 1.293) 12.980 28.998 ( -1.660 6.416 -2.281) 7.009 29.127 ( 0.507 6.271 2.639) 6.823 29.277 ( -4.036 7.145 2.438) 8.560 30.737 ( 3.415 12.044 -0.727) 12.540 30.915 ( -1.119 5.724 -3.582) 6.844 31.564 ( 1.381 -7.332 -0.779) 7.502 31.686 ( -1.462 -6.673 -0.992) 6.903 85.803 ( 0.975 0.130 1.023) 1.419 85.841 ( 0.392 -0.278 -0.099) 0.491 86.389 ( 0.801 -9.810 11.629) 15.235 86.515 ( -1.938 -15.522 13.316) 20.542 ======================= Grid point 197 (72/162) ======================= q-point: ( 0.40 0.31 0.18) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 440 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 4.177 ( 11.019 27.243 -0.152) 29.387 4.413 ( -10.772 26.950 -0.765) 29.033 4.586 ( 9.235 24.073 9.770) 27.572 4.855 ( -15.879 17.670 8.934) 25.381 5.815 ( 13.970 1.664 -7.046) 15.735 6.090 ( -13.166 -0.942 -6.745) 14.823 7.167 ( 19.119 -10.214 9.151) 23.528 7.396 ( -2.193 1.104 8.069) 8.434 7.718 ( -0.256 12.160 1.238) 12.225 7.784 ( -8.049 2.260 0.227) 8.363 8.435 ( 8.781 -2.659 -1.726) 9.336 8.545 ( 0.847 17.387 -1.590) 17.480 8.663 ( -7.940 4.878 -0.056) 9.319 8.721 ( -10.161 22.298 6.946) 25.469 9.846 ( 5.863 10.425 -0.702) 11.981 9.962 ( -6.140 9.013 1.485) 11.007 10.216 ( 9.102 12.057 0.680) 15.122 10.402 ( -8.976 13.785 -0.324) 16.453 10.886 ( 3.182 -4.130 1.225) 5.356 10.924 ( 0.242 -0.968 1.029) 1.433 11.061 ( 5.077 23.408 -8.909) 25.555 11.136 ( -1.843 19.890 -7.082) 21.194 11.671 ( 4.330 9.987 -6.746) 12.806 11.719 ( -0.343 9.744 -7.336) 12.202 12.920 ( 5.226 -0.907 8.205) 9.770 13.076 ( -9.637 -0.403 6.769) 11.783 13.542 ( 0.367 7.993 -1.669) 8.174 13.556 ( -1.005 7.496 -0.940) 7.622 14.175 ( 6.232 -5.055 -0.966) 8.082 14.279 ( -2.833 -4.672 -4.070) 6.813 14.539 ( 3.672 -2.815 -11.474) 12.371 14.671 ( -9.633 -5.382 -8.355) 13.841 17.018 ( 3.696 -15.045 4.217) 16.056 17.100 ( -3.896 -16.256 3.858) 17.156 17.623 ( 9.087 -17.140 -5.337) 20.121 17.777 ( -6.191 -16.904 -6.120) 19.014 28.850 ( 4.891 11.543 0.192) 12.538 28.942 ( -4.071 9.097 -1.490) 10.077 29.146 ( 1.546 6.125 2.976) 6.983 29.195 ( -3.620 6.709 3.308) 8.309 30.813 ( 3.941 9.413 -2.088) 10.416 30.879 ( -2.611 7.115 -3.095) 8.187 31.601 ( 2.281 -7.123 -0.855) 7.528 31.648 ( -2.332 -6.866 -0.937) 7.312 85.826 ( 1.194 0.361 0.415) 1.315 85.842 ( -0.357 0.156 -0.088) 0.400 86.417 ( 2.076 -11.984 12.341) 17.327 86.466 ( -2.772 -14.153 12.907) 19.354 ======================= Grid point 200 (73/162) ======================= q-point: ( 0.00 0.38 0.18) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 267 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 4.453 ( 0.000 25.436 -6.335) 26.213 4.925 ( 0.000 28.402 1.583) 28.446 5.191 ( 0.000 14.375 -0.907) 14.403 5.416 ( 0.000 10.687 -8.536) 13.678 5.710 ( 0.000 6.762 -1.376) 6.900 6.163 ( 0.000 -4.354 11.890) 12.662 6.445 ( 0.000 -15.128 -13.642) 20.371 7.277 ( 0.000 -9.719 5.123) 10.987 7.837 ( 0.000 -7.796 7.595) 10.884 8.011 ( 0.000 9.741 1.788) 9.904 8.123 ( 0.000 -6.150 -0.193) 6.153 8.669 ( 0.000 -5.575 1.422) 5.753 9.271 ( 0.000 17.708 1.541) 17.775 9.361 ( 0.000 17.496 -2.109) 17.622 9.830 ( 0.000 8.249 -6.167) 10.299 10.006 ( 0.000 -2.848 1.410) 3.178 10.365 ( 0.000 8.303 4.090) 9.256 10.677 ( 0.000 1.298 -1.916) 2.314 10.715 ( 0.000 -2.700 2.745) 3.850 10.879 ( 0.000 -1.113 3.254) 3.438 11.506 ( 0.000 24.246 -11.165) 26.693 11.528 ( 0.000 21.164 -5.428) 21.849 11.632 ( 0.000 9.066 -4.019) 9.917 11.873 ( 0.000 9.916 -9.825) 13.959 13.055 ( 0.000 15.853 3.643) 16.266 13.436 ( 0.000 5.204 3.381) 6.206 13.577 ( 0.000 5.985 9.557) 11.276 13.698 ( 0.000 6.382 0.841) 6.437 14.118 ( 0.000 -4.923 -12.553) 13.484 14.177 ( 0.000 3.439 3.989) 5.267 14.478 ( 0.000 -2.250 -9.500) 9.762 14.817 ( 0.000 -6.168 -8.658) 10.630 16.756 ( 0.000 -14.741 -2.371) 14.931 16.872 ( 0.000 -10.172 2.330) 10.435 16.969 ( 0.000 -18.621 1.732) 18.702 17.520 ( 0.000 -19.433 -5.053) 20.079 28.957 ( 0.000 9.506 0.917) 9.550 29.101 ( 0.000 3.641 -0.936) 3.759 29.236 ( 0.000 5.067 2.378) 5.597 29.420 ( 0.000 2.984 1.623) 3.397 30.947 ( 0.000 11.796 -0.205) 11.798 31.030 ( 0.000 5.363 -3.068) 6.179 31.423 ( 0.000 -5.670 0.093) 5.671 31.581 ( 0.000 -5.835 -0.167) 5.837 85.803 ( 0.000 0.977 0.823) 1.278 85.831 ( 0.000 0.040 0.069) 0.080 86.230 ( 0.000 -6.599 7.165) 9.741 86.283 ( 0.000 -10.065 6.993) 12.256 ======================= Grid point 201 (74/162) ======================= q-point: ( 0.20 0.38 0.18) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 441 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 4.517 ( 6.363 25.444 -6.155) 26.940 4.964 ( 3.810 27.828 3.026) 28.250 5.112 ( -7.682 19.019 -2.460) 20.659 5.348 ( -6.812 10.544 -2.662) 12.832 5.701 ( 2.568 5.272 -4.678) 7.501 6.228 ( -3.062 -2.363 0.469) 3.896 6.510 ( 12.948 -18.366 -3.259) 22.707 7.281 ( -0.819 -13.096 5.138) 14.091 7.816 ( -1.542 -5.040 6.646) 8.482 7.960 ( -3.899 7.365 1.727) 8.511 8.188 ( 5.266 -5.558 0.662) 7.685 8.622 ( -5.039 -7.441 1.522) 9.114 9.164 ( -6.420 20.122 -2.130) 21.229 9.321 ( -5.446 19.910 2.266) 20.766 9.863 ( 2.996 3.157 -5.276) 6.839 10.047 ( 1.363 -2.451 1.411) 3.139 10.351 ( 1.185 10.972 2.396) 11.293 10.675 ( -0.127 2.864 -2.201) 3.614 10.755 ( 2.651 -1.790 3.117) 4.466 10.879 ( 0.019 -2.579 2.967) 3.931 11.493 ( 1.671 22.355 -8.644) 24.026 11.562 ( 1.438 21.473 -7.175) 22.686 11.749 ( 9.285 12.006 -7.746) 17.039 11.907 ( 2.910 10.850 -10.022) 15.054 13.019 ( -2.732 14.584 5.232) 15.733 13.317 ( -9.517 5.242 6.506) 12.664 13.633 ( 3.158 4.475 5.720) 7.920 13.696 ( -0.069 7.604 -0.334) 7.612 14.073 ( -1.447 -1.646 -6.045) 6.430 14.225 ( 1.808 -1.011 -0.487) 2.128 14.466 ( -0.852 -2.860 -9.294) 9.761 14.738 ( -7.427 -5.931 -7.293) 11.981 16.714 ( -1.245 -13.519 0.797) 13.599 16.867 ( -1.921 -12.415 1.549) 12.658 17.089 ( 10.018 -17.164 -1.318) 19.918 17.502 ( -2.030 -19.188 -5.128) 19.965 28.982 ( 2.453 9.275 0.605) 9.613 29.101 ( -0.135 4.290 -1.045) 4.417 29.236 ( 0.056 4.682 2.574) 5.343 29.383 ( -3.564 3.387 2.094) 5.344 30.963 ( 1.477 10.946 -0.579) 11.060 31.029 ( -0.213 5.807 -2.864) 6.478 31.437 ( 1.426 -5.719 0.030) 5.894 31.565 ( -1.531 -5.827 -0.167) 6.028 85.816 ( 1.273 1.171 0.627) 1.840 85.842 ( 0.894 0.384 -0.106) 0.979 86.223 ( -0.604 -7.216 7.369) 10.331 86.268 ( -1.455 -10.036 7.104) 12.382 ======================= Grid point 202 (75/162) ======================= q-point: ( 0.40 0.38 0.18) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 441 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 4.689 ( 10.772 25.173 -5.533) 27.934 4.915 ( -11.576 23.435 -4.348) 26.497 5.063 ( 6.021 24.794 4.667) 25.938 5.197 ( -7.618 17.369 3.185) 19.232 5.832 ( 9.929 -0.042 -8.186) 12.869 6.053 ( -11.633 -2.857 -7.639) 14.207 6.865 ( 19.222 -19.279 4.850) 27.652 7.176 ( -11.067 -18.913 5.918) 22.698 7.813 ( 1.884 1.320 4.101) 4.702 7.879 ( -4.159 5.077 2.412) 6.992 8.313 ( 7.536 -7.377 1.175) 10.611 8.478 ( -8.830 -8.656 1.205) 12.423 9.107 ( 1.049 22.925 -0.882) 22.966 9.189 ( -6.551 22.072 1.695) 23.086 9.928 ( 3.659 -0.475 -2.297) 4.346 10.007 ( -4.124 -1.960 0.303) 4.576 10.460 ( 8.366 10.875 0.153) 13.722 10.615 ( -6.317 7.586 -0.835) 9.907 10.822 ( 3.749 -2.522 2.231) 5.039 10.873 ( -1.177 -2.978 2.551) 4.094 11.554 ( 3.305 23.322 -9.236) 25.301 11.585 ( 0.334 22.184 -8.698) 23.831 11.904 ( 5.471 12.440 -10.659) 17.271 11.951 ( 0.541 12.371 -10.887) 16.488 13.001 ( 2.156 10.637 8.073) 13.527 13.120 ( -9.328 6.385 8.412) 14.091 13.675 ( 1.493 5.169 0.915) 5.458 13.695 ( -0.358 8.062 -1.076) 8.142 14.101 ( 4.260 -2.878 -2.469) 5.703 14.202 ( -4.314 -3.339 -1.541) 5.668 14.477 ( 2.670 -3.976 -6.949) 8.440 14.577 ( -7.478 -5.051 -5.307) 10.469 16.735 ( 2.995 -12.625 1.852) 13.107 16.807 ( -3.812 -12.488 1.742) 13.172 17.286 ( 9.218 -17.578 -3.947) 20.237 17.431 ( -5.443 -18.491 -4.996) 19.913 29.042 ( 3.203 8.332 -0.363) 8.933 29.089 ( -1.354 6.204 -1.146) 6.453 29.247 ( 1.438 3.949 3.096) 5.219 29.302 ( -3.999 3.811 3.020) 6.296 30.995 ( 1.581 9.029 -1.423) 9.276 31.019 ( -0.824 7.103 -2.278) 7.504 31.475 ( 2.393 -5.789 -0.085) 6.265 31.525 ( -2.456 -5.816 -0.152) 6.315 85.844 ( 1.251 1.488 0.097) 1.946 85.855 ( 0.206 1.186 -0.287) 1.238 86.216 ( 0.200 -8.691 7.652) 11.581 86.235 ( -1.590 -9.762 7.444) 12.379 ======================= Grid point 205 (76/162) ======================= q-point: ( 0.00 0.44 0.18) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 264 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 4.939 ( 0.000 24.212 -10.567) 26.417 5.297 ( 0.000 8.787 -7.958) 11.855 5.393 ( 0.000 6.484 -5.786) 8.690 5.737 ( 0.000 20.946 -4.269) 21.377 5.856 ( 0.000 7.716 -4.415) 8.890 5.930 ( 0.000 -19.482 -3.776) 19.845 6.262 ( 0.000 -1.328 -0.660) 1.482 6.947 ( 0.000 -22.618 6.596) 23.560 7.771 ( 0.000 1.595 6.656) 6.844 8.001 ( 0.000 -6.515 3.470) 7.381 8.170 ( 0.000 7.084 2.515) 7.517 8.492 ( 0.000 -10.366 2.982) 10.787 9.554 ( 0.000 11.505 -2.274) 11.728 9.658 ( 0.000 11.680 -5.911) 13.090 9.920 ( 0.000 -5.296 1.801) 5.594 9.921 ( 0.000 0.941 -3.969) 4.079 10.522 ( 0.000 6.813 1.756) 7.035 10.668 ( 0.000 -1.778 -0.375) 1.817 10.700 ( 0.000 1.179 4.330) 4.487 10.825 ( 0.000 -3.602 3.734) 5.188 11.804 ( 0.000 7.071 -6.505) 9.608 11.821 ( 0.000 7.412 -12.374) 14.424 11.840 ( 0.000 12.491 -4.990) 13.451 12.040 ( 0.000 5.896 -8.501) 10.346 13.389 ( 0.000 13.448 1.570) 13.540 13.531 ( 0.000 4.083 5.546) 6.887 13.831 ( 0.000 6.268 -3.265) 7.068 13.832 ( 0.000 21.045 9.804) 23.217 14.028 ( 0.000 -3.702 -11.696) 12.268 14.239 ( 0.000 3.180 2.347) 3.952 14.421 ( 0.000 -3.667 -5.649) 6.735 14.672 ( 0.000 -10.641 -5.188) 11.838 16.510 ( 0.000 -8.994 -0.057) 8.994 16.649 ( 0.000 -11.691 0.998) 11.734 16.750 ( 0.000 -2.958 -0.098) 2.959 17.142 ( 0.000 -18.536 -3.624) 18.887 29.106 ( 0.000 5.548 1.071) 5.651 29.156 ( 0.000 1.923 0.199) 1.933 29.322 ( 0.000 3.847 1.222) 4.037 29.438 ( 0.000 -0.993 1.000) 1.410 31.131 ( 0.000 4.883 -2.054) 5.297 31.153 ( 0.000 9.000 -0.248) 9.004 31.328 ( 0.000 -3.955 0.394) 3.975 31.467 ( 0.000 -5.965 0.467) 5.984 85.825 ( 0.000 1.128 1.239) 1.676 85.836 ( 0.000 0.361 0.633) 0.729 86.127 ( 0.000 -3.879 3.761) 5.403 86.136 ( 0.000 -5.034 2.915) 5.817 ======================= Grid point 206 (77/162) ======================= q-point: ( 0.20 0.44 0.18) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 440 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 5.000 ( 5.959 23.752 -10.481) 26.637 5.349 ( 3.838 11.505 -5.730) 13.414 5.378 ( -0.551 7.017 -6.662) 9.691 5.681 ( -5.155 21.751 -3.309) 22.597 5.780 ( -1.948 1.737 -6.309) 6.828 6.133 ( 12.934 -17.759 -5.569) 22.664 6.191 ( -5.322 0.236 2.422) 5.852 6.903 ( -4.906 -23.933 6.320) 25.235 7.792 ( 2.297 2.618 5.998) 6.936 8.014 ( 0.653 -3.629 3.243) 4.911 8.139 ( -2.211 3.008 3.119) 4.864 8.433 ( -5.752 -10.405 3.010) 12.264 9.495 ( -3.231 13.690 -3.475) 14.489 9.648 ( -3.400 13.342 -0.894) 13.798 9.849 ( -1.124 -4.062 -3.882) 5.730 9.978 ( -0.096 -4.537 0.430) 4.558 10.533 ( 2.300 7.252 0.510) 7.625 10.682 ( 2.701 -1.196 -0.652) 3.024 10.750 ( 2.285 0.567 3.616) 4.315 10.820 ( -0.323 -2.972 3.118) 4.319 11.817 ( 3.377 10.127 -9.256) 14.129 11.867 ( 3.585 11.193 -7.079) 13.721 11.935 ( 7.121 6.251 -10.161) 13.894 12.091 ( 4.168 6.269 -9.928) 12.459 13.339 ( -3.922 13.137 3.852) 14.241 13.510 ( -3.386 12.182 4.715) 13.495 13.729 ( -4.115 7.292 6.070) 10.342 13.889 ( 0.695 12.712 0.009) 12.731 14.026 ( 0.831 -3.125 -9.239) 9.789 14.224 ( -1.998 1.125 2.130) 3.129 14.394 ( -2.285 -4.539 -5.419) 7.429 14.588 ( -7.499 -10.806 -3.351) 13.573 16.510 ( 1.591 -5.739 0.762) 6.005 16.710 ( 0.083 -3.525 -0.913) 3.642 16.780 ( 6.758 -13.049 -0.341) 14.699 17.127 ( -1.655 -18.430 -3.704) 18.871 29.128 ( 2.180 5.493 0.867) 5.973 29.168 ( 1.099 2.490 0.103) 2.723 29.310 ( -1.027 3.164 1.375) 3.599 29.408 ( -2.920 -0.628 1.215) 3.224 31.137 ( 0.609 5.278 -1.843) 5.623 31.157 ( 0.332 8.747 -0.323) 8.760 31.338 ( 1.111 -4.404 0.272) 4.550 31.453 ( -1.415 -5.847 0.400) 6.029 85.844 ( 1.785 1.462 1.098) 2.556 85.854 ( 1.720 0.805 0.523) 1.969 86.109 ( -1.707 -4.380 3.841) 6.071 86.118 ( -1.747 -5.329 3.069) 6.393 ======================= Grid point 207 (78/162) ======================= q-point: ( 0.40 0.44 0.18) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 440 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 5.152 ( 8.778 21.677 -10.065) 25.460 5.303 ( -5.681 16.334 -7.951) 19.034 5.463 ( 5.093 12.231 -3.105) 13.608 5.565 ( -5.820 18.695 -1.553) 19.642 5.822 ( 6.541 1.177 -7.063) 9.698 6.003 ( -10.476 0.227 -4.842) 11.543 6.455 ( 16.345 -21.746 2.620) 27.330 6.740 ( -11.885 -24.681 5.059) 27.856 7.864 ( 4.960 4.317 4.547) 7.995 7.970 ( -5.078 4.959 3.222) 7.795 8.160 ( 4.808 -8.044 3.881) 10.143 8.291 ( -7.816 -9.872 3.348) 13.029 9.476 ( 1.566 15.225 -2.099) 15.449 9.549 ( -5.295 14.874 -0.264) 15.790 9.866 ( 2.270 -5.508 -2.542) 6.478 9.929 ( -3.758 -5.740 -0.250) 6.866 10.620 ( 5.669 5.874 -0.291) 8.169 10.713 ( -2.519 3.015 -0.164) 3.933 10.777 ( 2.595 -2.340 1.850) 3.954 10.816 ( -0.747 -2.733 2.263) 3.626 11.905 ( 4.431 11.905 -10.300) 16.354 11.939 ( 1.882 14.283 -9.782) 17.413 12.064 ( 5.828 3.510 -11.851) 13.665 12.139 ( -0.688 5.258 -12.300) 13.394 13.294 ( 0.707 16.100 7.313) 17.697 13.384 ( -7.555 20.599 6.950) 23.015 13.740 ( 5.026 -0.330 3.243) 5.991 13.854 ( -4.471 6.351 -2.109) 8.049 14.068 ( 3.072 0.498 -2.931) 4.275 14.149 ( -5.041 -1.059 0.588) 5.185 14.370 ( 0.858 -7.077 -3.286) 7.850 14.440 ( -6.213 -9.520 -1.600) 11.480 16.577 ( 4.526 -2.423 0.331) 5.144 16.663 ( -3.816 -1.318 -0.354) 4.052 16.943 ( 7.976 -17.012 -2.690) 18.981 17.068 ( -4.657 -18.018 -3.612) 18.957 29.178 ( 2.267 5.473 0.123) 5.925 29.192 ( 0.909 4.443 -0.246) 4.541 29.295 ( 0.131 0.982 1.986) 2.219 29.338 ( -3.714 -0.079 1.804) 4.129 31.151 ( 0.691 6.363 -1.298) 6.530 31.160 ( -0.151 7.772 -0.680) 7.803 31.371 ( 2.120 -5.105 0.153) 5.530 31.415 ( -2.273 -5.549 0.245) 6.001 85.883 ( 1.731 2.485 0.579) 3.083 85.889 ( 1.260 2.254 0.224) 2.592 86.074 ( -1.259 -5.940 4.068) 7.309 86.079 ( -1.700 -6.271 3.634) 7.445 ======================= Grid point 210 (79/162) ======================= q-point: ( 0.00 -0.50 0.18) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 150 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 5.324 ( 0.000 -8.732 -9.349) 12.793 5.324 ( 0.000 8.732 -9.349) 12.793 5.537 ( 0.000 -14.978 -10.847) 18.493 5.537 ( 0.000 14.978 -10.847) 18.493 5.962 ( 0.000 -0.807 -7.298) 7.342 5.962 ( 0.000 0.807 -7.298) 7.342 6.475 ( 0.000 -22.761 8.635) 24.344 6.475 ( 0.000 22.761 8.635) 24.344 7.866 ( 0.000 -6.913 5.620) 8.909 7.866 ( 0.000 6.913 5.620) 8.909 8.311 ( 0.000 -7.905 2.922) 8.428 8.311 ( 0.000 7.905 2.922) 8.428 9.731 ( 0.000 -5.879 -5.536) 8.075 9.731 ( 0.000 5.879 -5.536) 8.075 9.884 ( 0.000 -3.403 -0.254) 3.413 9.884 ( 0.000 3.403 -0.254) 3.413 10.618 ( 0.000 -3.415 0.455) 3.445 10.618 ( 0.000 3.415 0.455) 3.445 10.752 ( 0.000 -3.616 4.353) 5.659 10.752 ( 0.000 3.616 4.353) 5.659 11.870 ( 0.000 -0.817 -9.015) 9.052 11.870 ( 0.000 0.817 -9.015) 9.052 12.041 ( 0.000 -6.082 -7.391) 9.572 12.041 ( 0.000 6.082 -7.391) 9.572 13.548 ( 0.000 -3.442 6.921) 7.730 13.548 ( 0.000 3.442 6.921) 7.730 13.927 ( 0.000 -4.103 -8.958) 9.853 13.927 ( 0.000 4.103 -8.958) 9.853 14.285 ( 0.000 -7.866 -0.203) 7.868 14.285 ( 0.000 7.866 -0.203) 7.868 14.378 ( 0.000 -10.150 -0.424) 10.159 14.378 ( 0.000 10.150 -0.424) 10.159 16.470 ( 0.000 -4.929 0.805) 4.995 16.470 ( 0.000 4.929 0.805) 4.995 16.839 ( 0.000 -11.220 -2.161) 11.426 16.839 ( 0.000 11.220 -2.161) 11.427 29.168 ( 0.000 -0.988 1.045) 1.438 29.168 ( 0.000 0.988 1.045) 1.438 29.393 ( 0.000 -3.321 0.536) 3.364 29.393 ( 0.000 3.321 0.536) 3.364 31.216 ( 0.000 -3.349 -1.132) 3.535 31.216 ( 0.000 3.349 -1.132) 3.535 31.344 ( 0.000 -6.333 0.798) 6.383 31.344 ( 0.000 6.333 0.798) 6.383 85.839 ( 0.000 -0.201 1.420) 1.434 85.839 ( 0.000 0.201 1.420) 1.434 86.087 ( 0.000 -0.061 1.780) 1.782 86.087 ( 0.000 0.061 1.780) 1.782 ======================= Grid point 212 (80/162) ======================= q-point: ( 0.20 -0.50 0.18) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 248 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 5.366 ( 4.191 -8.838 -10.167) 14.108 5.366 ( 4.191 8.838 -10.167) 14.108 5.581 ( 3.110 -14.955 -10.149) 18.339 5.581 ( 3.110 14.955 -10.149) 18.339 5.962 ( 0.981 -4.605 -5.659) 7.361 5.962 ( 0.981 4.605 -5.659) 7.361 6.416 ( -5.900 -23.336 7.731) 25.281 6.416 ( -5.900 23.336 7.731) 25.281 7.894 ( 2.903 -6.861 5.424) 9.216 7.894 ( 2.903 6.861 5.424) 9.216 8.252 ( -5.571 -7.683 3.199) 10.015 8.252 ( -5.571 7.683 3.199) 10.015 9.712 ( -1.078 -8.654 -4.522) 9.823 9.712 ( -1.078 8.654 -4.522) 9.823 9.861 ( -2.828 -7.676 -0.059) 8.181 9.861 ( -2.828 7.676 -0.059) 8.181 10.636 ( 2.472 -3.628 -0.163) 4.393 10.636 ( 2.472 3.628 -0.163) 4.393 10.772 ( 1.172 -1.831 3.583) 4.191 10.772 ( 1.172 1.831 3.583) 4.191 11.923 ( 5.084 -2.105 -9.520) 10.996 11.923 ( 5.084 2.105 -9.520) 10.996 12.095 ( 4.328 -5.794 -9.124) 11.642 12.095 ( 4.328 5.794 -9.124) 11.642 13.535 ( -0.372 -6.866 7.048) 9.846 13.535 ( -0.372 6.866 7.047) 9.846 13.920 ( -2.050 -8.067 -7.058) 10.912 13.920 ( -2.050 8.067 -7.058) 10.912 14.213 ( -5.557 -13.003 0.428) 14.147 14.213 ( -5.557 13.003 0.428) 14.147 14.338 ( -3.653 -6.699 -0.103) 7.631 14.338 ( -3.653 6.699 -0.103) 7.631 16.532 ( 5.717 -7.657 -0.001) 9.556 16.532 ( 5.717 7.657 -0.001) 9.556 16.824 ( -1.627 -11.327 -2.207) 11.654 16.824 ( -1.627 11.327 -2.207) 11.654 29.188 ( 1.992 -0.714 1.000) 2.341 29.188 ( 1.992 0.714 1.000) 2.341 29.370 ( -2.246 -2.873 0.587) 3.694 29.370 ( -2.246 2.873 0.587) 3.694 31.230 ( 1.329 -3.635 -0.946) 3.984 31.230 ( 1.329 3.635 -0.946) 3.984 31.333 ( -1.088 -6.040 0.612) 6.167 31.333 ( -1.088 6.040 0.612) 6.167 85.863 ( 2.344 -0.227 1.452) 2.767 85.863 ( 2.344 0.227 1.452) 2.767 86.063 ( -2.326 -0.148 1.744) 2.911 86.063 ( -2.326 0.148 1.744) 2.911 ======================= Grid point 214 (81/162) ======================= q-point: ( 0.40 -0.50 0.18) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 248 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 5.475 ( 6.427 -8.095 -11.070) 15.145 5.475 ( 6.427 8.095 -11.070) 15.145 5.584 ( -3.528 -9.577 -10.889) 14.925 5.584 ( -3.528 9.577 -10.889) 14.925 6.055 ( 8.731 -17.630 -0.140) 19.674 6.055 ( 8.731 17.630 -0.140) 19.674 6.254 ( -10.172 -23.168 4.830) 25.760 6.254 ( -10.172 23.168 4.830) 25.760 7.981 ( 5.923 -6.821 4.832) 10.244 7.981 ( 5.923 6.821 4.832) 10.244 8.117 ( -7.557 -7.131 3.958) 11.119 8.117 ( -7.557 7.131 3.958) 11.119 9.717 ( 1.898 -9.759 -2.591) 10.274 9.717 ( 1.898 9.759 -2.591) 10.274 9.783 ( -4.365 -9.440 -0.782) 10.430 9.783 ( -4.365 9.440 -0.782) 10.430 10.708 ( 4.114 -3.445 0.187) 5.369 10.708 ( 4.114 3.445 0.187) 5.369 10.770 ( -1.721 -1.974 1.824) 3.191 10.770 ( -1.721 1.974 1.824) 3.191 12.049 ( 6.852 -3.386 -11.017) 13.409 12.049 ( 6.852 3.386 -11.017) 13.409 12.140 ( -1.203 -4.761 -11.610) 12.606 12.140 ( -1.204 4.761 -11.610) 12.606 13.587 ( 6.771 -11.694 6.100) 14.826 13.587 ( 6.771 11.694 6.100) 14.826 13.782 ( -11.099 -13.388 0.683) 17.404 13.782 ( -11.099 13.388 0.683) 17.404 14.175 ( 2.148 -6.095 -0.922) 6.528 14.175 ( 2.148 6.095 -0.922) 6.528 14.251 ( -4.761 -4.357 -0.636) 6.485 14.251 ( -4.761 4.357 -0.636) 6.485 16.660 ( 6.588 -10.372 -1.337) 12.360 16.660 ( 6.588 10.372 -1.337) 12.360 16.768 ( -4.230 -11.312 -2.081) 12.255 16.768 ( -4.230 11.312 -2.081) 12.255 29.242 ( 3.339 -0.673 0.879) 3.517 29.242 ( 3.339 0.673 0.879) 3.517 29.311 ( -3.494 -1.782 0.720) 3.988 29.311 ( -3.494 1.782 0.720) 3.988 31.264 ( 2.022 -4.374 -0.464) 4.841 31.264 ( 2.022 4.374 -0.464) 4.841 31.303 ( -1.874 -5.287 0.128) 5.610 31.303 ( -1.874 5.287 0.128) 5.610 85.925 ( 3.783 -0.257 1.539) 4.092 85.925 ( 3.783 0.257 1.539) 4.092 86.002 ( -3.772 -0.234 1.651) 4.124 86.002 ( -3.772 0.234 1.651) 4.124 ======================= Grid point 255 (82/162) ======================= q-point: ( 0.00 0.00 0.27) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 162 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.113 ( 0.000 0.000 31.786) 31.786 2.336 ( 0.000 0.000 34.530) 34.530 3.809 ( 0.000 0.000 43.743) 43.743 3.924 ( 0.000 0.000 -6.496) 6.496 4.043 ( 0.000 0.000 21.568) 21.568 4.099 ( 0.000 0.000 11.892) 11.892 5.110 ( 0.000 0.000 -6.158) 6.158 5.128 ( 0.000 0.000 1.729) 1.729 6.584 ( 0.000 0.000 -8.605) 8.605 6.964 ( 0.000 0.000 -7.695) 7.695 7.589 ( 0.000 0.000 16.534) 16.534 7.938 ( 0.000 0.000 -7.177) 7.177 8.370 ( 0.000 0.000 -0.039) 0.039 8.446 ( 0.000 0.000 -1.446) 1.446 9.121 ( 0.000 0.000 0.096) 0.096 9.143 ( 0.000 0.000 -0.358) 0.358 9.503 ( 0.000 0.000 -4.308) 4.308 9.789 ( 0.000 0.000 19.313) 19.313 9.858 ( 0.000 0.000 -6.142) 6.142 10.601 ( 0.000 0.000 -3.749) 3.749 11.210 ( 0.000 0.000 -0.372) 0.372 11.511 ( 0.000 0.000 -3.308) 3.308 11.727 ( 0.000 0.000 -2.226) 2.226 12.079 ( 0.000 0.000 0.180) 0.180 12.098 ( 0.000 0.000 -0.194) 0.194 12.182 ( 0.000 0.000 -0.205) 0.205 12.184 ( 0.000 0.000 -0.219) 0.219 12.636 ( 0.000 0.000 -21.404) 21.404 14.383 ( 0.000 0.000 -8.088) 8.088 14.590 ( 0.000 0.000 -7.064) 7.064 14.721 ( 0.000 0.000 18.630) 18.630 16.376 ( 0.000 0.000 0.145) 0.145 17.441 ( 0.000 0.000 27.036) 27.036 18.180 ( 0.000 0.000 -2.486) 2.486 19.052 ( 0.000 0.000 -5.278) 5.278 19.534 ( 0.000 0.000 -7.984) 7.984 27.662 ( 0.000 0.000 8.745) 8.745 27.732 ( 0.000 0.000 8.236) 8.236 28.560 ( 0.000 0.000 -6.032) 6.032 28.616 ( 0.000 0.000 -6.811) 6.811 29.927 ( 0.000 0.000 7.818) 7.818 30.656 ( 0.000 0.000 -5.038) 5.038 32.077 ( 0.000 0.000 -5.555) 5.555 32.169 ( 0.000 0.000 -3.364) 3.364 85.978 ( 0.000 0.000 6.728) 6.728 86.265 ( 0.000 0.000 7.539) 7.539 87.814 ( 0.000 0.000 29.571) 29.571 90.377 ( 0.000 0.000 -18.095) 18.095 ======================= Grid point 256 (83/162) ======================= q-point: ( 0.20 0.00 0.27) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 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| 2.253 ( 13.643 0.000 28.381) 31.490 2.388 ( 6.910 0.000 27.385) 28.243 3.553 ( -23.710 0.000 5.713) 24.388 3.668 ( -23.577 0.000 11.977) 26.445 4.150 ( 22.518 0.000 47.221) 52.316 4.406 ( 17.368 0.000 0.942) 17.393 5.065 ( -4.568 0.000 -5.806) 7.388 5.275 ( 8.499 0.000 5.950) 10.375 6.417 ( -10.306 0.000 -0.130) 10.307 6.931 ( -7.712 0.000 -0.760) 7.749 7.633 ( 7.019 0.000 4.188) 8.173 8.037 ( 6.039 0.000 -6.361) 8.771 8.376 ( 0.681 0.000 -0.162) 0.700 8.438 ( -0.770 0.000 -1.298) 1.509 9.123 ( 0.257 0.000 0.038) 0.260 9.141 ( -0.162 0.000 -0.326) 0.364 9.455 ( -3.954 0.000 1.431) 4.205 9.584 ( -9.470 0.000 4.743) 10.591 10.102 ( 13.426 0.000 -1.060) 13.468 10.582 ( -2.320 0.000 -3.945) 4.577 11.197 ( -0.792 0.000 -0.178) 0.812 11.397 ( -7.499 0.000 -0.017) 7.499 11.903 ( 13.638 0.000 -6.785) 15.233 12.082 ( 0.319 0.000 0.151) 0.353 12.098 ( -0.009 0.000 -0.155) 0.155 12.180 ( -0.151 0.000 -0.212) 0.260 12.182 ( -0.153 0.000 -0.223) 0.270 12.608 ( -3.551 0.000 -20.903) 21.203 14.404 ( 1.636 0.000 -6.351) 6.559 14.554 ( -2.879 0.000 1.950) 3.477 14.840 ( 11.664 0.000 5.672) 12.970 16.074 ( -24.224 0.000 0.822) 24.238 17.749 ( 24.777 0.000 26.986) 36.635 18.260 ( 7.660 0.000 -0.728) 7.695 18.987 ( -6.251 0.000 -6.319) 8.888 19.391 ( -13.837 0.000 -4.434) 14.530 27.668 ( 0.638 0.000 8.699) 8.722 27.725 ( -0.699 0.000 8.287) 8.316 28.566 ( 0.557 0.000 -6.108) 6.133 28.611 ( -0.496 0.000 -6.739) 6.757 30.040 ( 10.453 0.000 3.245) 10.946 30.614 ( -4.286 0.000 -5.488) 6.963 32.085 ( 0.772 0.000 -5.160) 5.217 32.160 ( -0.869 0.000 -3.458) 3.566 85.986 ( 1.005 0.000 7.195) 7.265 86.207 ( -5.079 0.000 8.213) 9.657 88.014 ( 19.486 0.000 27.248) 33.499 90.025 ( -32.667 0.000 -6.717) 33.350 ======================= Grid point 257 (84/162) ======================= q-point: ( 0.40 0.00 0.27) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 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| 2.611 ( 21.904 0.000 20.912) 30.284 2.650 ( 19.857 0.000 15.380) 25.117 3.074 ( -24.695 0.000 13.032) 27.923 3.132 ( -27.945 0.000 9.541) 29.529 4.707 ( 30.363 0.000 37.455) 48.216 4.710 ( 13.481 0.000 -2.651) 13.739 4.931 ( -9.092 0.000 -4.698) 10.234 5.210 ( -17.311 0.000 19.492) 26.070 6.396 ( 9.604 0.000 6.605) 11.656 6.678 ( -15.941 0.000 6.111) 17.072 7.840 ( 12.339 0.000 -5.134) 13.365 8.044 ( -6.344 0.000 -7.156) 9.563 8.395 ( 1.141 0.000 -0.494) 1.243 8.418 ( -1.195 0.000 -0.926) 1.512 9.130 ( 0.362 0.000 -0.097) 0.375 9.136 ( -0.304 0.000 -0.234) 0.384 9.402 ( 0.658 0.000 1.022) 1.216 9.466 ( -4.336 0.000 2.585) 5.048 10.327 ( 9.888 0.000 -4.822) 11.001 10.495 ( -6.795 0.000 -3.925) 7.847 11.203 ( 1.782 0.000 0.970) 2.029 11.271 ( -5.085 0.000 2.438) 5.640 12.090 ( 0.395 0.000 0.068) 0.401 12.096 ( -0.195 0.000 -0.051) 0.201 12.178 ( -0.059 0.000 -0.227) 0.234 12.179 ( -0.139 0.000 -0.232) 0.270 12.197 ( 15.492 0.000 -13.331) 20.438 12.467 ( -11.054 0.000 -18.386) 21.453 14.440 ( 2.165 0.000 -2.707) 3.466 14.492 ( -3.125 0.000 1.469) 3.453 15.154 ( 19.631 0.000 -0.475) 19.636 15.586 ( -24.136 0.000 -0.409) 24.140 18.233 ( 21.346 0.000 26.636) 34.134 18.419 ( 4.452 0.000 11.465) 12.299 18.861 ( -2.631 0.000 -10.881) 11.194 19.052 ( -18.280 0.000 -4.050) 18.724 27.685 ( 1.059 0.000 8.574) 8.640 27.707 ( -1.097 0.000 8.417) 8.488 28.580 ( 0.867 0.000 -6.306) 6.365 28.597 ( -0.829 0.000 -6.547) 6.599 30.276 ( 12.265 0.000 -3.357) 12.716 30.486 ( -8.809 0.000 -5.801) 10.548 32.107 ( 1.414 0.000 -4.366) 4.589 32.136 ( -1.474 0.000 -3.758) 4.037 86.023 ( 2.898 0.000 8.073) 8.577 86.102 ( -5.034 0.000 8.581) 9.949 88.537 ( 33.043 0.000 21.683) 39.522 89.270 ( -40.532 0.000 11.097) 42.023 ======================= Grid point 260 (85/162) ======================= q-point: ( 0.00 0.06 0.27) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 264 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.456 ( 0.000 12.069 31.809) 34.021 2.532 ( 0.000 34.448 29.421) 45.302 3.874 ( 0.000 12.093 29.188) 31.594 4.087 ( 0.000 5.203 23.364) 23.936 4.185 ( 0.000 23.607 -5.349) 24.206 4.414 ( 0.000 26.931 18.910) 32.907 5.157 ( 0.000 7.918 -0.031) 7.918 5.423 ( 0.000 26.636 -5.745) 27.248 6.622 ( 0.000 4.612 -9.254) 10.340 6.978 ( 0.000 1.852 -7.046) 7.285 7.544 ( 0.000 -3.986 14.686) 15.218 7.921 ( 0.000 -1.537 -7.094) 7.258 8.528 ( 0.000 7.419 1.472) 7.564 8.567 ( 0.000 16.823 -0.847) 16.844 9.139 ( 0.000 1.649 2.337) 2.860 9.196 ( 0.000 5.340 -2.164) 5.762 9.580 ( 0.000 7.909 -7.625) 10.986 9.779 ( 0.000 -0.524 18.232) 18.240 9.908 ( 0.000 5.140 -4.453) 6.801 10.562 ( 0.000 -3.952 -3.707) 5.419 11.184 ( 0.000 -2.284 -1.760) 2.884 11.382 ( 0.000 -10.886 -3.630) 11.475 11.669 ( 0.000 -4.601 -0.272) 4.609 11.982 ( 0.000 -8.095 0.947) 8.150 12.185 ( 0.000 8.735 -0.607) 8.756 12.329 ( 0.000 14.106 -4.396) 14.775 12.341 ( 0.000 14.224 -1.462) 14.299 12.848 ( 0.000 17.266 -19.003) 25.676 14.358 ( 0.000 -2.428 -8.020) 8.379 14.556 ( 0.000 -3.373 -6.385) 7.221 14.657 ( 0.000 -6.329 16.654) 17.816 16.250 ( 0.000 -12.577 -0.826) 12.604 17.431 ( 0.000 -1.065 25.212) 25.234 18.122 ( 0.000 -5.876 -2.498) 6.385 18.955 ( 0.000 -9.658 -4.796) 10.783 19.351 ( 0.000 -17.318 -5.251) 18.097 27.743 ( 0.000 8.104 8.446) 11.705 27.893 ( 0.000 14.960 4.649) 15.666 28.599 ( 0.000 3.871 -5.381) 6.628 28.656 ( 0.000 4.115 -6.418) 7.624 29.961 ( 0.000 3.513 7.209) 8.020 30.653 ( 0.000 -0.208 -4.970) 4.974 32.043 ( 0.000 -3.395 -5.207) 6.216 32.138 ( 0.000 -3.081 -3.320) 4.529 85.969 ( 0.000 -0.846 6.389) 6.445 86.219 ( 0.000 -4.478 7.566) 8.792 87.730 ( 0.000 -8.435 28.424) 29.650 89.916 ( 0.000 -42.577 -4.734) 42.839 ======================= Grid point 261 (86/162) ======================= q-point: ( 0.20 0.06 0.27) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 440 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.483 ( 4.473 10.867 25.953) 28.489 2.656 ( 12.145 32.919 26.657) 44.066 3.646 ( -23.405 8.522 7.963) 26.150 3.914 ( -20.830 23.493 10.087) 32.978 4.257 ( 22.139 14.305 39.664) 47.623 4.662 ( 16.253 22.645 4.255) 28.197 5.255 ( 2.959 12.883 -1.145) 13.268 5.415 ( 0.106 20.154 -0.580) 20.163 6.452 ( -10.250 4.422 -0.292) 11.167 6.953 ( -7.325 2.817 -0.438) 7.861 7.607 ( 7.894 -2.395 3.232) 8.859 7.990 ( 4.206 -3.716 -6.645) 8.698 8.525 ( -0.436 7.923 0.867) 7.982 8.555 ( -1.129 14.625 -0.199) 14.670 9.151 ( 1.292 2.284 2.553) 3.661 9.202 ( 0.805 6.288 -2.330) 6.754 9.506 ( -6.245 5.017 1.916) 8.237 9.612 ( -8.015 3.458 3.819) 9.528 10.132 ( 13.181 3.273 -2.473) 13.804 10.558 ( -1.007 -2.464 -3.978) 4.786 11.165 ( -1.333 -2.938 -1.642) 3.620 11.327 ( -4.809 -6.528 -0.266) 8.112 11.727 ( 5.293 -10.832 -2.389) 12.291 11.978 ( -0.668 -8.713 0.333) 8.744 12.195 ( 0.926 8.979 -0.663) 9.051 12.292 ( -1.915 11.845 -1.910) 12.150 12.415 ( 5.484 17.439 -5.084) 18.974 12.824 ( -2.936 17.320 -18.459) 25.482 14.379 ( 1.599 -2.489 -6.385) 7.037 14.516 ( -2.838 -3.718 2.155) 5.150 14.777 ( 11.368 -6.257 4.410) 13.705 15.972 ( -22.872 -10.267 -0.229) 25.071 17.709 ( 22.870 -3.912 25.205) 34.258 18.199 ( 7.382 -6.157 -0.761) 9.642 18.891 ( -6.218 -9.600 -5.647) 12.756 19.228 ( -11.899 -15.423 -3.044) 19.716 27.754 ( 1.037 8.464 8.334) 11.924 27.871 ( -1.997 13.760 5.632) 15.002 28.604 ( 0.555 3.867 -5.473) 6.724 28.651 ( -0.550 4.038 -6.294) 7.498 30.067 ( 9.793 2.793 3.072) 10.637 30.613 ( -4.143 -0.066 -5.329) 6.751 32.052 ( 0.818 -3.345 -4.866) 5.961 32.129 ( -0.904 -3.119 -3.386) 4.692 85.977 ( 0.875 -0.963 6.837) 6.959 86.170 ( -4.352 -3.653 8.019) 9.828 87.907 ( 17.376 -10.506 26.532) 33.410 89.633 ( -26.536 -36.570 2.530) 45.254 ======================= Grid point 262 (87/162) ======================= q-point: ( 0.40 0.06 0.27) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 440 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.683 ( 16.054 7.609 15.629) 23.662 2.940 ( 8.945 20.621 17.799) 28.671 3.191 ( -13.679 17.810 12.311) 25.610 3.466 ( -23.146 29.638 14.485) 40.298 4.795 ( 29.167 11.415 30.906) 44.002 4.956 ( 13.259 21.928 -1.058) 25.647 5.177 ( -8.493 21.877 -3.673) 23.753 5.288 ( -17.282 9.868 15.680) 25.336 6.432 ( 9.384 4.733 6.828) 12.533 6.707 ( -15.586 3.832 6.391) 17.276 7.811 ( 11.244 -2.402 -5.355) 12.683 7.989 ( -5.321 -4.285 -6.868) 9.687 8.516 ( -0.156 8.527 0.205) 8.531 8.528 ( -1.321 10.490 0.185) 10.574 9.187 ( 2.068 5.002 1.806) 5.706 9.217 ( -0.321 8.200 -1.199) 8.294 9.424 ( 0.443 2.297 2.456) 3.392 9.498 ( -5.022 3.910 1.145) 6.467 10.349 ( 9.197 2.271 -5.705) 11.058 10.498 ( -5.539 0.299 -4.324) 7.033 11.162 ( 1.579 -3.821 0.027) 4.135 11.227 ( -4.741 -4.000 2.205) 6.583 11.848 ( 6.228 -14.349 -3.040) 15.935 11.943 ( -3.211 -11.454 -1.190) 11.955 12.220 ( 1.596 9.442 -0.858) 9.615 12.254 ( -1.883 10.263 -1.199) 10.503 12.552 ( 8.309 19.321 -9.913) 23.251 12.718 ( -7.744 18.243 -15.476) 25.145 14.412 ( 1.977 -2.690 -2.989) 4.481 14.460 ( -2.805 -3.231 1.012) 4.396 15.082 ( 19.100 -7.213 -0.829) 20.433 15.503 ( -23.475 -8.370 -1.009) 24.943 18.162 ( 20.321 -7.013 24.726) 32.764 18.350 ( 3.740 -7.027 11.234) 13.768 18.764 ( -2.832 -9.562 -10.066) 14.170 18.933 ( -16.134 -11.487 -4.338) 20.275 27.783 ( 1.900 9.573 7.946) 12.585 27.826 ( -2.399 11.459 7.093) 13.689 28.619 ( 0.877 3.873 -5.717) 6.961 28.636 ( -0.866 3.925 -6.023) 7.242 30.289 ( 11.617 1.435 -3.014) 12.088 30.489 ( -8.447 0.433 -5.454) 10.064 32.074 ( 1.453 -3.256 -4.171) 5.488 32.105 ( -1.506 -3.187 -3.634) 5.063 86.009 ( 2.560 -1.391 7.673) 8.208 86.078 ( -4.410 -2.301 8.193) 9.584 88.371 ( 29.084 -16.097 22.128) 39.933 89.006 ( -34.423 -25.206 14.460) 45.049 ======================= Grid point 265 (88/162) ======================= q-point: ( 0.00 0.12 0.27) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 267 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.791 ( 0.000 21.658 25.540) 33.487 3.107 ( 0.000 21.191 31.660) 38.098 4.157 ( 0.000 9.416 10.792) 14.322 4.519 ( 0.000 44.374 21.530) 49.321 4.633 ( 0.000 17.079 -2.724) 17.295 5.008 ( 0.000 31.709 21.558) 38.343 5.505 ( 0.000 29.159 0.733) 29.168 6.061 ( 0.000 34.556 -10.184) 36.025 6.805 ( 0.000 15.185 -9.331) 17.822 7.071 ( 0.000 8.805 -4.097) 9.712 7.475 ( 0.000 -1.016 9.596) 9.650 7.887 ( 0.000 -1.734 -7.049) 7.260 8.685 ( 0.000 7.672 5.962) 9.716 8.879 ( 0.000 12.975 3.987) 13.574 9.171 ( 0.000 1.197 2.972) 3.204 9.344 ( 0.000 9.540 -4.696) 10.633 9.779 ( 0.000 7.389 5.969) 9.498 9.818 ( 0.000 9.440 -1.610) 9.576 10.049 ( 0.000 8.601 0.105) 8.602 10.455 ( 0.000 -6.449 -4.659) 7.956 11.145 ( 0.000 -1.039 -4.671) 4.786 11.154 ( 0.000 -11.576 -5.109) 12.653 11.575 ( 0.000 -4.987 1.809) 5.305 11.829 ( 0.000 -7.425 2.947) 7.988 12.422 ( 0.000 14.961 -1.385) 15.025 12.635 ( 0.000 15.497 -7.678) 17.295 12.678 ( 0.000 19.303 -2.415) 19.453 13.191 ( 0.000 16.154 -15.240) 22.208 14.299 ( 0.000 -3.216 -8.229) 8.835 14.464 ( 0.000 -5.788 -4.348) 7.239 14.489 ( 0.000 -10.304 11.023) 15.089 15.912 ( 0.000 -21.107 -3.466) 21.390 17.400 ( 0.000 -2.113 20.287) 20.397 17.955 ( 0.000 -11.077 -2.436) 11.342 18.689 ( 0.000 -17.206 -3.648) 17.588 18.939 ( 0.000 -23.005 -2.406) 23.131 27.959 ( 0.000 13.426 7.543) 15.400 28.239 ( 0.000 18.683 -0.180) 18.684 28.705 ( 0.000 6.839 -3.516) 7.690 28.773 ( 0.000 7.727 -5.169) 9.297 30.064 ( 0.000 7.036 5.556) 8.965 30.654 ( 0.000 0.515 -4.835) 4.863 31.950 ( 0.000 -6.016 -4.282) 7.385 32.053 ( 0.000 -5.495 -3.196) 6.357 85.946 ( 0.000 -1.481 5.461) 5.658 86.106 ( 0.000 -6.578 7.243) 9.784 87.503 ( 0.000 -14.225 25.222) 28.957 88.948 ( 0.000 -51.591 12.951) 53.192 ======================= Grid point 266 (89/162) ======================= q-point: ( 0.20 0.12 0.27) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 441 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.781 ( 1.628 19.369 21.280) 28.821 3.241 ( 10.272 23.031 27.533) 37.336 3.877 ( -20.130 13.334 10.329) 26.262 4.441 ( -12.120 28.396 12.520) 33.316 4.817 ( 16.373 40.986 22.507) 49.543 5.106 ( 12.548 19.500 6.934) 24.203 5.593 ( 4.192 25.553 -0.266) 25.896 6.005 ( -6.457 33.925 -7.835) 35.411 6.642 ( -7.902 16.340 1.069) 18.182 7.098 ( -4.678 14.506 -0.349) 15.246 7.554 ( 9.217 -2.395 0.677) 9.547 7.923 ( 2.250 -2.756 -6.747) 7.628 8.659 ( -1.987 5.142 4.216) 6.940 8.841 ( -4.325 12.268 1.773) 13.129 9.192 ( 2.938 1.695 6.283) 7.140 9.378 ( 3.560 11.099 -4.724) 12.577 9.622 ( -10.138 6.696 10.084) 15.790 9.756 ( -5.030 11.166 -3.639) 12.775 10.231 ( 11.622 6.426 -3.974) 13.862 10.491 ( 2.674 -3.861 -4.753) 6.682 11.094 ( -2.648 -4.937 -5.005) 7.513 11.187 ( 0.355 -5.819 -1.451) 6.008 11.548 ( -0.775 -7.591 0.537) 7.649 11.815 ( -1.832 -7.596 1.803) 8.019 12.435 ( 1.280 15.069 -1.318) 15.180 12.586 ( -3.097 16.881 -3.755) 17.568 12.760 ( 6.165 16.962 -6.512) 19.186 13.165 ( -3.056 15.912 -14.943) 22.041 14.317 ( 1.391 -3.449 -6.784) 7.736 14.416 ( -2.277 -6.253 2.180) 7.003 14.611 ( 10.260 -10.092 1.299) 14.450 15.689 ( -19.372 -18.072 -2.862) 26.647 17.610 ( 18.020 -5.920 20.298) 27.781 18.025 ( 6.668 -11.508 -0.802) 13.324 18.627 ( -5.957 -16.970 -4.104) 18.447 18.857 ( -8.125 -21.015 -2.224) 22.641 27.978 ( 1.867 13.844 7.304) 15.763 28.198 ( -3.768 18.155 1.618) 18.612 28.711 ( 0.551 6.833 -3.643) 7.763 28.764 ( -0.810 7.444 -4.882) 8.939 30.151 ( 8.112 5.911 2.424) 10.326 30.618 ( -3.672 0.834 -4.993) 6.254 31.959 ( 0.927 -5.948 -4.071) 7.267 32.043 ( -0.990 -5.551 -3.207) 6.487 85.951 ( 0.558 -1.652 5.860) 6.114 86.077 ( -2.657 -5.480 7.267) 9.481 87.630 ( 12.493 -17.047 24.188) 32.121 88.783 ( -15.790 -46.264 15.044) 51.147 ======================= Grid point 267 (90/162) ======================= q-point: ( 0.40 0.12 0.27) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 441 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.917 ( 12.647 16.178 13.342) 24.489 3.231 ( -15.627 14.140 10.079) 23.361 3.746 ( 12.259 28.519 24.056) 39.272 4.097 ( -20.015 30.268 19.694) 41.287 5.221 ( 21.556 33.284 20.357) 44.575 5.407 ( 16.455 18.921 -0.738) 25.086 5.544 ( -9.170 22.684 1.277) 24.501 5.767 ( -17.401 30.549 -1.294) 35.181 6.660 ( 9.213 20.750 7.206) 23.820 6.901 ( -13.148 18.767 6.223) 23.745 7.763 ( 10.199 -2.273 -6.057) 12.078 7.912 ( -4.273 -3.138 -6.624) 8.484 8.648 ( 1.699 4.294 1.506) 4.857 8.728 ( -5.950 7.878 0.584) 9.889 9.289 ( 6.317 4.930 8.389) 11.601 9.422 ( -5.921 10.394 3.972) 12.604 9.509 ( 5.094 7.915 1.018) 9.468 9.643 ( -6.611 10.851 -2.902) 13.033 10.413 ( 7.101 3.979 -7.138) 10.826 10.509 ( -2.011 0.904 -5.376) 5.811 11.075 ( 1.378 -4.657 -1.978) 5.244 11.140 ( -4.272 -4.148 1.102) 6.056 11.609 ( 6.498 -10.048 -1.329) 12.040 11.742 ( -5.787 -8.793 -0.131) 10.527 12.471 ( 2.337 15.506 -1.387) 15.743 12.525 ( -3.071 16.331 -2.020) 16.740 12.903 ( 8.173 15.803 -9.628) 20.230 13.061 ( -7.329 15.545 -12.938) 21.511 14.344 ( 1.458 -3.892 -4.046) 5.800 14.377 ( -1.832 -4.893 -0.660) 5.266 14.887 ( 17.442 -12.171 -1.659) 21.333 15.273 ( -21.411 -14.608 -2.532) 26.043 17.978 ( 17.002 -11.324 19.510) 28.248 18.153 ( 2.172 -12.759 10.201) 16.480 18.510 ( -2.132 -15.797 -8.546) 18.086 18.646 ( -12.033 -16.852 -5.247) 21.361 28.031 ( 3.525 15.030 6.444) 16.729 28.112 ( -4.565 16.696 4.564) 17.901 28.726 ( 0.926 6.865 -3.980) 7.989 28.745 ( -1.040 7.048 -4.417) 8.382 30.337 ( 9.862 3.690 -2.420) 10.804 30.510 ( -7.360 1.864 -4.737) 8.949 31.984 ( 1.567 -5.807 -3.636) 7.029 32.016 ( -1.605 -5.671 -3.316) 6.763 85.972 ( 1.741 -2.270 6.574) 7.169 86.019 ( -2.902 -3.580 7.068) 8.437 87.961 ( 20.428 -24.396 21.942) 38.652 88.392 ( -22.451 -34.986 18.883) 45.658 ======================= Grid point 270 (91/162) ======================= q-point: ( 0.00 0.19 0.27) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 264 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.278 ( 0.000 27.689 18.804) 33.470 3.437 ( 0.000 14.948 27.535) 31.330 4.358 ( 0.000 11.854 9.745) 15.346 4.847 ( 0.000 7.294 -2.476) 7.703 5.280 ( 0.000 22.083 8.258) 23.576 5.783 ( 0.000 53.145 18.746) 56.354 6.099 ( 0.000 22.973 3.196) 23.194 6.648 ( 0.000 25.598 -10.743) 27.761 7.209 ( 0.000 23.909 -3.359) 24.144 7.240 ( 0.000 7.101 2.511) 7.532 7.703 ( 0.000 26.059 -4.624) 26.466 7.867 ( 0.000 0.095 -7.215) 7.215 8.838 ( 0.000 9.736 9.583) 13.661 9.077 ( 0.000 7.917 9.534) 12.393 9.171 ( 0.000 -0.417 1.240) 1.308 9.542 ( 0.000 9.751 -5.065) 10.988 9.914 ( 0.000 9.038 9.643) 13.216 10.077 ( 0.000 13.696 -7.596) 15.662 10.176 ( 0.000 1.437 5.340) 5.530 10.383 ( 0.000 2.671 -7.746) 8.193 10.955 ( 0.000 -8.279 -6.277) 10.390 11.157 ( 0.000 2.308 -7.105) 7.471 11.470 ( 0.000 -5.836 2.235) 6.250 11.688 ( 0.000 -7.044 3.289) 7.773 12.742 ( 0.000 17.020 -2.073) 17.146 12.888 ( 0.000 9.725 -4.311) 10.638 13.062 ( 0.000 19.136 -2.348) 19.279 13.437 ( 0.000 8.472 -8.920) 12.302 14.243 ( 0.000 -3.207 -9.476) 10.004 14.290 ( 0.000 -8.192 2.998) 8.723 14.342 ( 0.000 -6.416 -1.116) 6.513 15.469 ( 0.000 -23.095 -6.974) 24.125 17.346 ( 0.000 -3.592 13.733) 14.195 17.698 ( 0.000 -15.060 -2.159) 15.214 18.304 ( 0.000 -21.687 -2.266) 21.805 18.501 ( 0.000 -21.192 -3.071) 21.413 28.243 ( 0.000 15.049 6.015) 16.206 28.573 ( 0.000 14.890 -2.142) 15.044 28.857 ( 0.000 8.442 -0.834) 8.483 28.953 ( 0.000 10.513 -2.907) 10.907 30.233 ( 0.000 10.186 3.382) 10.733 30.680 ( 0.000 2.335 -4.713) 5.260 31.817 ( 0.000 -7.366 -3.047) 7.971 31.931 ( 0.000 -6.773 -2.960) 7.392 85.914 ( 0.000 -1.757 4.172) 4.527 85.980 ( 0.000 -5.968 6.064) 8.508 87.198 ( 0.000 -16.407 20.627) 26.356 88.016 ( 0.000 -42.649 17.904) 46.255 ======================= Grid point 271 (92/162) ======================= q-point: ( 0.20 0.19 0.27) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 440 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.214 ( -1.015 24.175 16.390) 29.225 3.616 ( 10.409 17.932 22.173) 30.357 4.139 ( -13.725 14.004 12.273) 23.133 4.858 ( -7.939 13.514 8.776) 17.963 5.339 ( 10.111 10.805 3.927) 15.310 5.848 ( 7.908 54.928 16.476) 57.889 6.076 ( -4.385 17.067 -3.031) 17.880 6.658 ( -2.563 34.970 -9.476) 36.322 7.049 ( -1.589 20.035 9.616) 22.280 7.480 ( 10.687 13.780 -4.569) 18.027 7.642 ( -3.671 20.410 -3.755) 21.075 7.907 ( 2.281 3.259 -6.750) 7.835 8.740 ( -6.571 4.917 7.080) 10.839 8.997 ( -8.627 2.769 2.251) 9.336 9.242 ( 6.850 5.581 8.099) 11.986 9.597 ( 4.894 10.431 -1.727) 11.651 9.785 ( -9.304 9.977 8.810) 16.240 9.996 ( -5.098 12.245 -2.100) 13.429 10.324 ( 8.862 1.383 -4.723) 10.137 10.473 ( 6.920 4.439 -5.907) 10.123 10.964 ( 0.634 -6.715 -5.714) 8.839 11.155 ( -0.625 1.530 -4.145) 4.462 11.416 ( -3.006 -6.160 1.105) 6.943 11.681 ( -1.577 -6.189 1.907) 6.666 12.754 ( 1.255 16.793 -1.892) 16.946 12.886 ( -0.689 11.927 -3.548) 12.462 13.071 ( 1.597 15.421 -3.190) 15.828 13.404 ( -3.675 8.067 -8.756) 12.460 14.257 ( 1.028 -3.016 -8.093) 8.698 14.287 ( -0.094 -6.060 -0.083) 6.062 14.415 ( 7.648 -9.065 -0.696) 11.881 15.303 ( -15.052 -20.350 -6.065) 26.028 17.482 ( 12.076 -7.196 13.770) 19.679 17.760 ( 5.975 -15.259 -0.751) 16.405 18.252 ( -4.842 -20.870 -2.860) 21.614 18.450 ( -5.217 -20.065 -3.602) 21.043 28.268 ( 2.510 15.266 5.672) 16.478 28.533 ( -3.843 15.452 -0.689) 15.938 28.862 ( 0.557 8.444 -0.969) 8.517 28.935 ( -1.531 9.920 -2.386) 10.317 30.298 ( 6.001 8.985 1.313) 10.884 30.653 ( -2.861 2.810 -4.681) 6.163 31.828 ( 1.049 -7.304 -2.982) 7.959 31.920 ( -1.099 -6.835 -2.917) 7.512 85.915 ( 0.210 -1.927 4.546) 4.942 85.971 ( -0.919 -5.071 5.766) 7.734 87.273 ( 7.423 -18.804 20.247) 28.612 87.932 ( -8.248 -39.682 18.162) 44.413 ======================= Grid point 272 (93/162) ======================= q-point: ( 0.40 0.19 0.27) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 440 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.297 ( 9.493 22.030 10.312) 26.111 3.554 ( -14.447 18.851 6.881) 24.727 4.177 ( 16.330 17.242 26.271) 35.414 4.553 ( -19.624 16.866 21.033) 33.346 5.617 ( 15.290 6.510 -1.095) 16.655 5.887 ( -11.324 11.638 -2.026) 16.364 6.119 ( 15.930 48.675 7.093) 51.705 6.453 ( -16.048 41.798 -0.245) 44.774 7.195 ( 12.520 27.422 8.025) 31.195 7.432 ( -10.358 28.920 2.226) 30.799 7.757 ( 9.626 4.597 -6.639) 12.565 7.897 ( -4.015 4.398 -6.091) 8.519 8.683 ( 1.981 0.053 2.528) 3.212 8.806 ( -9.389 -0.031 0.450) 9.400 9.397 ( 8.716 7.401 11.137) 15.962 9.576 ( -9.030 7.666 12.897) 17.511 9.744 ( 6.835 13.347 -4.412) 15.631 9.883 ( -6.585 12.687 -2.733) 14.553 10.475 ( 6.413 1.991 -7.930) 10.391 10.552 ( -0.309 3.839 -6.770) 7.789 10.993 ( 3.224 -3.301 -2.895) 5.447 11.090 ( -5.623 -0.949 -0.139) 5.704 11.457 ( 6.932 -5.360 -1.473) 8.885 11.603 ( -6.395 -5.266 -0.245) 8.288 12.792 ( 2.558 16.340 -1.724) 16.628 12.849 ( -2.888 15.533 -2.121) 15.941 13.148 ( 6.237 9.407 -5.308) 12.472 13.291 ( -7.420 7.613 -7.368) 12.934 14.275 ( 0.754 -3.059 -6.064) 6.834 14.285 ( -0.259 -4.106 -3.614) 5.476 14.638 ( 14.633 -12.375 -2.237) 19.295 14.964 ( -18.007 -16.019 -4.285) 24.479 17.733 ( 11.774 -13.681 12.742) 22.094 17.866 ( 0.887 -16.237 8.056) 18.147 18.176 ( 0.569 -17.824 -7.616) 19.392 18.304 ( -9.041 -17.628 -5.844) 20.656 28.338 ( 4.557 15.753 4.499) 17.005 28.439 ( -5.387 15.994 2.227) 17.023 28.878 ( 1.077 8.547 -1.309) 8.714 28.904 ( -1.529 9.001 -1.751) 9.296 30.437 ( 7.463 6.499 -2.131) 10.123 30.569 ( -5.677 4.236 -4.129) 8.199 31.856 ( 1.726 -7.156 -2.873) 7.902 31.891 ( -1.756 -6.984 -2.851) 7.745 85.925 ( 0.876 -2.425 5.058) 5.677 85.948 ( -1.292 -3.491 5.361) 6.527 87.470 ( 12.092 -24.880 19.466) 33.825 87.719 ( -12.605 -32.648 18.740) 39.698 ======================= Grid point 275 (94/162) ======================= q-point: ( 0.00 0.25 0.27) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 267 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.730 ( 0.000 15.292 18.166) 23.746 3.851 ( 0.000 30.450 13.162) 33.173 4.620 ( 0.000 14.779 6.880) 16.302 4.970 ( 0.000 5.750 -4.603) 7.365 5.523 ( 0.000 6.591 3.753) 7.585 6.318 ( 0.000 3.173 -0.901) 3.298 6.832 ( 0.000 48.467 11.654) 49.849 6.853 ( 0.000 -4.842 5.031) 6.983 7.598 ( 0.000 13.393 4.366) 14.087 7.672 ( 0.000 34.537 -8.368) 35.536 7.911 ( 0.000 4.800 -4.985) 6.921 8.144 ( 0.000 13.533 -8.372) 15.913 9.076 ( 0.000 -4.023 2.194) 4.583 9.132 ( 0.000 16.916 14.857) 22.514 9.323 ( 0.000 12.685 6.621) 14.309 9.722 ( 0.000 11.614 -8.398) 14.332 10.113 ( 0.000 10.202 3.537) 10.798 10.185 ( 0.000 3.837 -0.259) 3.846 10.376 ( 0.000 19.194 -3.587) 19.526 10.525 ( 0.000 8.902 -2.666) 9.293 10.839 ( 0.000 -3.791 -5.188) 6.425 11.225 ( 0.000 3.226 -4.320) 5.392 11.360 ( 0.000 -3.844 -3.167) 4.981 11.561 ( 0.000 -5.512 1.699) 5.768 13.007 ( 0.000 2.664 3.142) 4.119 13.058 ( 0.000 14.706 -2.316) 14.887 13.394 ( 0.000 14.140 -1.870) 14.263 13.529 ( 0.000 2.027 -4.087) 4.562 14.117 ( 0.000 -6.124 -5.084) 7.960 14.233 ( 0.000 -4.077 2.458) 4.761 14.256 ( 0.000 1.130 -8.537) 8.612 15.055 ( 0.000 -18.288 -9.825) 20.760 17.253 ( 0.000 -6.013 7.368) 9.510 17.378 ( 0.000 -17.358 -1.693) 17.440 17.861 ( 0.000 -23.249 -0.732) 23.261 18.117 ( 0.000 -18.365 -4.873) 19.001 28.528 ( 0.000 13.856 4.058) 14.438 28.813 ( 0.000 9.921 -2.432) 10.215 29.025 ( 0.000 8.546 1.778) 8.729 29.167 ( 0.000 10.738 -0.371) 10.745 30.454 ( 0.000 12.237 1.404) 12.317 30.747 ( 0.000 4.455 -4.491) 6.325 31.671 ( 0.000 -7.339 -1.736) 7.542 31.797 ( 0.000 -6.744 -2.522) 7.200 85.880 ( 0.000 -1.606 2.816) 3.242 85.883 ( 0.000 -3.844 4.257) 5.735 86.881 ( 0.000 -15.682 15.522) 22.064 87.293 ( 0.000 -31.588 15.110) 35.016 ======================= Grid point 276 (95/162) ======================= q-point: ( 0.20 0.25 0.27) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 441 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.680 ( -0.560 22.273 12.128) 25.367 4.005 ( 9.053 23.002 13.926) 28.372 4.435 ( -11.001 16.181 8.813) 21.460 5.042 ( -2.021 6.946 3.188) 7.905 5.483 ( 2.199 4.934 2.852) 6.108 6.224 ( -9.370 1.953 -4.031) 10.385 6.891 ( 7.116 45.690 10.893) 47.506 7.054 ( 16.530 -0.911 2.951) 16.816 7.464 ( -8.238 26.251 0.974) 27.530 7.793 ( 1.908 14.351 -5.991) 15.668 7.909 ( 4.002 14.923 -0.851) 15.474 8.168 ( 2.420 12.351 -8.202) 15.022 8.910 ( -12.027 3.656 2.991) 12.921 8.984 ( -12.258 5.846 12.264) 18.299 9.458 ( 8.535 14.690 6.106) 18.053 9.792 ( 5.538 11.826 -2.759) 13.347 9.988 ( -7.279 9.759 4.201) 12.879 10.214 ( -1.732 10.069 -1.024) 10.268 10.413 ( 4.920 12.189 -7.186) 14.981 10.612 ( 5.739 8.423 -4.589) 11.178 10.868 ( 2.944 -2.934 -3.991) 5.763 11.195 ( -3.988 0.164 0.745) 4.061 11.331 ( 0.198 -0.209 -6.321) 6.327 11.579 ( 0.453 -3.878 -0.080) 3.905 13.007 ( 0.453 3.601 2.812) 4.591 13.073 ( 1.353 12.777 -1.710) 12.961 13.355 ( -3.252 12.604 -2.736) 13.301 13.491 ( -4.098 2.099 -3.784) 5.960 14.145 ( 2.741 -6.191 -4.527) 8.144 14.244 ( 0.051 -0.875 -4.585) 4.668 14.295 ( 4.977 -2.426 -2.590) 6.112 14.940 ( -10.738 -15.856 -8.412) 20.916 17.313 ( 5.339 -11.034 7.097) 14.164 17.450 ( 6.450 -15.564 0.085) 16.847 17.830 ( -2.469 -21.865 -2.031) 22.097 18.081 ( -3.717 -17.817 -5.249) 18.942 28.555 ( 2.635 13.797 3.653) 14.514 28.788 ( -2.558 10.700 -1.717) 11.135 29.031 ( 0.599 8.561 1.700) 8.749 29.139 ( -2.497 10.371 0.342) 10.673 30.496 ( 3.929 11.163 0.170) 11.836 30.729 ( -1.835 4.996 -4.340) 6.867 31.683 ( 1.153 -7.293 -1.797) 7.599 31.785 ( -1.220 -6.810 -2.435) 7.335 85.876 ( -0.001 -2.226 3.635) 4.262 85.890 ( 0.285 -2.763 3.364) 4.362 86.917 ( 3.597 -17.309 15.438) 23.471 87.251 ( -4.169 -30.089 15.091) 33.918 ======================= Grid point 277 (96/162) ======================= q-point: ( 0.40 0.25 0.27) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 441 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.750 ( 7.757 23.700 6.811) 25.850 3.958 ( -11.684 22.279 3.789) 25.441 4.487 ( 14.700 15.518 20.287) 29.470 4.816 ( -16.832 11.463 15.780) 25.762 5.684 ( 14.757 1.411 -2.979) 15.121 5.981 ( -14.623 0.857 -4.659) 15.371 7.071 ( 10.582 44.060 6.947) 45.842 7.277 ( -9.139 37.287 0.434) 38.394 7.412 ( 15.991 -2.730 1.646) 16.306 7.679 ( -10.338 1.681 -4.824) 11.531 8.089 ( 10.217 24.009 1.257) 26.122 8.208 ( -0.426 17.262 -5.511) 18.126 8.709 ( -6.390 3.313 7.089) 10.103 8.744 ( -9.421 -3.517 5.788) 11.603 9.617 ( 8.025 14.689 6.905) 18.107 9.775 ( -7.504 13.135 7.895) 17.063 9.987 ( 6.892 11.651 -2.666) 13.797 10.127 ( -6.429 12.693 -0.932) 14.259 10.543 ( 7.204 7.018 -10.432) 14.491 10.650 ( -2.561 6.844 -8.945) 11.550 10.953 ( 5.601 -1.070 -0.779) 5.756 11.078 ( -6.839 -1.137 1.953) 7.203 11.416 ( 7.078 1.541 -5.339) 8.999 11.542 ( -4.596 -0.875 -2.740) 5.421 13.038 ( 2.698 5.640 1.869) 6.525 13.086 ( -1.015 9.374 0.125) 9.430 13.313 ( 0.367 8.662 -3.820) 9.474 13.383 ( -5.823 3.834 -3.460) 7.783 14.203 ( 2.518 -4.181 -5.684) 7.493 14.236 ( -0.917 -1.720 -6.209) 6.508 14.449 ( 10.559 -5.988 -2.283) 12.352 14.690 ( -13.462 -10.991 -5.165) 18.130 17.437 ( 6.722 -16.748 6.663) 19.237 17.532 ( -0.995 -17.799 5.949) 18.793 17.832 ( 4.733 -16.969 -6.656) 18.832 17.971 ( -7.309 -16.430 -6.215) 19.026 28.626 ( 4.442 13.433 2.362) 14.344 28.717 ( -4.475 12.331 0.255) 13.120 29.050 ( 1.396 8.751 1.521) 8.992 29.087 ( -2.411 9.427 1.200) 9.804 30.588 ( 4.931 8.835 -2.086) 10.331 30.675 ( -3.716 6.549 -3.667) 8.375 31.714 ( 1.895 -7.161 -1.974) 7.666 31.753 ( -1.937 -6.975 -2.219) 7.572 85.881 ( 0.474 -2.013 3.564) 4.121 85.890 ( -0.310 -2.235 3.333) 4.025 87.015 ( 6.131 -21.390 15.241) 26.970 87.143 ( -6.471 -26.215 15.101) 30.938 ======================= Grid point 280 (97/162) ======================= q-point: ( 0.00 0.31 0.27) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 264 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 4.036 ( 0.000 16.085 7.489) 17.743 4.447 ( 0.000 30.069 8.748) 31.315 4.920 ( 0.000 15.331 3.760) 15.785 5.082 ( 0.000 6.018 -7.915) 9.943 5.604 ( 0.000 2.549 -1.044) 2.754 6.313 ( 0.000 -3.182 -6.976) 7.668 6.648 ( 0.000 -13.928 7.607) 15.870 7.460 ( 0.000 11.393 11.438) 16.144 7.791 ( 0.000 8.851 -2.990) 9.343 8.034 ( 0.000 7.109 6.654) 9.737 8.135 ( 0.000 4.898 -3.304) 5.908 8.430 ( 0.000 22.351 -7.029) 23.430 9.049 ( 0.000 3.876 -0.626) 3.927 9.255 ( 0.000 -1.106 7.762) 7.841 9.567 ( 0.000 11.657 3.637) 12.211 10.007 ( 0.000 9.253 0.417) 9.263 10.286 ( 0.000 7.752 2.621) 8.183 10.423 ( 0.000 19.286 -7.419) 20.664 10.714 ( 0.000 12.472 -1.755) 12.595 10.791 ( 0.000 -1.045 -0.252) 1.075 10.867 ( 0.000 28.785 -7.035) 29.632 11.189 ( 0.000 -3.611 3.265) 4.868 11.430 ( 0.000 8.764 -14.755) 17.161 11.495 ( 0.000 -0.622 -1.078) 1.245 13.030 ( 0.000 1.464 6.830) 6.985 13.300 ( 0.000 10.049 -1.827) 10.213 13.573 ( 0.000 3.695 -2.485) 4.453 13.593 ( 0.000 6.422 -1.802) 6.670 14.021 ( 0.000 -4.102 -4.148) 5.834 14.209 ( 0.000 1.904 4.790) 5.155 14.290 ( 0.000 1.943 -8.311) 8.535 14.779 ( 0.000 -9.908 -10.079) 14.134 17.035 ( 0.000 -17.294 -1.238) 17.338 17.106 ( 0.000 -9.197 2.628) 9.565 17.411 ( 0.000 -22.476 0.952) 22.496 17.770 ( 0.000 -17.570 -5.644) 18.455 28.777 ( 0.000 11.547 2.320) 11.778 28.973 ( 0.000 6.747 -1.773) 6.976 29.179 ( 0.000 6.961 3.203) 7.663 29.349 ( 0.000 7.494 1.030) 7.564 30.700 ( 0.000 12.699 0.104) 12.699 30.850 ( 0.000 5.894 -3.914) 7.075 31.537 ( 0.000 -6.298 -0.524) 6.319 31.674 ( 0.000 -5.794 -1.833) 6.077 85.832 ( 0.000 -1.400 2.518) 2.881 85.854 ( 0.000 -1.016 1.682) 1.965 86.596 ( 0.000 -13.332 10.675) 17.079 86.771 ( 0.000 -22.269 10.397) 24.577 ======================= Grid point 281 (98/162) ======================= q-point: ( 0.20 0.31 0.27) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 440 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 4.072 ( 3.957 18.511 5.617) 19.745 4.513 ( 4.232 27.986 7.741) 29.344 4.758 ( -9.076 16.476 3.743) 19.179 5.158 ( 0.376 5.275 -1.638) 5.536 5.558 ( -0.158 3.068 -0.977) 3.224 6.210 ( -9.891 -2.791 -6.104) 11.953 6.857 ( 18.370 -14.100 3.718) 23.454 7.498 ( 3.121 8.062 9.595) 12.915 7.754 ( -2.809 10.603 -2.537) 11.258 7.997 ( -3.886 7.642 5.467) 10.168 8.225 ( 7.390 2.629 -1.785) 8.044 8.442 ( 1.858 23.280 -5.416) 23.974 8.860 ( -13.199 1.060 -2.813) 13.537 9.182 ( -9.975 8.516 15.176) 20.058 9.679 ( 9.185 7.250 -0.683) 11.722 10.067 ( 5.148 7.602 1.251) 9.265 10.171 ( -7.349 12.360 2.374) 14.575 10.440 ( -0.222 13.402 -6.097) 14.725 10.784 ( 4.647 16.302 -4.085) 17.437 10.820 ( 0.219 6.865 -4.265) 8.085 10.874 ( 3.399 16.246 -3.618) 16.987 11.147 ( -3.755 -1.187 2.175) 4.499 11.436 ( 2.012 8.544 -11.908) 14.793 11.549 ( 3.251 1.455 -4.498) 5.738 13.028 ( 0.326 1.159 7.045) 7.147 13.281 ( -2.377 7.641 0.003) 8.002 13.522 ( -4.057 5.541 -4.002) 7.948 13.566 ( -2.702 5.970 -2.613) 7.055 14.046 ( 2.754 -3.984 -2.316) 5.369 14.236 ( 0.527 0.729 0.180) 0.918 14.301 ( 2.667 1.757 -5.351) 6.231 14.707 ( -6.738 -7.973 -8.236) 13.296 17.032 ( 1.342 -16.421 1.720) 16.565 17.176 ( 3.836 -13.534 1.930) 14.199 17.416 ( 1.692 -20.046 -1.449) 20.169 17.743 ( -2.849 -17.210 -5.897) 18.414 28.800 ( 2.286 11.317 1.923) 11.704 28.961 ( -1.265 7.332 -1.532) 7.596 29.185 ( 0.610 6.901 3.198) 7.630 29.318 ( -2.869 7.517 1.683) 8.220 30.724 ( 2.163 11.856 -0.564) 12.065 30.842 ( -0.777 6.417 -3.716) 7.455 31.549 ( 1.225 -6.279 -0.669) 6.433 31.660 ( -1.348 -5.859 -1.726) 6.255 85.838 ( 0.629 -1.112 2.398) 2.717 85.858 ( 0.336 -0.945 1.670) 1.948 86.607 ( 1.129 -14.338 10.686) 17.917 86.749 ( -2.102 -21.564 10.427) 24.045 ======================= Grid point 282 (99/162) ======================= q-point: ( 0.40 0.31 0.27) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 440 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 4.199 ( 9.032 21.939 2.574) 23.865 4.410 ( -11.603 23.487 0.578) 26.203 4.804 ( 10.600 17.239 12.310) 23.687 5.029 ( -11.006 10.634 8.226) 17.375 5.693 ( 12.134 -0.240 -5.299) 13.243 5.963 ( -14.274 -2.226 -5.983) 15.636 7.247 ( 18.800 -12.965 -0.530) 22.843 7.503 ( -5.767 -5.530 1.641) 8.157 7.741 ( 3.401 17.080 3.415) 17.747 7.873 ( -8.207 12.550 6.445) 16.321 8.365 ( 6.620 1.618 -5.358) 8.669 8.481 ( -2.467 9.844 -5.789) 11.684 8.703 ( 2.938 11.334 6.082) 13.194 8.921 ( -14.649 14.363 13.918) 24.791 9.849 ( 7.914 6.528 0.816) 10.292 9.999 ( -7.618 6.377 2.448) 10.231 10.233 ( 8.524 13.360 0.815) 15.868 10.385 ( -5.873 12.645 -1.770) 14.055 10.818 ( 2.434 17.782 -10.530) 20.808 10.860 ( 0.093 12.888 -8.851) 15.635 10.958 ( 4.833 5.089 0.172) 7.021 11.059 ( -5.058 2.747 0.853) 5.819 11.510 ( 4.666 7.462 -9.850) 13.208 11.575 ( -1.155 4.306 -7.264) 8.523 13.069 ( 4.297 0.811 6.599) 7.916 13.188 ( -6.759 2.285 4.188) 8.273 13.473 ( -0.081 8.065 -5.505) 9.765 13.506 ( -2.861 7.509 -4.377) 9.151 14.122 ( 4.503 -3.618 -2.772) 6.407 14.201 ( -3.279 -1.692 -4.048) 5.477 14.402 ( 6.642 0.113 -2.131) 6.976 14.551 ( -8.363 -3.751 -4.362) 10.151 17.093 ( 4.352 -17.795 3.512) 18.653 17.177 ( -3.322 -18.270 4.026) 19.001 17.515 ( 7.452 -15.823 -5.600) 18.364 17.655 ( -6.111 -16.246 -6.237) 18.444 28.859 ( 3.424 10.470 0.775) 11.043 28.922 ( -2.750 8.882 -0.653) 9.321 29.206 ( 1.726 6.918 3.152) 7.796 29.255 ( -3.133 7.268 2.739) 8.375 30.773 ( 2.617 9.918 -1.920) 10.436 30.818 ( -1.791 7.878 -3.067) 8.641 31.582 ( 2.051 -6.190 -1.027) 6.602 31.625 ( -2.128 -6.021 -1.430) 6.544 85.853 ( 0.711 -0.720 2.084) 2.317 85.862 ( -0.114 -0.724 1.774) 1.919 86.642 ( 2.403 -16.834 10.647) 20.063 86.697 ( -3.005 -19.589 10.525) 22.440 ======================= Grid point 285 (100/162) ======================= q-point: ( 0.00 0.38 0.27) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 267 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 4.363 ( 0.000 17.713 -2.274) 17.858 4.961 ( 0.000 18.553 1.954) 18.656 5.182 ( 0.000 10.272 0.165) 10.273 5.251 ( 0.000 14.722 -8.356) 16.928 5.654 ( 0.000 3.533 -4.509) 5.728 6.137 ( 0.000 -17.147 -17.816) 24.727 6.416 ( 0.000 -6.465 14.545) 15.917 7.423 ( 0.000 -11.084 8.848) 14.182 7.875 ( 0.000 0.310 -0.918) 0.969 8.130 ( 0.000 -2.300 0.974) 2.498 8.139 ( 0.000 4.024 9.270) 10.106 8.675 ( 0.000 -0.564 -1.069) 1.208 9.237 ( 0.000 12.297 -6.047) 13.703 9.319 ( 0.000 9.738 -2.787) 10.129 9.777 ( 0.000 9.487 2.148) 9.727 10.056 ( 0.000 -1.879 3.841) 4.276 10.429 ( 0.000 7.078 2.671) 7.565 10.640 ( 0.000 3.977 -1.884) 4.401 10.777 ( 0.000 -0.076 3.469) 3.470 10.942 ( 0.000 1.916 2.692) 3.304 11.292 ( 0.000 16.718 -9.828) 19.393 11.385 ( 0.000 21.359 -9.346) 23.314 11.547 ( 0.000 5.487 -4.618) 7.172 11.628 ( 0.000 10.824 -15.333) 18.769 13.140 ( 0.000 11.087 4.864) 12.107 13.459 ( 0.000 6.791 -0.915) 6.853 13.688 ( 0.000 4.501 -2.404) 5.103 13.695 ( 0.000 8.737 -2.586) 9.111 13.954 ( 0.000 -2.302 1.325) 2.657 14.276 ( 0.000 3.579 5.809) 6.823 14.321 ( 0.000 1.090 -6.090) 6.187 14.655 ( 0.000 -3.505 -7.673) 8.436 16.725 ( 0.000 -13.941 -0.841) 13.967 16.896 ( 0.000 -12.018 0.085) 12.018 17.004 ( 0.000 -18.354 2.064) 18.470 17.420 ( 0.000 -18.308 -5.189) 19.029 28.979 ( 0.000 9.166 1.379) 9.269 29.085 ( 0.000 4.799 -0.752) 4.858 29.289 ( 0.000 4.197 2.990) 5.153 29.449 ( 0.000 2.623 1.172) 2.873 30.940 ( 0.000 11.623 -0.498) 11.634 30.971 ( 0.000 6.415 -2.860) 7.024 31.427 ( 0.000 -5.053 0.384) 5.067 31.569 ( 0.000 -5.039 -1.021) 5.141 85.826 ( 0.000 0.666 1.452) 1.598 85.843 ( 0.000 -0.034 1.031) 1.031 86.365 ( 0.000 -10.304 6.561) 12.215 86.413 ( 0.000 -14.637 6.123) 15.866 ======================= Grid point 286 (101/162) ======================= q-point: ( 0.20 0.38 0.27) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 441 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 4.427 ( 6.413 18.388 -2.510) 19.635 5.032 ( 6.290 18.503 3.431) 19.842 5.063 ( -9.566 17.496 -2.608) 20.110 5.270 ( -0.190 8.464 -4.531) 9.602 5.611 ( -1.387 2.330 -5.282) 5.937 6.119 ( -6.242 -6.808 -10.445) 13.942 6.548 ( 15.156 -15.733 6.700) 22.850 7.402 ( -3.096 -13.641 6.083) 15.253 7.869 ( -0.022 1.721 1.299) 2.156 8.072 ( -3.616 1.296 7.109) 8.080 8.217 ( 5.292 -1.221 3.259) 6.334 8.627 ( -5.316 -3.574 -1.284) 6.533 9.093 ( -5.227 18.167 -4.692) 19.477 9.396 ( -1.799 12.996 4.336) 13.818 9.779 ( 2.886 3.320 -2.412) 5.017 10.094 ( 1.076 -2.155 3.484) 4.236 10.387 ( -1.356 9.250 1.425) 9.457 10.623 ( -0.679 4.878 -3.210) 5.879 10.825 ( 2.850 0.065 3.908) 4.838 10.939 ( -0.455 -1.556 2.969) 3.383 11.299 ( 1.362 20.482 -10.656) 23.128 11.392 ( 0.299 20.162 -10.081) 22.544 11.597 ( 4.162 7.120 -8.669) 11.966 11.665 ( 2.984 9.892 -14.114) 17.492 13.135 ( -0.106 10.995 6.227) 12.637 13.406 ( -5.446 6.752 2.069) 8.918 13.652 ( -2.443 6.730 -5.040) 8.756 13.679 ( -1.559 6.767 -2.411) 7.351 13.987 ( 3.224 -1.772 1.699) 4.052 14.259 ( -2.757 0.980 -0.175) 2.931 14.341 ( 2.642 1.709 -0.591) 3.201 14.609 ( -4.345 -2.923 -5.778) 7.798 16.728 ( 1.010 -13.810 0.797) 13.869 16.899 ( -1.200 -13.998 1.574) 14.138 17.060 ( 5.992 -16.635 -1.545) 17.748 17.399 ( -2.238 -18.042 -5.389) 18.962 28.998 ( 1.807 8.989 1.045) 9.229 29.084 ( -0.184 5.341 -0.723) 5.393 29.291 ( 0.310 3.874 3.045) 4.937 29.420 ( -2.733 2.782 1.629) 4.227 30.950 ( 0.847 11.069 -0.790) 11.129 30.974 ( 0.181 6.870 -2.670) 7.373 31.439 ( 1.208 -5.126 0.195) 5.270 31.555 ( -1.448 -5.072 -0.931) 5.356 85.837 ( 0.988 0.864 1.343) 1.878 85.851 ( 0.710 0.278 0.961) 1.226 86.360 ( -0.406 -10.957 6.609) 12.802 86.399 ( -1.263 -14.492 6.219) 15.821 ======================= Grid point 287 (102/162) ======================= q-point: ( 0.40 0.38 0.27) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 441 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 4.603 ( 11.112 19.536 -2.932) 22.666 4.840 ( -12.411 19.470 -3.191) 23.309 5.159 ( 5.418 18.108 4.532) 19.437 5.237 ( -2.866 11.080 0.234) 11.447 5.680 ( 8.777 -0.861 -6.944) 11.225 5.911 ( -13.021 -2.290 -6.102) 14.561 6.920 ( 20.052 -19.915 0.845) 28.274 7.254 ( -12.747 -18.478 1.555) 22.502 7.899 ( 3.318 3.156 5.237) 6.957 7.986 ( -4.946 2.436 7.239) 9.100 8.336 ( 6.747 -3.626 1.707) 7.847 8.483 ( -8.152 -4.639 -0.571) 9.397 9.099 ( 5.272 20.756 0.642) 21.425 9.257 ( -9.551 18.000 5.550) 21.119 9.889 ( 6.927 -1.392 -1.734) 7.275 10.027 ( -6.592 -2.266 1.725) 7.181 10.456 ( 6.981 9.520 -0.627) 11.822 10.584 ( -4.603 7.757 -2.604) 9.388 10.873 ( 2.775 -1.966 2.783) 4.394 10.922 ( -1.634 -2.800 2.344) 4.000 11.346 ( 2.796 22.702 -11.952) 25.808 11.387 ( -1.106 20.878 -11.406) 23.817 11.674 ( 3.181 8.239 -13.161) 15.849 11.705 ( 0.351 8.550 -13.598) 16.067 13.161 ( 3.366 9.986 7.820) 13.123 13.270 ( -7.255 7.808 6.281) 12.371 13.627 ( 0.019 7.302 -5.467) 9.122 13.646 ( -1.625 7.052 -4.267) 8.401 14.071 ( 5.131 -1.491 0.766) 5.398 14.176 ( -5.224 -0.863 -1.113) 5.411 14.411 ( 4.335 -0.044 0.243) 4.342 14.508 ( -5.390 -1.692 -2.083) 6.021 16.774 ( 3.441 -14.000 2.161) 14.578 16.847 ( -3.628 -14.478 2.427) 15.122 17.202 ( 7.479 -16.432 -4.704) 18.657 17.328 ( -5.130 -17.309 -5.555) 18.889 29.040 ( 2.186 8.268 0.194) 8.554 29.073 ( -1.034 6.780 -0.513) 6.877 29.308 ( 1.605 3.260 3.074) 4.759 29.357 ( -3.241 2.988 2.565) 5.100 30.967 ( 0.737 9.686 -1.457) 9.823 30.975 ( -0.115 8.094 -2.155) 8.377 31.472 ( 2.128 -5.202 -0.236) 5.626 31.517 ( -2.274 -5.154 -0.660) 5.672 85.857 ( 0.851 1.166 1.078) 1.802 85.863 ( 0.259 0.932 0.901) 1.322 86.356 ( 0.214 -12.517 6.636) 14.169 86.372 ( -1.307 -13.885 6.459) 15.369 ======================= Grid point 290 (103/162) ======================= q-point: ( 0.00 0.44 0.27) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 264 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 4.735 ( 0.000 20.333 -9.769) 22.558 5.141 ( 0.000 3.982 -8.240) 9.151 5.291 ( 0.000 1.487 -4.577) 4.812 5.636 ( 0.000 15.059 -7.048) 16.627 5.718 ( 0.000 -19.892 -13.345) 23.954 5.759 ( 0.000 6.330 -5.422) 8.334 6.395 ( 0.000 4.610 11.543) 12.430 7.089 ( 0.000 -21.690 7.201) 22.854 7.888 ( 0.000 2.454 5.506) 6.028 8.069 ( 0.000 -4.018 3.487) 5.320 8.234 ( 0.000 5.818 4.071) 7.101 8.540 ( 0.000 -9.625 1.670) 9.769 9.446 ( 0.000 8.666 -8.841) 12.380 9.517 ( 0.000 7.565 -8.564) 11.427 9.908 ( 0.000 3.620 2.990) 4.695 9.990 ( 0.000 -3.757 5.273) 6.475 10.554 ( 0.000 5.394 1.775) 5.678 10.667 ( 0.000 -0.452 0.273) 0.528 10.793 ( 0.000 1.775 5.056) 5.358 10.904 ( 0.000 -3.196 4.389) 5.429 11.564 ( 0.000 8.728 -13.565) 16.130 11.649 ( 0.000 3.279 -9.394) 9.950 11.693 ( 0.000 11.528 -9.885) 15.186 11.816 ( 0.000 6.715 -14.500) 15.980 13.429 ( 0.000 15.846 2.320) 16.015 13.586 ( 0.000 6.215 -0.373) 6.226 13.765 ( 0.000 2.111 -3.567) 4.145 13.802 ( 0.000 -1.248 -10.928) 10.999 14.052 ( 0.000 15.183 12.290) 19.534 14.312 ( 0.000 0.164 5.018) 5.021 14.331 ( 0.000 0.111 -3.001) 3.003 14.595 ( 0.000 -4.638 -2.508) 5.273 16.512 ( 0.000 -7.230 0.287) 7.235 16.655 ( 0.000 -11.879 -0.473) 11.888 16.751 ( 0.000 -5.853 0.434) 5.869 17.067 ( 0.000 -17.151 -4.060) 17.625 29.129 ( 0.000 5.872 1.326) 6.020 29.162 ( 0.000 3.011 0.375) 3.035 29.349 ( 0.000 2.402 1.611) 2.892 29.455 ( 0.000 -1.643 0.665) 1.772 31.095 ( 0.000 6.052 -1.586) 6.256 31.143 ( 0.000 8.613 -0.807) 8.651 31.339 ( 0.000 -3.669 0.832) 3.762 31.469 ( 0.000 -5.466 -0.340) 5.477 85.851 ( 0.000 1.589 1.347) 2.084 85.853 ( 0.000 0.961 1.076) 1.442 86.194 ( 0.000 -7.693 2.972) 8.247 86.198 ( 0.000 -6.641 3.410) 7.466 ======================= Grid point 291 (104/162) ======================= q-point: ( 0.20 0.44 0.27) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 440 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 4.798 ( 6.274 19.523 -9.595) 22.640 5.211 ( 6.248 3.342 -8.583) 11.130 5.263 ( -3.089 4.725 -5.201) 7.676 5.592 ( -5.918 -2.157 -9.721) 11.583 5.625 ( 0.495 14.944 -4.946) 15.749 5.963 ( 10.424 -6.238 -8.274) 14.698 6.353 ( -1.837 -1.149 10.652) 10.870 7.028 ( -6.544 -23.109 5.802) 24.709 7.905 ( 1.881 3.282 5.686) 6.829 8.083 ( 0.759 -1.666 3.729) 4.154 8.213 ( -1.367 2.297 4.612) 5.331 8.481 ( -5.584 -9.173 1.769) 10.884 9.397 ( -0.943 12.502 -6.171) 13.974 9.605 ( 4.049 6.075 -5.221) 8.975 9.818 ( -5.361 2.001 2.475) 6.235 10.020 ( -0.593 -5.000 3.777) 6.294 10.542 ( 0.525 6.481 0.493) 6.521 10.667 ( 1.490 0.195 -0.855) 1.729 10.830 ( 1.382 0.445 4.397) 4.630 10.886 ( -1.491 -2.749 3.515) 4.705 11.596 ( 3.239 9.272 -12.870) 16.189 11.679 ( 1.941 6.509 -11.615) 13.456 11.725 ( 3.256 8.448 -11.730) 14.818 11.843 ( 1.981 6.274 -15.380) 16.728 13.418 ( -0.533 15.132 4.098) 15.687 13.573 ( -1.779 9.662 0.850) 9.861 13.736 ( -1.434 1.351 -4.366) 4.790 13.808 ( -0.867 3.044 -8.142) 8.736 14.042 ( 0.314 10.139 10.145) 14.346 14.267 ( -4.064 0.002 0.634) 4.114 14.344 ( 0.797 -1.277 2.257) 2.713 14.547 ( -4.495 -5.066 -0.856) 6.827 16.526 ( 1.889 -5.974 0.842) 6.322 16.692 ( 0.866 -6.856 -0.932) 6.973 16.768 ( 3.583 -11.416 -0.741) 11.988 17.050 ( -1.816 -17.003 -4.206) 17.609 29.147 ( 1.700 5.973 1.069) 6.302 29.172 ( 0.925 3.598 0.304) 3.727 29.341 ( -0.721 1.641 1.732) 2.493 29.430 ( -2.458 -1.478 0.935) 3.017 31.105 ( 0.954 6.412 -1.445) 6.642 31.147 ( 0.246 8.749 -0.781) 8.787 31.346 ( 0.804 -4.275 0.589) 4.390 31.454 ( -1.459 -5.443 -0.318) 5.644 85.867 ( 1.499 1.863 1.174) 2.664 85.870 ( 1.568 1.654 1.070) 2.517 86.178 ( -1.534 -8.019 3.140) 8.747 86.182 ( -1.507 -7.284 3.409) 8.183 ======================= Grid point 292 (105/162) ======================= q-point: ( 0.40 0.44 0.27) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 440 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 4.962 ( 9.791 17.069 -8.990) 21.634 5.150 ( -8.431 12.443 -7.481) 16.789 5.344 ( 6.675 1.796 -9.249) 11.547 5.472 ( -6.444 2.615 -8.796) 11.213 5.731 ( 10.307 11.838 -0.988) 15.727 5.956 ( -10.010 9.836 -0.159) 14.035 6.505 ( 16.022 -21.506 2.469) 26.932 6.822 ( -14.338 -24.578 2.893) 28.601 7.965 ( 4.175 4.612 5.781) 8.492 8.053 ( -3.968 4.762 4.993) 7.959 8.237 ( 4.193 -6.230 4.293) 8.650 8.351 ( -6.904 -8.053 2.869) 10.988 9.438 ( 4.920 14.099 -1.518) 15.010 9.566 ( -6.895 13.242 1.967) 15.058 9.818 ( 5.042 -5.609 -2.117) 7.833 9.940 ( -6.374 -6.207 1.454) 9.015 10.611 ( 5.644 6.448 -0.726) 8.600 10.698 ( -1.073 4.068 -1.432) 4.444 10.822 ( 0.420 -2.908 2.572) 3.904 10.861 ( -1.819 -3.143 2.252) 4.273 11.670 ( 3.569 10.357 -13.391) 17.301 11.708 ( 0.199 11.941 -13.670) 18.152 11.794 ( 3.646 3.585 -15.283) 16.116 11.853 ( -1.550 4.942 -16.682) 17.468 13.432 ( 2.385 15.222 6.294) 16.644 13.507 ( -4.502 15.144 4.562) 16.444 13.733 ( 1.292 2.470 -3.961) 4.844 13.772 ( -2.200 4.526 -5.573) 7.509 14.085 ( 3.668 4.219 5.090) 7.561 14.172 ( -5.043 0.891 2.066) 5.522 14.369 ( 2.281 -4.601 3.122) 6.010 14.445 ( -5.154 -5.762 1.891) 7.959 16.586 ( 3.852 -4.209 0.685) 5.747 16.659 ( -3.222 -3.659 0.095) 4.876 16.883 ( 6.441 -15.572 -3.450) 17.201 16.991 ( -4.339 -16.527 -4.270) 17.612 29.183 ( 1.470 6.169 0.391) 6.354 29.191 ( 0.679 5.377 0.116) 5.421 29.334 ( 0.524 -0.395 2.018) 2.121 29.372 ( -3.012 -1.273 1.617) 3.648 31.127 ( 1.207 7.376 -1.111) 7.556 31.145 ( -0.523 8.445 -0.829) 8.502 31.373 ( 1.918 -5.131 0.106) 5.479 31.416 ( -2.270 -5.387 -0.207) 5.849 85.898 ( 1.288 2.994 0.899) 3.381 85.901 ( 1.075 3.019 0.870) 3.321 86.148 ( -1.076 -9.058 3.465) 9.758 86.150 ( -1.271 -8.746 3.538) 9.520 ======================= Grid point 295 (106/162) ======================= q-point: ( 0.00 -0.50 0.27) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 150 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 5.113 ( 0.000 -13.037 -12.584) 18.119 5.113 ( 0.000 13.037 -12.584) 18.119 5.327 ( 0.000 -8.215 -9.715) 12.723 5.327 ( 0.000 8.215 -9.715) 12.723 5.836 ( 0.000 -0.584 -5.561) 5.591 5.836 ( 0.000 0.585 -5.561) 5.591 6.651 ( 0.000 -20.660 9.240) 22.632 6.651 ( 0.000 20.660 9.240) 22.632 7.973 ( 0.000 -5.451 5.337) 7.629 7.973 ( 0.000 5.452 5.337) 7.629 8.365 ( 0.000 -7.800 2.479) 8.184 8.365 ( 0.000 7.800 2.479) 8.184 9.564 ( 0.000 -2.691 -10.598) 10.934 9.564 ( 0.000 2.691 -10.598) 10.934 9.942 ( 0.000 -1.097 5.419) 5.529 9.942 ( 0.000 1.097 5.419) 5.529 10.634 ( 0.000 -2.827 1.245) 3.089 10.634 ( 0.000 2.827 1.245) 3.089 10.842 ( 0.000 -3.007 4.862) 5.716 10.842 ( 0.000 3.007 4.862) 5.716 11.660 ( 0.000 -1.932 -12.172) 12.324 11.660 ( 0.000 1.932 -12.172) 12.324 11.847 ( 0.000 -3.584 -12.603) 13.102 11.847 ( 0.000 3.584 -12.603) 13.102 13.656 ( 0.000 -3.693 3.525) 5.106 13.656 ( 0.000 3.693 3.525) 5.106 13.752 ( 0.000 -0.361 -8.564) 8.571 13.752 ( 0.000 0.361 -8.564) 8.571 14.305 ( 0.000 -1.685 1.979) 2.599 14.305 ( 0.000 1.685 1.979) 2.599 14.410 ( 0.000 -13.437 4.147) 14.062 14.410 ( 0.000 13.437 4.147) 14.062 16.481 ( 0.000 -4.514 0.313) 4.525 16.481 ( 0.000 4.514 0.313) 4.525 16.794 ( 0.000 -9.421 -2.385) 9.718 16.794 ( 0.000 9.421 -2.385) 9.718 29.192 ( 0.000 -0.425 1.342) 1.407 29.192 ( 0.000 0.425 1.342) 1.407 29.402 ( 0.000 -3.180 0.430) 3.209 29.402 ( 0.000 3.180 0.430) 3.209 31.197 ( 0.000 -3.666 -0.830) 3.759 31.197 ( 0.000 3.666 -0.830) 3.759 31.355 ( 0.000 -5.700 0.306) 5.708 31.355 ( 0.000 5.700 0.306) 5.708 85.869 ( 0.000 -0.143 1.582) 1.588 85.869 ( 0.000 0.143 1.582) 1.588 86.122 ( 0.000 -0.454 1.744) 1.802 86.122 ( 0.000 0.454 1.744) 1.802 ======================= Grid point 297 (107/162) ======================= q-point: ( 0.20 -0.50 0.27) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 248 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 5.144 ( 3.451 -12.345 -12.549) 17.938 5.144 ( 3.451 12.345 -12.549) 17.938 5.374 ( 2.734 -9.222 -10.306) 14.097 5.374 ( 2.734 9.222 -10.306) 14.097 5.870 ( 4.778 -6.867 -3.782) 9.181 5.870 ( 4.778 6.867 -3.782) 9.181 6.572 ( -8.024 -21.138 7.990) 23.979 6.572 ( -8.024 21.138 7.990) 23.980 7.999 ( 2.740 -5.642 5.418) 8.288 7.999 ( 2.740 5.642 5.418) 8.288 8.315 ( -4.819 -7.327 3.035) 9.280 8.315 ( -4.819 7.327 3.035) 9.280 9.585 ( 2.345 -6.562 -7.965) 10.583 9.585 ( 2.345 6.562 -7.965) 10.583 9.908 ( -3.933 -6.120 4.656) 8.638 9.908 ( -3.933 6.120 4.656) 8.638 10.637 ( 1.567 -3.248 0.220) 3.613 10.637 ( 1.567 3.248 0.220) 3.613 10.846 ( -0.414 -1.326 3.873) 4.115 10.846 ( -0.414 1.326 3.873) 4.115 11.699 ( 3.736 -2.129 -12.952) 13.647 11.699 ( 3.736 2.129 -12.952) 13.647 11.869 ( 1.527 -3.659 -14.045) 14.594 11.869 ( 1.527 3.659 -14.045) 14.594 13.639 ( -0.471 -6.456 2.793) 7.050 13.639 ( -0.471 6.456 2.793) 7.050 13.778 ( 1.343 -5.286 -6.799) 8.716 13.778 ( 1.343 5.286 -6.799) 8.716 14.256 ( -3.830 -3.458 3.664) 6.328 14.256 ( -3.830 3.458 3.664) 6.329 14.376 ( -3.422 -9.700 4.377) 11.178 14.376 ( -3.422 9.700 4.377) 11.178 16.528 ( 4.417 -6.211 -0.397) 7.632 16.528 ( 4.417 6.211 -0.397) 7.632 16.778 ( -1.678 -9.433 -2.445) 9.889 16.778 ( -1.678 9.433 -2.445) 9.889 29.211 ( 1.871 -0.290 1.260) 2.275 29.211 ( 1.871 0.290 1.260) 2.275 29.381 ( -2.110 -2.810 0.522) 3.553 29.381 ( -2.110 2.810 0.522) 3.553 31.213 ( 1.611 -3.876 -0.724) 4.259 31.213 ( 1.611 3.876 -0.724) 4.259 31.341 ( -1.375 -5.514 0.193) 5.686 31.341 ( -1.375 5.514 0.193) 5.686 85.893 ( 2.390 -0.251 1.596) 2.884 85.893 ( 2.390 0.252 1.596) 2.884 86.098 ( -2.378 -0.458 1.727) 2.974 86.098 ( -2.378 0.458 1.727) 2.974 ======================= Grid point 299 (108/162) ======================= q-point: ( 0.40 -0.50 0.27) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 248 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 5.245 ( 6.338 -10.207 -12.295) 17.191 5.245 ( 6.338 10.207 -12.295) 17.191 5.360 ( -4.307 -8.395 -11.648) 14.990 5.360 ( -4.307 8.395 -11.648) 14.990 6.060 ( 13.877 -16.955 0.502) 21.916 6.060 ( 13.877 16.956 0.502) 21.916 6.349 ( -14.135 -20.938 4.715) 25.699 6.349 ( -14.135 20.938 4.715) 25.699 8.079 ( 5.296 -5.990 5.272) 9.577 8.079 ( 5.296 5.990 5.272) 9.577 8.198 ( -6.504 -6.497 4.328) 10.161 8.198 ( -6.504 6.497 4.328) 10.161 9.662 ( 5.556 -8.811 -2.866) 10.804 9.662 ( 5.556 8.811 -2.866) 10.804 9.792 ( -7.143 -8.662 1.815) 11.373 9.792 ( -7.143 8.662 1.815) 11.373 10.711 ( 5.226 -3.441 -0.074) 6.257 10.711 ( 5.226 3.441 -0.074) 6.257 10.805 ( -3.761 -2.158 1.704) 4.659 10.805 ( -3.761 2.158 1.704) 4.659 11.791 ( 5.091 -2.515 -14.888) 15.934 11.791 ( 5.091 2.515 -14.888) 15.934 11.869 ( -2.159 -3.279 -15.859) 16.338 11.869 ( -2.159 3.279 -15.859) 16.338 13.670 ( 3.794 -7.420 1.658) 8.497 13.670 ( 3.793 7.420 1.658) 8.497 13.759 ( -3.752 -6.520 -2.982) 8.092 13.759 ( -3.752 6.520 -2.982) 8.092 14.218 ( 1.143 -1.975 5.266) 5.739 14.218 ( 1.143 1.975 5.266) 5.739 14.288 ( -4.927 -4.992 4.798) 8.498 14.288 ( -4.927 4.992 4.798) 8.498 16.631 ( 5.487 -8.277 -1.639) 10.065 16.631 ( 5.487 8.277 -1.639) 10.065 16.725 ( -3.864 -9.228 -2.347) 10.276 16.725 ( -3.864 9.228 -2.348) 10.276 29.261 ( 3.133 -0.852 1.041) 3.410 29.261 ( 3.133 0.852 1.041) 3.410 29.326 ( -3.279 -1.891 0.759) 3.861 29.326 ( -3.279 1.891 0.759) 3.861 31.255 ( 2.475 -4.403 -0.445) 5.070 31.255 ( 2.475 4.403 -0.445) 5.070 31.303 ( -2.330 -5.024 -0.096) 5.539 31.303 ( -2.330 5.024 -0.096) 5.539 85.957 ( 3.861 -0.384 1.633) 4.210 85.957 ( 3.861 0.384 1.633) 4.210 86.035 ( -3.853 -0.449 1.684) 4.229 86.035 ( -3.853 0.449 1.684) 4.229 ======================= Grid point 340 (109/162) ======================= q-point: ( 0.00 0.00 0.36) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 162 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.678 ( 0.000 0.000 26.864) 26.864 2.959 ( 0.000 0.000 30.261) 30.261 3.759 ( 0.000 0.000 -10.819) 10.819 4.082 ( 0.000 0.000 -1.424) 1.424 4.338 ( 0.000 0.000 12.670) 12.670 4.732 ( 0.000 0.000 34.695) 34.695 4.971 ( 0.000 0.000 -8.264) 8.264 5.220 ( 0.000 0.000 6.667) 6.667 6.492 ( 0.000 0.000 -0.651) 0.651 6.805 ( 0.000 0.000 -8.525) 8.525 7.789 ( 0.000 0.000 -6.812) 6.812 7.812 ( 0.000 0.000 5.912) 5.912 8.372 ( 0.000 0.000 0.265) 0.265 8.419 ( 0.000 0.000 -1.330) 1.330 9.122 ( 0.000 0.000 0.087) 0.087 9.135 ( 0.000 0.000 -0.376) 0.376 9.448 ( 0.000 0.000 -1.215) 1.215 9.691 ( 0.000 0.000 -9.764) 9.764 10.136 ( 0.000 0.000 15.588) 15.588 10.543 ( 0.000 0.000 -2.520) 2.520 11.216 ( 0.000 0.000 0.531) 0.531 11.430 ( 0.000 0.000 -5.151) 5.151 11.747 ( 0.000 0.000 4.187) 4.187 12.083 ( 0.000 0.000 0.217) 0.217 12.094 ( 0.000 0.000 -0.167) 0.167 12.179 ( 0.000 0.000 -0.157) 0.157 12.180 ( 0.000 0.000 -0.194) 0.194 12.280 ( 0.000 0.000 -15.223) 15.223 14.274 ( 0.000 0.000 -2.768) 2.768 14.456 ( 0.000 0.000 -6.446) 6.446 15.094 ( 0.000 0.000 19.968) 19.968 16.246 ( 0.000 0.000 -13.415) 13.415 17.870 ( 0.000 0.000 17.475) 17.475 18.176 ( 0.000 0.000 1.555) 1.555 19.000 ( 0.000 0.000 -0.037) 0.037 19.367 ( 0.000 0.000 -9.263) 9.263 27.847 ( 0.000 0.000 10.357) 10.357 27.902 ( 0.000 0.000 9.201) 9.201 28.429 ( 0.000 0.000 -7.532) 7.532 28.464 ( 0.000 0.000 -8.874) 8.874 30.093 ( 0.000 0.000 9.254) 9.254 30.552 ( 0.000 0.000 -5.811) 5.811 31.998 ( 0.000 0.000 -2.535) 2.535 32.096 ( 0.000 0.000 -4.012) 4.012 86.132 ( 0.000 0.000 8.686) 8.686 86.372 ( 0.000 0.000 3.193) 3.193 88.379 ( 0.000 0.000 29.191) 29.191 89.973 ( 0.000 0.000 -23.655) 23.655 ======================= Grid point 341 (110/162) ======================= q-point: ( 0.20 0.00 0.36) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 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| 2.762 ( 8.277 0.000 24.243) 25.617 2.884 ( -4.506 0.000 24.002) 24.422 3.596 ( -13.948 0.000 -2.084) 14.103 3.762 ( -26.482 0.000 -1.633) 26.532 4.463 ( 10.107 0.000 5.237) 11.384 4.936 ( -3.627 0.000 -7.630) 8.448 4.942 ( 18.494 0.000 33.386) 38.166 5.423 ( 13.613 0.000 8.102) 15.842 6.452 ( -0.878 0.000 4.587) 4.671 6.859 ( 2.446 0.000 -6.185) 6.651 7.716 ( -1.476 0.000 2.663) 3.045 7.918 ( 4.569 0.000 -4.925) 6.718 8.376 ( 0.423 0.000 0.121) 0.440 8.414 ( -0.476 0.000 -1.168) 1.261 9.124 ( 0.153 0.000 0.033) 0.156 9.134 ( -0.096 0.000 -0.340) 0.353 9.407 ( -5.020 0.000 -4.485) 6.732 9.505 ( -12.982 0.000 -9.199) 15.911 10.248 ( 8.092 0.000 11.548) 14.101 10.552 ( 0.418 0.000 -0.120) 0.435 11.216 ( 0.713 0.000 2.111) 2.228 11.432 ( -0.441 0.000 1.474) 1.539 11.802 ( 5.559 0.000 -2.300) 6.016 12.086 ( 0.263 0.000 0.189) 0.324 12.095 ( 0.067 0.000 -0.128) 0.145 12.177 ( -0.166 0.000 -0.164) 0.233 12.178 ( -0.161 0.000 -0.199) 0.256 12.260 ( -2.690 0.000 -15.141) 15.378 14.319 ( 3.852 0.000 -2.202) 4.437 14.488 ( 2.532 0.000 -5.603) 6.149 15.069 ( -0.585 0.000 15.251) 15.263 15.988 ( -21.957 0.000 -9.818) 24.052 18.137 ( 22.836 0.000 12.622) 26.092 18.264 ( 8.525 0.000 2.184) 8.801 18.926 ( -7.344 0.000 0.350) 7.352 19.286 ( -8.388 0.000 -6.469) 10.593 27.852 ( 0.494 0.000 10.253) 10.265 27.896 ( -0.541 0.000 9.319) 9.335 28.432 ( 0.356 0.000 -7.668) 7.676 28.461 ( -0.309 0.000 -8.753) 8.758 30.144 ( 4.914 0.000 6.871) 8.448 30.514 ( -3.833 0.000 -5.087) 6.370 32.008 ( 1.016 0.000 -2.640) 2.829 32.088 ( -0.814 0.000 -3.861) 3.946 86.146 ( 1.433 0.000 8.728) 8.845 86.337 ( -3.283 0.000 4.676) 5.713 88.510 ( 12.955 0.000 24.599) 27.802 89.786 ( -17.935 0.000 -16.910) 24.650 ======================= Grid point 342 (111/162) ======================= q-point: ( 0.40 0.00 0.36) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 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| 2.908 ( 8.844 0.000 11.471) 14.485 2.986 ( 14.071 0.000 17.484) 22.443 3.239 ( -23.877 0.000 1.827) 23.947 3.289 ( -16.316 0.000 8.490) 18.392 4.665 ( 9.764 0.000 -1.691) 9.910 4.831 ( -7.027 0.000 -5.598) 8.984 5.317 ( 17.162 0.000 25.135) 30.436 5.539 ( -3.712 0.000 14.056) 14.538 6.561 ( 11.893 0.000 10.064) 15.580 6.800 ( -9.199 0.000 4.794) 10.373 7.775 ( 7.223 0.000 -1.275) 7.334 7.921 ( -4.998 0.000 -5.100) 7.140 8.387 ( 0.709 0.000 -0.264) 0.757 8.402 ( -0.741 0.000 -0.755) 1.058 9.128 ( 0.217 0.000 -0.098) 0.238 9.132 ( -0.182 0.000 -0.239) 0.300 9.279 ( -3.015 0.000 -11.024) 11.429 9.331 ( -6.414 0.000 -12.638) 14.172 10.404 ( 7.604 0.000 8.587) 11.470 10.524 ( -3.954 0.000 4.388) 5.906 11.272 ( 5.093 0.000 6.044) 7.903 11.382 ( -4.874 0.000 7.959) 9.333 11.960 ( 10.082 0.000 -10.950) 14.885 12.092 ( 0.289 0.000 0.105) 0.307 12.095 ( -0.071 0.000 -0.020) 0.074 12.153 ( -8.329 0.000 -14.243) 16.500 12.174 ( -0.078 0.000 -0.185) 0.201 12.174 ( -0.138 0.000 -0.203) 0.245 14.405 ( 4.829 0.000 -0.721) 4.883 14.492 ( -3.008 0.000 -1.367) 3.305 15.177 ( 12.804 0.000 2.923) 13.133 15.534 ( -22.227 0.000 -5.042) 22.792 18.477 ( 12.662 0.000 0.777) 12.686 18.618 ( 23.150 0.000 3.661) 23.437 18.731 ( -11.136 0.000 4.381) 11.967 19.034 ( -17.245 0.000 0.529) 17.254 27.865 ( 0.820 0.000 9.976) 10.010 27.882 ( -0.849 0.000 9.620) 9.657 28.442 ( 0.549 0.000 -8.015) 8.034 28.453 ( -0.521 0.000 -8.429) 8.445 30.269 ( 7.284 0.000 1.807) 7.505 30.409 ( -6.634 0.000 -2.623) 7.133 32.035 ( 1.577 0.000 -2.973) 3.366 32.065 ( -1.452 0.000 -3.455) 3.748 86.189 ( 3.001 0.000 8.467) 8.984 86.260 ( -4.079 0.000 7.130) 8.214 88.863 ( 22.320 0.000 13.126) 25.893 89.343 ( -25.345 0.000 -2.013) 25.424 ======================= Grid point 345 (112/162) ======================= q-point: ( 0.00 0.06 0.36) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 264 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.037 ( 0.000 8.048 28.437) 29.554 3.057 ( 0.000 33.045 24.967) 41.416 4.048 ( 0.000 26.492 -9.141) 28.024 4.072 ( 0.000 3.222 -0.467) 3.255 4.519 ( 0.000 12.852 16.016) 20.536 4.911 ( 0.000 19.816 28.129) 34.408 5.138 ( 0.000 12.927 -4.382) 13.649 5.363 ( 0.000 18.140 1.120) 18.174 6.515 ( 0.000 3.298 -1.412) 3.587 6.832 ( 0.000 3.316 -7.931) 8.596 7.733 ( 0.000 -6.668 4.620) 8.113 7.772 ( 0.000 -1.528 -7.155) 7.317 8.567 ( 0.000 17.778 0.764) 17.795 8.574 ( 0.000 13.525 2.890) 13.830 9.143 ( 0.000 1.330 -3.050) 3.327 9.169 ( 0.000 4.420 0.017) 4.420 9.475 ( 0.000 3.025 -2.264) 3.779 9.769 ( 0.000 7.574 -8.870) 11.664 10.110 ( 0.000 -2.200 14.899) 15.060 10.505 ( 0.000 -3.887 -2.476) 4.609 11.165 ( 0.000 -4.538 -0.451) 4.561 11.306 ( 0.000 -10.758 -4.268) 11.573 11.709 ( 0.000 -3.108 4.383) 5.373 11.986 ( 0.000 -6.688 -0.853) 6.742 12.178 ( 0.000 8.289 -0.126) 8.289 12.256 ( 0.000 10.189 -3.375) 10.733 12.324 ( 0.000 13.402 -0.320) 13.406 12.542 ( 0.000 18.618 -12.178) 22.247 14.255 ( 0.000 -1.871 -2.401) 3.044 14.433 ( 0.000 -2.240 -6.001) 6.405 15.003 ( 0.000 -9.145 18.871) 20.970 16.112 ( 0.000 -13.396 -13.289) 18.869 17.829 ( 0.000 -4.159 16.131) 16.658 18.113 ( 0.000 -6.275 1.169) 6.383 18.908 ( 0.000 -9.190 -0.054) 9.190 19.223 ( 0.000 -14.002 -7.623) 15.942 27.923 ( 0.000 7.506 10.090) 12.576 28.015 ( 0.000 10.932 7.590) 13.309 28.480 ( 0.000 5.146 -6.916) 8.621 28.512 ( 0.000 4.860 -8.562) 9.845 30.116 ( 0.000 2.325 8.651) 8.958 30.552 ( 0.000 -0.013 -5.652) 5.652 31.969 ( 0.000 -2.906 -2.372) 3.751 32.067 ( 0.000 -2.960 -3.934) 4.923 86.115 ( 0.000 -1.683 8.174) 8.345 86.328 ( 0.000 -4.288 3.434) 5.494 88.270 ( 0.000 -10.869 27.754) 29.806 89.689 ( 0.000 -27.458 -17.435) 32.525 ======================= Grid point 346 (113/162) ======================= q-point: ( 0.20 0.06 0.36) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 440 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.954 ( -5.188 7.441 22.764) 24.505 3.133 ( 7.182 32.400 22.735) 40.227 3.720 ( -21.873 8.492 -0.258) 23.465 3.996 ( -14.307 26.992 -2.335) 30.639 4.652 ( 12.867 16.550 8.191) 22.507 5.039 ( 11.419 12.048 24.489) 29.585 5.179 ( 0.627 21.158 -3.260) 21.417 5.488 ( 10.234 8.456 6.192) 14.649 6.480 ( -0.413 3.937 4.124) 5.716 6.886 ( 2.429 3.321 -5.943) 7.228 7.679 ( -1.017 -3.540 2.662) 4.545 7.857 ( 3.972 -4.555 -6.280) 8.716 8.549 ( -1.182 14.493 1.543) 14.623 8.573 ( -0.632 14.385 2.123) 14.554 9.133 ( -0.652 1.286 -4.153) 4.396 9.177 ( 0.507 4.972 -1.044) 5.106 9.440 ( -3.834 3.342 -4.676) 6.909 9.582 ( -12.651 7.352 -5.973) 15.804 10.240 ( 8.750 -0.419 10.053) 13.334 10.526 ( 1.413 -2.750 -0.213) 3.099 11.161 ( 0.506 -5.034 1.279) 5.219 11.340 ( 2.125 -8.416 0.021) 8.680 11.706 ( 0.456 -6.564 1.266) 6.700 11.967 ( -2.093 -7.856 -1.767) 8.319 12.186 ( 0.774 8.716 -0.207) 8.752 12.252 ( -0.607 10.343 -2.365) 10.627 12.346 ( 2.204 14.339 -2.024) 14.648 12.530 ( -1.451 18.505 -11.546) 21.860 14.296 ( 3.615 -2.164 -1.933) 4.635 14.462 ( 2.167 -2.622 -5.096) 6.127 14.983 ( -0.129 -8.585 14.313) 16.691 15.873 ( -20.569 -11.497 -10.058) 25.621 18.073 ( 21.183 -6.351 12.138) 25.226 18.198 ( 8.152 -6.617 1.520) 10.609 18.837 ( -7.088 -8.933 0.319) 11.407 19.148 ( -7.816 -13.473 -5.291) 16.450 27.931 ( 0.767 7.759 9.931) 12.626 28.005 ( -1.000 10.498 7.961) 13.213 28.483 ( 0.321 5.114 -7.072) 8.733 28.509 ( -0.286 4.876 -8.399) 9.716 30.164 ( 4.664 2.069 6.410) 8.193 30.515 ( -3.639 0.184 -4.948) 6.145 31.979 ( 1.004 -2.919 -2.492) 3.967 32.059 ( -0.822 -2.970 -3.775) 4.873 86.128 ( 1.290 -1.816 8.222) 8.518 86.298 ( -2.883 -3.864 4.704) 6.736 88.388 ( 11.728 -12.059 23.679) 29.045 89.526 ( -15.667 -25.212 -11.951) 31.999 ======================= Grid point 347 (114/162) ======================= q-point: ( 0.40 0.06 0.36) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 440 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.953 ( 6.730 6.247 12.186) 15.259 3.198 ( -12.647 7.766 7.921) 16.822 3.419 ( 5.449 31.397 11.952) 34.034 3.680 ( -16.169 33.109 7.400) 37.582 4.895 ( 10.815 21.515 -1.368) 24.119 5.065 ( -6.381 21.613 -5.008) 23.086 5.370 ( 14.571 6.353 22.212) 27.314 5.571 ( -3.939 3.927 12.480) 13.664 6.594 ( 11.766 4.415 9.657) 15.849 6.828 ( -9.011 3.620 4.607) 10.748 7.737 ( 6.561 -3.181 -1.981) 7.556 7.864 ( -4.031 -4.442 -5.620) 8.220 8.532 ( -0.264 11.726 1.651) 11.845 8.547 ( -1.616 12.139 1.963) 12.402 9.138 ( 1.673 2.859 -7.606) 8.296 9.176 ( -1.040 5.143 -4.560) 6.952 9.356 ( -2.346 6.253 -6.022) 8.992 9.397 ( -6.092 7.143 -7.176) 11.816 10.402 ( 7.552 -0.175 7.577) 10.699 10.515 ( -3.320 -0.942 3.902) 5.209 11.216 ( 5.124 -5.233 5.332) 9.059 11.324 ( -4.329 -5.423 6.842) 9.745 11.770 ( 6.134 -11.309 -4.597) 13.662 11.895 ( -5.413 -10.533 -3.913) 12.472 12.206 ( 1.259 9.536 -0.525) 9.633 12.232 ( -1.304 10.157 -1.165) 10.306 12.404 ( 3.527 16.597 -5.401) 17.807 12.478 ( -3.690 18.186 -9.140) 20.685 14.377 ( 4.516 -2.724 -0.580) 5.306 14.460 ( -3.011 -3.165 -1.042) 4.491 15.096 ( 12.664 -8.066 2.426) 15.209 15.442 ( -21.327 -9.196 -5.311) 23.824 18.405 ( 12.186 -7.358 0.982) 14.269 18.522 ( 22.116 -9.399 3.873) 24.340 18.649 ( -11.105 -8.323 3.452) 14.301 18.913 ( -16.173 -11.920 0.701) 20.103 27.952 ( 1.320 8.475 9.466) 12.774 27.980 ( -1.458 9.502 8.743) 12.995 28.491 ( 0.493 5.027 -7.479) 9.025 28.501 ( -0.472 4.933 -7.984) 9.397 30.282 ( 6.914 1.437 1.635) 7.249 30.415 ( -6.298 0.720 -2.575) 6.842 32.005 ( 1.559 -2.950 -2.852) 4.389 32.036 ( -1.447 -2.975 -3.354) 4.711 86.167 ( 2.689 -2.246 8.007) 8.740 86.230 ( -3.622 -2.995 6.836) 8.296 88.707 ( 20.075 -15.369 13.539) 28.679 89.136 ( -22.480 -20.235 0.467) 30.249 ======================= Grid point 350 (115/162) ======================= q-point: ( 0.00 0.12 0.36) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 267 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.271 ( 0.000 15.763 23.950) 28.672 3.639 ( 0.000 20.232 22.782) 30.469 4.275 ( 0.000 15.032 1.595) 15.116 4.575 ( 0.000 21.026 -4.026) 21.408 4.879 ( 0.000 28.623 16.714) 33.146 5.419 ( 0.000 28.265 18.692) 33.887 5.498 ( 0.000 28.125 -2.181) 28.210 5.882 ( 0.000 29.476 -7.715) 30.469 6.693 ( 0.000 17.372 -1.580) 17.444 6.983 ( 0.000 14.183 -5.252) 15.124 7.593 ( 0.000 -6.977 2.853) 7.538 7.737 ( 0.000 -1.840 -7.633) 7.851 8.838 ( 0.000 11.077 9.644) 14.687 8.935 ( 0.000 16.440 2.485) 16.627 9.233 ( 0.000 9.166 -6.669) 11.336 9.267 ( 0.000 4.648 5.309) 7.057 9.594 ( 0.000 10.395 -8.728) 13.573 9.965 ( 0.000 11.854 -8.336) 14.492 10.078 ( 0.000 -0.299 12.774) 12.778 10.395 ( 0.000 -7.170 -1.709) 7.371 11.071 ( 0.000 -4.424 -3.041) 5.369 11.076 ( 0.000 -11.851 -3.077) 12.244 11.638 ( 0.000 -4.224 4.522) 6.188 11.862 ( 0.000 -6.379 0.158) 6.381 12.402 ( 0.000 14.158 -0.579) 14.170 12.508 ( 0.000 14.535 -5.356) 15.491 12.650 ( 0.000 18.900 -0.530) 18.908 12.919 ( 0.000 18.852 -12.117) 22.410 14.208 ( 0.000 -2.663 -1.446) 3.030 14.375 ( 0.000 -3.496 -4.634) 5.805 14.755 ( 0.000 -15.579 15.723) 22.134 15.750 ( 0.000 -22.668 -13.135) 26.198 17.715 ( 0.000 -7.302 12.543) 14.514 17.938 ( 0.000 -11.392 0.430) 11.400 18.653 ( 0.000 -16.492 -0.048) 16.492 18.865 ( 0.000 -21.310 -4.846) 21.854 28.120 ( 0.000 12.044 9.022) 15.048 28.284 ( 0.000 15.221 4.241) 15.801 28.624 ( 0.000 9.375 -4.900) 10.579 28.653 ( 0.000 9.620 -7.238) 12.039 30.186 ( 0.000 4.947 6.958) 8.537 30.557 ( 0.000 0.785 -5.251) 5.310 31.889 ( 0.000 -5.185 -1.926) 5.531 31.985 ( 0.000 -5.268 -3.716) 6.446 86.069 ( 0.000 -2.915 6.802) 7.400 86.216 ( 0.000 -6.791 3.840) 7.801 87.976 ( 0.000 -18.499 23.881) 30.208 89.000 ( 0.000 -40.318 -5.756) 40.727 ======================= Grid point 351 (116/162) ======================= q-point: ( 0.20 0.12 0.36) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 441 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.175 ( -5.899 14.969 19.361) 25.173 3.655 ( -5.342 15.729 13.250) 21.249 4.064 ( -7.212 25.480 10.681) 28.554 4.608 ( -5.228 28.812 2.826) 29.418 5.054 ( 16.716 25.154 8.580) 31.397 5.399 ( 2.734 24.546 15.456) 29.135 5.595 ( 3.724 21.421 0.937) 21.762 5.873 ( -1.312 28.390 -5.022) 28.860 6.686 ( 1.629 19.669 4.013) 20.140 7.039 ( 2.851 14.310 -5.102) 15.458 7.589 ( 1.030 -5.316 1.838) 5.718 7.779 ( 2.731 -3.050 -7.484) 8.531 8.776 ( -5.138 7.425 7.915) 12.007 8.878 ( -5.411 12.586 2.669) 13.958 9.247 ( 1.900 11.264 -7.141) 13.472 9.315 ( 3.593 8.557 2.904) 9.724 9.557 ( -3.421 9.799 -8.863) 13.648 9.761 ( -11.181 10.290 -0.933) 15.224 10.255 ( 8.966 2.567 5.218) 10.687 10.443 ( 4.095 -5.693 -0.423) 7.025 11.042 ( 0.219 -6.978 -0.514) 7.000 11.161 ( 5.053 -8.374 -1.663) 9.921 11.588 ( -3.855 -5.681 3.682) 7.791 11.827 ( -3.660 -6.720 -0.840) 7.698 12.416 ( 1.358 14.338 -0.549) 14.412 12.512 ( -0.049 15.140 -3.944) 15.646 12.668 ( 2.084 17.750 -2.667) 18.070 12.901 ( -2.032 18.415 -11.663) 21.892 14.242 ( 2.915 -3.198 -1.211) 4.494 14.393 ( 1.096 -4.215 -3.522) 5.601 14.751 ( 1.291 -14.423 11.556) 18.527 15.559 ( -16.952 -19.871 -10.562) 28.174 17.904 ( 16.847 -10.415 10.161) 22.261 18.015 ( 7.458 -11.855 0.412) 14.012 18.589 ( -6.417 -16.074 0.279) 17.310 18.802 ( -6.535 -20.624 -3.494) 21.915 28.134 ( 1.341 12.333 8.740) 15.175 28.265 ( -1.797 14.920 4.966) 15.827 28.626 ( 0.250 9.338 -5.098) 10.642 28.650 ( -0.319 9.515 -6.952) 11.788 30.227 ( 3.991 4.512 5.086) 7.884 30.527 ( -3.084 1.152 -4.613) 5.667 31.898 ( 0.968 -5.209 -2.083) 5.693 31.976 ( -0.843 -5.286 -3.538) 6.416 86.079 ( 0.938 -3.111 6.864) 7.595 86.196 ( -1.900 -6.169 4.625) 7.940 88.065 ( 8.758 -20.236 20.994) 30.446 88.888 ( -10.847 -37.649 -2.571) 39.265 ======================= Grid point 352 (117/162) ======================= q-point: ( 0.40 0.12 0.36) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 441 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.153 ( 5.100 14.079 10.950) 18.551 3.377 ( -16.454 11.912 4.858) 20.886 4.154 ( 11.438 35.946 17.772) 41.698 4.407 ( -13.102 35.671 11.493) 39.701 5.372 ( 12.569 22.604 -1.221) 25.892 5.493 ( 2.086 21.061 3.185) 21.402 5.625 ( 3.969 18.212 9.988) 21.147 5.790 ( -7.882 22.911 3.527) 24.485 6.809 ( 10.155 19.835 7.887) 23.638 7.001 ( -7.196 16.136 3.260) 17.966 7.669 ( 6.634 -3.499 -3.221) 8.163 7.783 ( -3.294 -3.419 -6.302) 7.890 8.701 ( -0.907 4.449 4.355) 6.292 8.757 ( -5.752 6.953 2.649) 9.405 9.308 ( 3.947 14.295 -10.123) 17.955 9.363 ( -0.140 13.994 -5.833) 15.161 9.504 ( 0.047 9.017 -2.867) 9.462 9.583 ( -7.013 10.955 0.157) 13.009 10.403 ( 6.395 0.344 4.339) 7.735 10.485 ( -1.149 -2.160 2.149) 3.257 11.094 ( 5.142 -6.528 3.636) 9.071 11.198 ( -3.065 -6.666 4.131) 8.420 11.578 ( 4.683 -8.344 -1.509) 9.687 11.717 ( -7.352 -7.879 -2.464) 11.054 12.451 ( 2.123 14.929 -0.613) 15.091 12.493 ( -1.842 15.627 -1.407) 15.798 12.736 ( 4.693 16.662 -7.044) 18.689 12.834 ( -4.702 17.390 -10.052) 20.629 14.306 ( 3.598 -4.250 -0.203) 5.572 14.376 ( -2.943 -5.181 -0.116) 5.960 14.880 ( 12.164 -13.388 1.104) 18.122 15.192 ( -18.654 -15.744 -5.871) 25.106 18.197 ( 11.251 -13.635 2.171) 17.811 18.280 ( 18.732 -14.561 2.945) 23.908 18.417 ( -10.528 -15.030 1.831) 18.441 18.605 ( -13.606 -18.464 0.176) 22.937 28.170 ( 2.333 13.112 7.885) 15.478 28.220 ( -2.605 14.109 6.499) 15.750 28.633 ( 0.412 9.292 -5.619) 10.867 28.642 ( -0.453 9.348 -6.307) 11.286 30.328 ( 5.898 3.417 1.077) 6.900 30.442 ( -5.353 2.139 -2.523) 6.292 31.924 ( 1.513 -5.265 -2.513) 6.027 31.954 ( -1.436 -5.299 -3.074) 6.293 86.107 ( 1.915 -3.752 6.763) 7.968 86.151 ( -2.487 -4.875 5.996) 8.118 88.301 ( 14.812 -24.940 13.849) 32.144 88.613 ( -16.098 -31.448 5.091) 35.694 ======================= Grid point 355 (118/162) ======================= q-point: ( 0.00 0.19 0.36) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 264 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.642 ( 0.000 21.834 18.415) 28.563 3.900 ( 0.000 9.833 18.927) 21.329 4.525 ( 0.000 11.150 7.454) 13.412 4.816 ( 0.000 6.382 -1.493) 6.554 5.428 ( 0.000 16.527 7.668) 18.219 6.048 ( 0.000 16.473 -8.048) 18.334 6.082 ( 0.000 45.078 12.171) 46.692 6.490 ( 0.000 38.612 -5.885) 39.058 7.209 ( 0.000 32.038 3.218) 32.199 7.321 ( 0.000 6.635 5.241) 8.455 7.581 ( 0.000 16.968 -7.207) 18.435 7.713 ( 0.000 -0.001 -8.258) 8.258 9.031 ( 0.000 12.183 9.182) 15.256 9.114 ( 0.000 0.758 -1.090) 1.328 9.360 ( 0.000 7.318 14.199) 15.974 9.452 ( 0.000 9.734 -3.286) 10.274 9.884 ( 0.000 17.498 -10.818) 20.572 10.113 ( 0.000 3.674 9.061) 9.777 10.194 ( 0.000 7.079 -11.738) 13.707 10.262 ( 0.000 -1.110 3.293) 3.475 10.871 ( 0.000 -8.481 -2.599) 8.870 11.013 ( 0.000 -1.199 -7.057) 7.158 11.540 ( 0.000 -5.940 4.472) 7.436 11.729 ( 0.000 -7.295 0.566) 7.317 12.706 ( 0.000 16.289 -1.396) 16.349 12.792 ( 0.000 13.830 -4.798) 14.639 13.026 ( 0.000 18.707 -1.273) 18.750 13.238 ( 0.000 12.897 -10.297) 16.504 14.159 ( 0.000 -2.254 -0.264) 2.269 14.307 ( 0.000 -3.189 -2.357) 3.965 14.435 ( 0.000 -15.747 11.001) 19.209 15.274 ( 0.000 -24.753 -13.085) 27.999 17.551 ( 0.000 -9.356 7.805) 12.184 17.679 ( 0.000 -14.969 0.026) 14.969 18.285 ( 0.000 -20.737 0.207) 20.738 18.435 ( 0.000 -21.872 -3.668) 22.177 28.369 ( 0.000 12.935 6.888) 14.655 28.563 ( 0.000 12.752 0.582) 12.765 28.833 ( 0.000 11.627 -1.582) 11.734 28.883 ( 0.000 13.554 -4.130) 14.169 30.311 ( 0.000 7.807 4.562) 9.042 30.589 ( 0.000 2.646 -4.730) 5.420 31.774 ( 0.000 -6.367 -1.291) 6.496 31.869 ( 0.000 -6.415 -3.382) 7.252 86.006 ( 0.000 -3.416 4.977) 6.036 86.079 ( 0.000 -6.919 3.843) 7.915 87.578 ( 0.000 -21.560 18.639) 28.500 88.203 ( 0.000 -39.732 2.261) 39.796 ======================= Grid point 356 (119/162) ======================= q-point: ( 0.20 0.19 0.36) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 440 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.522 ( -6.539 19.987 15.331) 26.025 3.914 ( -7.274 13.280 7.833) 17.047 4.439 ( 3.187 13.237 18.194) 22.724 4.968 ( 5.353 9.065 2.475) 10.814 5.451 ( 4.268 11.075 7.179) 13.872 5.989 ( -5.807 14.507 -6.023) 16.746 6.118 ( 4.236 46.981 11.360) 48.521 6.494 ( -0.782 38.216 -7.090) 38.876 7.234 ( 3.366 29.292 8.692) 30.739 7.415 ( 7.551 12.922 -1.738) 15.067 7.547 ( -1.882 11.219 -5.297) 12.549 7.757 ( 2.828 2.975 -8.401) 9.350 8.896 ( -9.650 7.646 8.276) 14.835 9.013 ( -9.234 2.353 0.405) 9.538 9.443 ( 6.804 7.124 10.838) 14.646 9.526 ( 5.830 12.700 -2.764) 14.245 9.834 ( -4.648 16.448 -9.698) 19.652 9.965 ( -8.314 10.455 2.920) 13.673 10.298 ( 4.040 -5.440 0.979) 6.846 10.361 ( 8.212 4.908 -4.134) 10.422 10.897 ( 2.713 -6.795 -1.278) 7.427 11.062 ( 4.497 -1.657 -4.992) 6.920 11.474 ( -5.338 -6.229 4.345) 9.283 11.697 ( -3.575 -6.648 -0.543) 7.568 12.721 ( 1.486 16.231 -1.326) 16.352 12.804 ( 1.058 13.933 -4.385) 14.645 13.012 ( -0.908 16.804 -2.319) 16.987 13.211 ( -2.918 12.466 -9.982) 16.235 14.182 ( 1.982 -2.746 -0.285) 3.399 14.305 ( -0.807 -4.851 -0.283) 4.926 14.463 ( 3.982 -13.363 6.687) 15.465 15.139 ( -12.260 -21.868 -10.861) 27.321 17.681 ( 11.449 -12.378 6.820) 18.187 17.747 ( 7.070 -15.161 -0.196) 16.730 18.229 ( -5.525 -20.238 0.399) 20.982 18.385 ( -5.186 -21.263 -3.226) 22.122 28.387 ( 1.747 13.050 6.467) 14.669 28.544 ( -1.895 12.983 1.399) 13.195 28.835 ( 0.248 11.655 -1.781) 11.793 28.875 ( -0.786 13.144 -3.730) 13.686 30.342 ( 3.068 7.291 3.175) 8.523 30.567 ( -2.253 3.124 -4.211) 5.707 31.783 ( 0.915 -6.398 -1.491) 6.633 31.860 ( -0.877 -6.441 -3.183) 7.238 86.012 ( 0.548 -3.587 5.059) 6.225 86.071 ( -0.798 -6.356 4.153) 7.635 87.633 ( 5.438 -23.177 16.957) 29.228 88.137 ( -6.428 -37.766 3.820) 38.499 ======================= Grid point 357 (120/162) ======================= q-point: ( 0.40 0.19 0.36) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 440 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.486 ( 3.651 19.441 9.092) 21.771 3.663 ( -13.420 17.027 4.075) 22.059 4.648 ( 13.935 15.325 21.403) 29.785 4.900 ( -10.284 14.475 13.809) 22.494 5.625 ( 11.407 5.617 1.946) 12.863 5.835 ( -9.567 9.572 -2.215) 13.713 6.253 ( 8.900 45.356 5.659) 46.566 6.420 ( -6.906 40.600 -2.641) 41.267 7.336 ( 6.212 25.918 6.344) 27.397 7.443 ( -4.120 22.079 -0.416) 22.464 7.636 ( 8.939 4.951 -5.746) 11.723 7.765 ( -3.062 5.294 -7.482) 9.664 8.762 ( -2.192 4.055 5.463) 7.148 8.828 ( -7.931 2.026 2.146) 8.462 9.582 ( 6.987 10.114 3.982) 12.922 9.647 ( 5.611 14.936 -1.726) 16.049 9.728 ( -4.971 12.819 -4.148) 14.362 9.808 ( -7.764 12.506 1.310) 14.778 10.391 ( 4.774 -2.866 -0.650) 5.606 10.447 ( 0.108 -0.440 -3.154) 3.187 10.986 ( 6.383 -3.882 1.842) 7.695 11.104 ( -3.132 -2.193 1.093) 3.977 11.437 ( 4.326 -6.311 -0.387) 7.661 11.583 ( -7.848 -5.978 -2.085) 10.083 12.761 ( 2.531 16.099 -1.240) 16.344 12.807 ( -1.424 15.606 -2.164) 15.819 13.027 ( 3.279 12.629 -6.078) 14.394 13.124 ( -5.548 11.629 -8.782) 15.593 14.224 ( 2.275 -3.821 0.251) 4.454 14.270 ( -2.324 -5.262 1.102) 5.857 14.612 ( 10.806 -12.802 -0.458) 16.759 14.864 ( -14.384 -16.629 -6.127) 22.824 17.889 ( 9.823 -17.444 3.251) 20.282 17.975 ( 13.818 -16.455 2.226) 21.603 18.082 ( -8.695 -18.580 -0.274) 20.515 18.230 ( -10.665 -19.253 -1.960) 22.096 28.434 ( 2.930 13.271 5.217) 14.558 28.494 ( -3.036 13.296 3.306) 14.033 28.843 ( 0.568 11.840 -2.287) 12.073 28.858 ( -0.872 12.366 -2.970) 12.747 30.419 ( 4.465 5.971 0.181) 7.458 30.505 ( -3.975 4.385 -2.563) 6.450 31.807 ( 1.459 -6.457 -2.016) 6.920 31.836 ( -1.436 -6.476 -2.662) 7.147 86.028 ( 1.043 -4.153 5.082) 6.645 86.050 ( -1.196 -5.172 4.744) 7.119 87.780 ( 9.197 -27.435 12.768) 31.627 87.972 ( -9.805 -32.939 7.819) 35.246 ======================= Grid point 360 (121/162) ======================= q-point: ( 0.00 0.25 0.36) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 267 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 4.073 ( 0.000 8.162 16.328) 18.254 4.108 ( 0.000 25.535 12.976) 28.642 4.749 ( 0.000 12.192 5.926) 13.556 4.896 ( 0.000 2.692 -3.244) 4.216 5.563 ( 0.000 1.252 1.424) 1.896 6.157 ( 0.000 -1.311 -13.132) 13.197 7.034 ( 0.000 46.735 9.394) 47.670 7.048 ( 0.000 1.129 12.218) 12.270 7.524 ( 0.000 33.391 -6.975) 34.112 7.624 ( 0.000 4.010 -3.931) 5.616 7.891 ( 0.000 20.970 4.066) 21.360 8.006 ( 0.000 16.348 -5.183) 17.150 9.026 ( 0.000 -7.122 -3.043) 7.745 9.425 ( 0.000 22.132 14.700) 26.569 9.519 ( 0.000 3.307 -12.054) 12.499 9.571 ( 0.000 12.584 15.255) 19.776 10.165 ( 0.000 7.667 0.857) 7.715 10.182 ( 0.000 1.718 -0.237) 1.734 10.275 ( 0.000 16.988 -5.673) 17.910 10.457 ( 0.000 11.282 -4.787) 12.255 10.770 ( 0.000 -1.536 -1.856) 2.409 11.030 ( 0.000 2.979 -11.691) 12.064 11.408 ( 0.000 -7.396 4.552) 8.684 11.585 ( 0.000 -6.979 0.333) 6.987 13.012 ( 0.000 14.469 -2.077) 14.617 13.025 ( 0.000 9.474 -0.640) 9.496 13.343 ( 0.000 12.946 -3.225) 13.342 13.393 ( 0.000 2.999 -8.166) 8.699 14.111 ( 0.000 -3.187 2.823) 4.257 14.217 ( 0.000 -4.647 4.117) 6.209 14.262 ( 0.000 -1.026 0.394) 1.099 14.840 ( 0.000 -18.289 -12.267) 22.022 17.353 ( 0.000 -10.928 3.146) 11.372 17.364 ( 0.000 -16.944 0.201) 16.945 17.864 ( 0.000 -21.915 1.017) 21.939 18.030 ( 0.000 -19.491 -4.153) 19.929 28.612 ( 0.000 11.751 4.445) 12.564 28.779 ( 0.000 9.550 -1.401) 9.653 29.058 ( 0.000 10.931 1.641) 11.054 29.150 ( 0.000 12.820 -1.329) 12.888 30.488 ( 0.000 10.285 2.125) 10.502 30.664 ( 0.000 5.004 -4.055) 6.441 31.648 ( 0.000 -6.297 -0.538) 6.320 31.743 ( 0.000 -6.209 -2.938) 6.869 85.941 ( 0.000 -3.111 3.175) 4.445 85.958 ( 0.000 -5.242 3.230) 6.158 87.160 ( 0.000 -20.773 13.190) 24.607 87.488 ( 0.000 -33.073 5.141) 33.470 ======================= Grid point 361 (122/162) ======================= q-point: ( 0.20 0.25 0.36) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 441 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.915 ( -5.818 18.801 12.030) 23.066 4.209 ( -3.452 17.655 6.172) 19.019 4.661 ( 3.267 10.727 13.996) 17.934 5.068 ( 7.602 2.913 -0.154) 8.142 5.544 ( 0.209 0.798 3.407) 3.506 6.103 ( -6.162 -0.075 -8.797) 10.741 7.072 ( 3.999 44.221 7.985) 45.113 7.118 ( 6.327 7.651 4.554) 10.923 7.466 ( -3.117 23.358 -1.160) 23.593 7.654 ( -0.411 5.166 -7.997) 9.530 7.949 ( 5.530 26.009 3.183) 26.780 8.018 ( 1.693 13.892 -6.331) 15.360 8.918 ( -7.599 -6.453 1.737) 10.119 9.255 ( -13.351 23.192 11.918) 29.294 9.589 ( 7.793 3.882 2.906) 9.179 9.733 ( 9.863 12.797 2.191) 16.304 10.076 ( -7.098 7.270 3.146) 10.636 10.195 ( -1.961 8.634 -1.208) 8.936 10.259 ( 1.336 10.409 -7.253) 12.757 10.493 ( 1.441 7.281 -7.812) 10.776 10.824 ( 5.278 -0.207 -0.605) 5.317 11.082 ( 4.952 3.423 -8.936) 10.775 11.344 ( -5.158 -6.965 4.573) 9.799 11.572 ( -2.088 -5.922 -1.174) 6.388 13.020 ( 0.596 12.476 -0.909) 12.524 13.034 ( 1.471 10.523 -1.939) 10.800 13.288 ( -4.382 10.128 -3.929) 11.714 13.370 ( -3.119 4.603 -7.382) 9.242 14.129 ( 1.628 -3.070 2.179) 4.102 14.206 ( -0.775 -3.226 2.474) 4.139 14.308 ( 4.345 -2.625 1.030) 5.180 14.760 ( -7.342 -15.604 -10.100) 19.985 17.402 ( 4.920 -16.689 2.504) 17.578 17.458 ( 8.574 -13.667 0.633) 16.146 17.819 ( -4.369 -21.256 0.801) 21.715 17.991 ( -4.091 -19.032 -4.207) 19.916 28.630 ( 1.752 11.675 3.959) 12.452 28.766 ( -1.329 9.885 -0.830) 10.008 29.062 ( 0.373 10.991 1.472) 11.095 29.134 ( -1.476 12.535 -0.783) 12.645 30.510 ( 2.070 9.774 1.234) 10.067 30.651 ( -1.290 5.511 -3.683) 6.753 31.657 ( 0.863 -6.325 -0.783) 6.431 31.734 ( -0.935 -6.251 -2.722) 6.882 85.944 ( 0.272 -3.240 3.302) 4.634 85.959 ( 0.073 -4.811 3.206) 5.782 87.187 ( 2.713 -21.971 12.373) 25.361 87.452 ( -3.455 -31.889 5.867) 32.608 ======================= Grid point 362 (123/162) ======================= q-point: ( 0.40 0.25 0.36) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 441 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.887 ( 3.136 20.906 7.100) 22.300 4.028 ( -10.403 20.055 3.057) 22.799 4.859 ( 12.531 8.369 16.998) 22.716 5.066 ( -7.209 4.817 9.159) 12.612 5.663 ( 11.477 -0.563 1.208) 11.554 5.914 ( -12.452 -0.005 -2.415) 12.684 7.170 ( 5.179 44.445 3.177) 44.859 7.224 ( 1.602 29.786 -3.487) 30.033 7.457 ( 3.654 3.973 1.990) 5.753 7.579 ( -6.468 0.664 -4.876) 8.127 8.048 ( 3.579 18.490 -7.059) 20.113 8.070 ( 1.948 17.484 -6.237) 18.665 8.841 ( 1.673 2.656 10.713) 11.163 8.991 ( -12.231 16.422 14.326) 24.990 9.748 ( 8.317 7.794 4.603) 12.292 9.906 ( -2.140 7.889 3.157) 8.763 9.934 ( 2.713 13.750 -0.237) 14.017 10.089 ( -7.381 15.282 -2.805) 17.201 10.351 ( 6.309 1.680 -8.305) 10.565 10.464 ( -4.315 2.610 -9.795) 11.017 10.960 ( 8.076 0.887 1.578) 8.277 11.109 ( -5.507 1.793 0.794) 5.845 11.332 ( 6.682 -4.061 -2.724) 8.280 11.485 ( -6.821 -3.893 -3.394) 8.556 13.044 ( 1.934 11.078 -0.667) 11.265 13.068 ( 0.755 11.124 -1.694) 11.278 13.220 ( -0.917 7.273 -5.153) 8.961 13.278 ( -5.297 5.047 -6.613) 9.862 14.163 ( 1.588 -2.631 1.294) 3.334 14.189 ( -1.078 -2.508 1.376) 3.057 14.426 ( 7.532 -5.482 -1.038) 9.373 14.592 ( -9.048 -10.203 -5.405) 14.669 17.529 ( 7.495 -19.128 3.211) 20.794 17.632 ( 3.916 -18.944 3.883) 19.731 17.727 ( -0.420 -17.011 -3.749) 17.424 17.870 ( -8.091 -17.475 -4.242) 19.719 28.675 ( 2.727 11.353 2.584) 11.959 28.728 ( -2.469 10.666 0.716) 10.971 29.075 ( 0.988 11.260 1.000) 11.348 29.101 ( -1.655 11.857 0.228) 11.974 30.561 ( 2.886 8.453 -0.711) 8.960 30.615 ( -2.415 6.830 -2.542) 7.677 31.680 ( 1.428 -6.360 -1.405) 6.668 31.709 ( -1.473 -6.330 -2.145) 6.844 85.951 ( 0.430 -3.508 3.391) 4.898 85.958 ( -0.219 -4.049 3.290) 5.222 87.262 ( 4.785 -25.061 10.281) 27.507 87.364 ( -5.240 -28.829 7.800) 30.321 ======================= Grid point 365 (124/162) ======================= q-point: ( 0.00 0.31 0.36) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 264 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 4.225 ( 0.000 7.638 11.771) 14.032 4.622 ( 0.000 26.624 8.526) 27.956 4.936 ( 0.000 1.643 -6.783) 6.979 4.997 ( 0.000 12.753 3.749) 13.293 5.551 ( 0.000 -1.596 -3.525) 3.869 6.050 ( 0.000 -9.517 -16.666) 19.192 6.900 ( 0.000 -10.257 15.225) 18.358 7.623 ( 0.000 -0.955 -4.267) 4.373 7.750 ( 0.000 21.109 8.586) 22.788 8.110 ( 0.000 10.506 1.180) 10.572 8.206 ( 0.000 10.288 9.525) 14.020 8.292 ( 0.000 23.916 -7.306) 25.007 8.931 ( 0.000 0.223 -8.152) 8.155 9.319 ( 0.000 -9.721 -3.067) 10.193 9.772 ( 0.000 7.473 15.314) 17.040 10.050 ( 0.000 18.987 5.267) 19.704 10.308 ( 0.000 16.078 -4.011) 16.570 10.318 ( 0.000 8.698 0.988) 8.754 10.664 ( 0.000 10.877 -3.979) 11.582 10.692 ( 0.000 22.552 -9.782) 24.582 10.801 ( 0.000 5.703 0.031) 5.704 11.126 ( 0.000 6.262 -15.866) 17.057 11.269 ( 0.000 -5.745 4.786) 7.477 11.477 ( 0.000 -3.549 -1.211) 3.750 13.140 ( 0.000 2.813 4.860) 5.615 13.256 ( 0.000 10.377 -2.275) 10.623 13.434 ( 0.000 3.823 -9.080) 9.852 13.514 ( 0.000 5.095 -6.122) 7.965 14.072 ( 0.000 -0.054 6.810) 6.810 14.212 ( 0.000 2.111 0.155) 2.116 14.284 ( 0.000 3.420 2.386) 4.170 14.591 ( 0.000 -7.283 -9.271) 11.789 17.030 ( 0.000 -16.885 0.689) 16.899 17.125 ( 0.000 -12.335 -0.419) 12.342 17.442 ( 0.000 -21.027 2.345) 21.157 17.669 ( 0.000 -17.878 -4.933) 18.546 28.825 ( 0.000 10.133 2.621) 10.466 28.943 ( 0.000 7.393 -1.449) 7.534 29.242 ( 0.000 7.585 3.252) 8.253 29.358 ( 0.000 8.143 -0.147) 8.144 30.704 ( 0.000 11.534 0.286) 11.537 30.782 ( 0.000 6.901 -3.032) 7.538 31.534 ( 0.000 -5.344 0.270) 5.350 31.632 ( 0.000 -5.108 -2.398) 5.643 85.880 ( 0.000 -2.680 2.253) 3.502 85.890 ( 0.000 -2.068 1.784) 2.731 86.782 ( 0.000 -17.716 8.389) 19.602 86.920 ( 0.000 -25.004 5.015) 25.502 ======================= Grid point 366 (125/162) ======================= q-point: ( 0.20 0.31 0.36) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 440 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 4.218 ( 0.431 12.528 9.276) 15.595 4.612 ( -6.023 22.573 1.634) 23.420 4.874 ( 3.917 10.953 7.834) 14.025 5.117 ( 5.043 2.792 -1.875) 6.062 5.530 ( -0.063 -1.601 -1.371) 2.109 6.038 ( -3.362 -6.070 -11.613) 13.528 6.974 ( 8.142 -11.791 8.769) 16.799 7.582 ( -4.186 -3.091 -5.152) 7.322 7.774 ( 2.532 20.859 8.449) 22.647 8.067 ( -3.159 15.636 1.786) 16.052 8.227 ( 0.161 10.038 -0.569) 10.055 8.352 ( 3.988 18.014 -3.715) 18.820 8.810 ( -4.569 -0.058 1.070) 4.693 9.462 ( 3.612 -5.042 8.065) 10.174 9.681 ( -2.326 9.870 4.058) 10.922 10.118 ( 5.652 16.008 4.613) 17.592 10.205 ( -6.925 8.800 1.330) 11.276 10.334 ( -0.390 11.267 -3.821) 11.903 10.645 ( -2.073 20.111 -11.750) 23.384 10.681 ( -1.601 16.726 -6.918) 18.171 10.868 ( 5.669 4.011 0.817) 6.992 11.176 ( 4.966 3.380 -12.039) 13.454 11.222 ( -3.919 -2.417 3.817) 5.981 11.483 ( -0.203 -2.670 -3.247) 4.209 13.138 ( 0.051 3.144 4.407) 5.413 13.259 ( 0.078 9.282 -1.637) 9.426 13.392 ( -3.603 4.624 -7.848) 9.795 13.476 ( -3.498 5.506 -6.184) 8.988 14.090 ( 1.665 -0.355 5.813) 6.057 14.201 ( -1.054 1.562 0.494) 1.948 14.316 ( 3.057 2.927 1.563) 4.512 14.556 ( -3.296 -5.584 -7.519) 9.929 17.063 ( 3.419 -17.301 1.747) 17.721 17.191 ( 5.684 -14.024 -0.653) 15.146 17.414 ( -2.508 -20.007 1.346) 20.208 17.637 ( -3.255 -17.511 -5.142) 18.538 28.841 ( 1.488 9.979 2.201) 10.327 28.937 ( -0.699 7.724 -1.135) 7.838 29.246 ( 0.437 7.550 3.074) 8.163 29.339 ( -1.828 8.052 0.409) 8.267 30.716 ( 1.157 11.110 -0.165) 11.171 30.778 ( -0.349 7.363 -2.807) 7.888 31.542 ( 0.819 -5.376 -0.016) 5.438 31.622 ( -1.031 -5.171 -2.174) 5.703 85.885 ( 0.480 -2.410 2.214) 3.308 85.894 ( 0.361 -2.049 1.792) 2.746 86.789 ( 0.822 -18.510 8.080) 20.214 86.902 ( -1.762 -24.409 5.332) 25.046 ======================= Grid point 367 (126/162) ======================= q-point: ( 0.40 0.31 0.36) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 440 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 4.275 ( 5.609 18.271 5.064) 19.772 4.431 ( -9.803 20.591 1.191) 22.837 5.022 ( 7.796 8.937 8.986) 14.880 5.135 ( -3.186 2.711 2.364) 4.806 5.632 ( 10.659 -2.123 -0.279) 10.872 5.878 ( -12.174 -2.880 -2.911) 12.844 7.206 ( 13.945 -11.493 -2.259) 18.212 7.449 ( -9.752 -7.376 -5.925) 13.588 7.851 ( 5.331 19.567 6.655) 21.344 7.973 ( -6.385 18.337 3.909) 19.806 8.248 ( 2.714 10.292 -6.287) 12.362 8.329 ( -4.756 9.369 -9.359) 14.071 8.923 ( 14.208 7.078 16.330) 22.773 9.250 ( -17.197 7.852 19.784) 27.364 9.844 ( 11.441 2.316 -3.099) 12.077 10.046 ( -9.192 4.731 1.699) 10.477 10.243 ( 6.345 14.005 0.384) 15.380 10.326 ( -1.442 9.329 -4.052) 10.272 10.595 ( -1.227 22.858 -11.952) 25.824 10.629 ( -3.449 16.798 -12.821) 21.411 10.990 ( 6.556 1.770 2.492) 7.234 11.116 ( -6.040 -1.658 4.147) 7.512 11.317 ( 7.681 3.096 -9.480) 12.588 11.441 ( -4.378 -0.269 -6.627) 7.947 13.160 ( 2.530 3.441 2.869) 5.146 13.230 ( -3.641 4.537 0.511) 5.840 13.349 ( 0.634 8.076 -6.481) 10.374 13.400 ( -3.776 7.438 -6.035) 10.296 14.130 ( 2.246 -0.436 3.674) 4.329 14.172 ( -1.889 0.384 1.684) 2.560 14.391 ( 4.297 1.046 -0.621) 4.466 14.477 ( -4.429 -2.116 -3.881) 6.257 17.156 ( 5.621 -18.662 3.194) 19.750 17.252 ( -2.456 -19.331 3.658) 19.827 17.415 ( 5.094 -15.510 -4.659) 16.977 17.542 ( -6.270 -16.398 -5.457) 18.384 28.878 ( 2.079 9.454 1.090) 9.741 28.915 ( -1.565 8.566 -0.214) 8.711 29.262 ( 1.286 7.569 2.529) 8.084 29.297 ( -2.165 7.795 1.566) 8.240 30.743 ( 1.407 9.985 -1.170) 10.151 30.766 ( -0.914 8.554 -2.154) 8.868 31.565 ( 1.442 -5.394 -0.733) 5.631 31.595 ( -1.574 -5.306 -1.557) 5.750 85.895 ( 0.453 -2.024 2.072) 2.932 85.899 ( 0.072 -1.947 1.886) 2.712 86.815 ( 1.844 -20.504 7.241) 21.823 86.859 ( -2.431 -22.757 6.179) 23.706 ======================= Grid point 370 (127/162) ======================= q-point: ( 0.00 0.38 0.36) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 267 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 4.385 ( 0.000 9.116 4.665) 10.240 4.950 ( 0.000 1.632 -5.663) 5.893 5.144 ( 0.000 24.389 -0.254) 24.391 5.204 ( 0.000 6.513 2.248) 6.890 5.541 ( 0.000 2.283 -6.962) 7.327 5.788 ( 0.000 -16.879 -17.529) 24.335 6.719 ( 0.000 -7.475 16.615) 18.219 7.503 ( 0.000 -11.843 -3.387) 12.317 7.941 ( 0.000 3.210 9.788) 10.301 8.163 ( 0.000 -0.374 2.533) 2.560 8.303 ( 0.000 0.786 7.191) 7.234 8.624 ( 0.000 4.020 -4.231) 5.836 9.071 ( 0.000 11.167 -9.062) 14.381 9.231 ( 0.000 3.114 -6.638) 7.332 9.903 ( 0.000 6.489 9.563) 11.557 10.144 ( 0.000 -1.195 4.537) 4.692 10.477 ( 0.000 7.216 2.727) 7.714 10.615 ( 0.000 7.473 -0.146) 7.474 10.838 ( 0.000 2.748 2.714) 3.862 10.946 ( 0.000 12.434 -2.806) 12.747 11.172 ( 0.000 3.121 -3.927) 5.016 11.182 ( 0.000 20.000 -11.362) 23.002 11.321 ( 0.000 9.582 -13.570) 16.613 11.456 ( 0.000 0.993 -4.842) 4.942 13.229 ( 0.000 8.474 4.256) 9.483 13.420 ( 0.000 6.913 -2.541) 7.365 13.545 ( 0.000 6.216 -8.192) 10.283 13.598 ( 0.000 4.576 -6.597) 8.029 14.115 ( 0.000 4.929 10.648) 11.733 14.264 ( 0.000 2.868 0.260) 2.880 14.373 ( 0.000 4.348 3.511) 5.589 14.529 ( 0.000 0.250 -5.712) 5.717 16.726 ( 0.000 -13.670 0.969) 13.704 16.875 ( 0.000 -13.110 -2.211) 13.295 17.055 ( 0.000 -18.165 3.325) 18.467 17.322 ( 0.000 -17.736 -5.065) 18.445 29.008 ( 0.000 8.548 1.527) 8.683 29.071 ( 0.000 5.802 -0.680) 5.842 29.348 ( 0.000 3.334 3.128) 4.571 29.461 ( 0.000 2.388 -0.014) 2.388 30.926 ( 0.000 7.725 -1.691) 7.908 30.928 ( 0.000 11.079 -0.777) 11.106 31.439 ( 0.000 -4.402 0.989) 4.512 31.542 ( 0.000 -4.351 -1.814) 4.713 85.854 ( 0.000 -0.009 1.368) 1.369 85.865 ( 0.000 -0.433 1.031) 1.119 86.474 ( 0.000 -13.673 4.675) 14.451 86.509 ( 0.000 -17.247 3.725) 17.645 ======================= Grid point 371 (128/162) ======================= q-point: ( 0.20 0.38 0.36) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 441 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 4.438 ( 5.407 10.790 3.767) 12.643 4.963 ( -3.646 8.396 -7.851) 12.059 5.091 ( 0.826 10.547 1.936) 10.755 5.239 ( 1.240 13.394 2.021) 13.602 5.491 ( -0.726 -2.672 -6.291) 6.873 5.889 ( 4.740 -7.787 -12.516) 15.484 6.735 ( 3.518 -11.580 12.198) 17.183 7.432 ( -7.250 -13.053 -4.335) 15.548 7.955 ( 1.685 3.404 8.005) 8.860 8.166 ( -1.169 -0.763 3.229) 3.517 8.323 ( 2.478 0.586 6.417) 6.904 8.572 ( -5.024 1.771 -4.111) 6.729 9.016 ( 1.373 16.230 -2.075) 16.420 9.413 ( 10.202 1.744 -4.207) 11.172 9.824 ( -5.907 5.818 7.840) 11.410 10.169 ( 0.215 -2.006 3.542) 4.077 10.413 ( -3.771 8.522 1.613) 9.458 10.560 ( -3.252 7.685 -2.765) 8.791 10.893 ( 2.845 1.960 2.705) 4.388 10.961 ( 0.060 6.724 -2.190) 7.072 11.113 ( -1.656 16.064 -8.854) 18.417 11.210 ( 0.066 12.676 -7.425) 14.690 11.346 ( 2.572 8.612 -13.334) 16.080 11.476 ( 1.240 1.651 -7.058) 7.353 13.240 ( 1.194 9.215 4.541) 10.342 13.404 ( -2.037 6.934 -1.627) 7.408 13.518 ( -1.674 6.933 -6.921) 9.938 13.585 ( -1.437 5.913 -6.130) 8.638 14.120 ( 0.693 3.797 9.486) 10.241 14.242 ( -2.014 2.376 1.171) 3.328 14.393 ( 1.766 3.758 2.568) 4.882 14.512 ( -1.556 0.466 -4.619) 4.896 16.751 ( 2.592 -13.997 1.746) 14.341 16.911 ( 2.436 -14.202 -0.942) 14.440 17.048 ( 0.176 -17.203 1.076) 17.238 17.297 ( -2.586 -17.426 -5.275) 18.390 29.021 ( 1.197 8.455 1.222) 8.627 29.072 ( -0.024 6.181 -0.562) 6.207 29.350 ( 0.210 3.085 2.979) 4.293 29.441 ( -1.902 2.395 0.446) 3.090 30.931 ( 0.442 8.516 -1.474) 8.654 30.934 ( 0.502 10.425 -1.004) 10.485 31.446 ( 0.728 -4.510 0.667) 4.617 31.530 ( -1.158 -4.421 -1.606) 4.844 85.863 ( 0.827 0.186 1.300) 1.552 85.872 ( 0.645 -0.161 1.013) 1.211 86.469 ( -0.424 -14.224 4.627) 14.963 86.497 ( -1.060 -17.140 3.845) 17.598 ======================= Grid point 372 (129/162) ======================= q-point: ( 0.40 0.38 0.36) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 441 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 4.589 ( 9.700 13.944 1.592) 17.061 4.796 ( -10.706 15.797 -1.605) 19.150 5.160 ( 3.627 1.601 -4.599) 6.072 5.223 ( -2.629 8.357 -2.129) 9.016 5.607 ( 11.668 1.120 0.705) 11.743 5.842 ( -9.427 0.712 -1.641) 9.595 6.919 ( 14.552 -17.424 0.010) 22.702 7.219 ( -14.164 -16.353 -5.086) 22.224 8.011 ( 3.929 3.007 5.648) 7.508 8.100 ( -4.763 1.071 3.951) 6.280 8.390 ( 3.777 0.999 3.523) 5.261 8.470 ( -4.657 1.671 -0.423) 4.966 9.157 ( 11.749 15.245 6.096) 20.189 9.407 ( -11.008 10.165 9.593) 17.791 9.851 ( 9.513 -1.485 -2.511) 9.950 10.061 ( -10.039 -2.480 1.071) 10.396 10.433 ( 4.527 8.403 -1.739) 9.702 10.512 ( -2.692 8.505 -4.561) 10.019 10.906 ( 0.017 1.963 -0.581) 2.047 10.934 ( -2.173 2.687 -2.775) 4.432 11.135 ( 2.820 17.694 -7.892) 19.578 11.188 ( -2.129 14.623 -7.153) 16.418 11.415 ( 3.909 5.857 -12.137) 14.032 11.474 ( -1.703 3.269 -10.205) 10.851 13.277 ( 2.570 9.807 3.907) 10.865 13.341 ( -3.763 8.370 1.159) 9.250 13.512 ( 1.023 7.822 -5.347) 9.530 13.547 ( -2.202 7.384 -5.227) 9.311 14.147 ( 2.028 2.256 6.603) 7.267 14.194 ( -2.657 1.831 3.469) 4.738 14.432 ( 2.095 2.236 0.530) 3.109 14.474 ( -2.157 1.040 -2.104) 3.187 16.822 ( 4.311 -14.921 2.925) 15.804 16.902 ( -3.254 -15.819 3.194) 16.463 17.110 ( 5.608 -15.716 -4.634) 17.318 17.221 ( -5.076 -16.582 -5.525) 18.200 29.048 ( 1.351 8.038 0.494) 8.166 29.067 ( -0.563 7.129 -0.185) 7.154 29.362 ( 1.164 2.612 2.470) 3.779 29.397 ( -2.269 2.405 1.504) 3.633 30.940 ( 0.370 9.193 -1.326) 9.295 30.942 ( 0.209 9.971 -1.154) 10.040 31.468 ( 1.452 -4.640 -0.131) 4.864 31.500 ( -1.719 -4.575 -1.002) 4.989 85.880 ( 0.645 0.500 1.140) 1.402 85.883 ( 0.306 0.365 1.020) 1.126 86.464 ( 0.059 -15.517 4.455) 16.144 86.475 ( -1.018 -16.647 4.147) 17.186 ======================= Grid point 375 (130/162) ======================= q-point: ( 0.00 0.44 0.36) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 264 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 4.597 ( 0.000 12.890 -3.817) 13.444 4.970 ( 0.000 0.151 -10.049) 10.050 5.222 ( 0.000 -2.783 -2.500) 3.741 5.399 ( 0.000 -15.488 -12.450) 19.872 5.593 ( 0.000 13.863 -2.915) 14.166 5.659 ( 0.000 7.708 -4.697) 9.027 6.644 ( 0.000 1.134 13.692) 13.739 7.178 ( 0.000 -19.735 0.903) 19.756 7.998 ( 0.000 3.326 6.487) 7.289 8.132 ( 0.000 -2.592 3.015) 3.976 8.317 ( 0.000 1.954 4.172) 4.607 8.542 ( 0.000 -7.977 -1.727) 8.162 9.262 ( 0.000 7.639 -8.743) 11.610 9.343 ( 0.000 4.627 -8.968) 10.091 10.010 ( 0.000 4.071 6.675) 7.818 10.101 ( 0.000 -2.315 5.495) 5.963 10.597 ( 0.000 4.974 2.870) 5.743 10.682 ( 0.000 0.869 1.463) 1.702 10.884 ( 0.000 2.183 4.135) 4.676 10.982 ( 0.000 -2.514 3.196) 4.066 11.334 ( 0.000 7.479 -9.476) 12.072 11.447 ( 0.000 4.552 -11.346) 12.225 11.495 ( 0.000 5.172 -9.531) 10.844 11.515 ( 0.000 8.091 -15.432) 17.425 13.462 ( 0.000 13.116 0.890) 13.146 13.541 ( 0.000 5.300 -3.215) 6.199 13.633 ( 0.000 2.291 -6.292) 6.696 13.685 ( 0.000 3.269 -4.783) 5.793 14.275 ( 0.000 9.395 9.341) 13.249 14.327 ( 0.000 5.125 3.442) 6.174 14.405 ( 0.000 -0.928 3.714) 3.828 14.569 ( 0.000 1.739 -0.608) 1.842 16.522 ( 0.000 -6.690 0.815) 6.740 16.631 ( 0.000 -11.111 -1.948) 11.280 16.773 ( 0.000 -9.052 1.982) 9.266 16.987 ( 0.000 -15.822 -4.253) 16.383 29.154 ( 0.000 6.038 1.124) 6.142 29.170 ( 0.000 4.123 0.378) 4.140 29.383 ( 0.000 0.708 1.849) 1.979 29.461 ( 0.000 -1.985 -0.190) 1.994 31.074 ( 0.000 7.091 -0.511) 7.109 31.122 ( 0.000 8.240 -1.321) 8.346 31.360 ( 0.000 -3.500 1.361) 3.755 31.454 ( 0.000 -4.845 -1.209) 4.993 85.874 ( 0.000 1.267 0.973) 1.598 85.874 ( 0.000 1.762 1.018) 2.035 86.245 ( 0.000 -9.647 2.210) 9.897 86.252 ( 0.000 -8.851 2.189) 9.118 ======================= Grid point 376 (131/162) ======================= q-point: ( 0.20 0.44 0.36) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 440 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 4.662 ( 6.395 12.479 -3.934) 14.564 5.021 ( 4.621 -0.509 -11.072) 12.008 5.183 ( -4.400 0.841 -2.931) 5.353 5.366 ( -3.121 -9.762 -10.883) 14.949 5.594 ( 3.649 16.610 0.326) 17.010 5.824 ( 12.226 1.644 -6.386) 13.891 6.575 ( -5.736 -2.751 12.134) 13.700 7.087 ( -9.248 -20.673 -0.529) 22.653 8.019 ( 2.114 3.743 6.341) 7.661 8.150 ( 1.138 -0.881 3.031) 3.356 8.310 ( -0.357 -0.359 5.034) 5.060 8.494 ( -4.220 -7.093 -0.432) 8.265 9.284 ( 4.145 10.540 -4.792) 12.298 9.465 ( 9.611 1.396 -8.257) 12.748 9.927 ( -7.549 4.899 7.661) 11.818 10.106 ( -2.012 -4.048 4.414) 6.318 10.556 ( -1.929 6.149 1.231) 6.561 10.650 ( -1.091 2.083 -0.816) 2.489 10.906 ( 0.204 0.056 3.163) 3.170 10.945 ( -3.240 -2.572 2.159) 4.666 11.368 ( 2.966 7.921 -9.798) 12.944 11.449 ( 0.222 6.520 -11.591) 13.301 11.491 ( 0.399 5.818 -12.428) 13.728 11.544 ( 1.470 5.322 -13.543) 14.625 13.476 ( 1.379 12.302 1.611) 12.483 13.548 ( 0.465 7.422 -2.590) 7.875 13.622 ( -0.383 3.174 -5.287) 6.179 13.689 ( -0.058 3.899 -5.048) 6.379 14.253 ( -1.667 9.036 10.286) 13.792 14.292 ( -2.585 3.172 3.486) 5.375 14.421 ( 0.958 -0.592 3.519) 3.695 14.545 ( -2.339 0.995 0.183) 2.548 16.544 ( 2.311 -6.500 1.174) 6.998 16.668 ( 2.800 -10.143 -1.849) 10.684 16.765 ( -0.221 -10.088 0.913) 10.131 16.967 ( -2.049 -15.594 -4.395) 16.331 29.167 ( 1.223 6.219 0.897) 6.401 29.178 ( 0.815 4.635 0.342) 4.718 29.375 ( -0.598 0.052 1.844) 1.939 29.441 ( -1.899 -1.996 0.126) 2.758 31.085 ( 1.097 7.410 -0.495) 7.507 31.128 ( 0.396 8.576 -1.198) 8.668 31.362 ( 0.267 -4.090 1.044) 4.230 31.440 ( -1.299 -4.932 -1.076) 5.213 85.888 ( 1.351 1.936 0.966) 2.551 85.891 ( 1.433 2.110 0.914) 2.709 86.231 ( -1.349 -10.105 2.269) 10.444 86.237 ( -1.425 -9.405 2.234) 9.771 ======================= Grid point 377 (132/162) ======================= q-point: ( 0.40 0.44 0.36) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 440 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 4.830 ( 10.144 11.112 -4.258) 15.637 5.029 ( -9.000 8.462 -5.160) 13.388 5.145 ( 5.937 -3.156 -10.053) 12.094 5.272 ( -6.210 -3.941 -10.455) 12.783 5.766 ( 12.450 14.662 3.675) 19.582 5.962 ( -3.009 11.754 -0.189) 12.134 6.556 ( 8.149 -18.516 3.179) 20.478 6.831 ( -15.857 -22.209 -2.112) 27.371 8.077 ( 3.603 4.458 5.529) 7.964 8.142 ( -2.328 3.728 3.789) 5.803 8.330 ( 2.753 -5.482 5.223) 8.057 8.405 ( -4.515 -6.423 2.685) 8.297 9.430 ( 10.145 11.858 1.002) 15.637 9.608 ( -2.014 8.368 1.358) 8.713 9.800 ( 1.836 -2.816 0.987) 3.503 9.976 ( -10.278 -5.833 1.681) 11.936 10.589 ( 4.516 7.270 -1.533) 8.694 10.653 ( -0.399 5.864 -3.171) 6.678 10.862 ( -1.769 -3.909 1.241) 4.467 10.891 ( -3.001 -3.684 0.399) 4.768 11.425 ( 2.325 9.204 -11.169) 14.658 11.451 ( -0.377 9.623 -11.862) 15.279 11.513 ( 1.791 3.445 -13.008) 13.575 11.548 ( -1.134 3.615 -13.303) 13.832 13.510 ( 1.963 11.493 1.703) 11.783 13.544 ( -1.112 10.931 -0.222) 10.990 13.635 ( 1.644 4.222 -4.695) 6.524 13.672 ( -1.660 4.756 -4.660) 6.862 14.232 ( -0.138 6.856 9.079) 11.377 14.248 ( -1.665 3.967 5.798) 7.220 14.442 ( 1.518 -1.734 3.027) 3.804 14.488 ( -3.058 -0.855 1.860) 3.680 16.606 ( 3.644 -6.276 1.485) 7.408 16.671 ( -2.518 -6.657 1.219) 7.222 16.814 ( 4.763 -13.893 -3.569) 15.114 16.906 ( -4.159 -14.950 -4.488) 16.153 29.191 ( 0.943 6.495 0.420) 6.576 29.195 ( 0.596 6.053 0.250) 6.087 29.370 ( 0.374 -1.503 1.678) 2.284 29.397 ( -2.194 -2.095 0.937) 3.175 31.111 ( 1.319 8.222 -0.542) 8.345 31.129 ( -0.408 8.861 -0.834) 8.909 31.376 ( 1.231 -5.016 0.205) 5.169 31.408 ( -1.861 -5.138 -0.624) 5.500 85.916 ( 1.112 3.152 0.833) 3.445 85.918 ( 0.934 3.287 0.789) 3.507 86.205 ( -0.881 -11.116 2.391) 11.404 86.208 ( -1.160 -10.777 2.360) 11.094 ======================= Grid point 380 (133/162) ======================= q-point: ( 0.00 -0.50 0.36) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 150 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 4.868 ( 0.000 -12.593 -11.672) 17.170 4.868 ( 0.000 12.593 -11.672) 17.170 5.184 ( 0.000 -1.796 -5.260) 5.558 5.184 ( 0.000 1.796 -5.260) 5.558 5.752 ( 0.000 -0.277 -3.148) 3.160 5.752 ( 0.000 0.277 -3.148) 3.160 6.810 ( 0.000 -15.628 6.812) 17.048 6.810 ( 0.000 15.628 6.812) 17.048 8.069 ( 0.000 -3.697 4.638) 5.931 8.069 ( 0.000 3.697 4.638) 5.931 8.397 ( 0.000 -6.139 0.642) 6.173 8.397 ( 0.000 6.139 0.642) 6.173 9.363 ( 0.000 -2.449 -9.424) 9.737 9.363 ( 0.000 2.449 -9.424) 9.737 10.063 ( 0.000 -1.834 6.392) 6.650 10.063 ( 0.000 1.834 6.392) 6.650 10.668 ( 0.000 -2.247 2.372) 3.267 10.668 ( 0.000 2.247 2.372) 3.267 10.930 ( 0.000 -2.584 3.997) 4.760 10.930 ( 0.000 2.584 3.997) 4.760 11.433 ( 0.000 -3.107 -10.653) 11.097 11.433 ( 0.000 3.107 -10.653) 11.097 11.585 ( 0.000 -1.040 -13.487) 13.527 11.585 ( 0.000 1.040 -13.487) 13.527 13.610 ( 0.000 -0.773 -5.647) 5.700 13.610 ( 0.000 0.773 -5.647) 5.700 13.679 ( 0.000 -4.098 -0.958) 4.209 13.679 ( 0.000 4.098 -0.958) 4.209 14.362 ( 0.000 -2.944 3.701) 4.729 14.362 ( 0.000 2.944 3.701) 4.729 14.513 ( 0.000 -8.170 5.608) 9.910 14.513 ( 0.000 8.170 5.608) 9.910 16.482 ( 0.000 -3.080 -0.101) 3.082 16.482 ( 0.000 3.080 -0.101) 3.082 16.752 ( 0.000 -6.741 -1.919) 7.009 16.752 ( 0.000 6.741 -1.919) 7.009 29.217 ( 0.000 -0.044 1.228) 1.229 29.217 ( 0.000 0.044 1.228) 1.229 29.408 ( 0.000 -2.489 0.165) 2.495 29.408 ( 0.000 2.489 0.165) 2.495 31.185 ( 0.000 -3.083 -0.438) 3.114 31.185 ( 0.000 3.083 -0.438) 3.114 31.356 ( 0.000 -4.196 -0.077) 4.197 31.356 ( 0.000 4.196 -0.077) 4.197 85.897 ( 0.000 -0.245 1.225) 1.249 85.897 ( 0.000 0.245 1.225) 1.249 86.151 ( 0.000 -0.570 1.207) 1.335 86.151 ( 0.000 0.570 1.207) 1.335 ======================= Grid point 382 (134/162) ======================= q-point: ( 0.20 -0.50 0.36) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 248 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 4.910 ( 4.291 -11.296 -10.894) 16.270 4.910 ( 4.291 11.296 -10.894) 16.270 5.209 ( 0.792 -3.874 -6.632) 7.721 5.209 ( 0.792 3.874 -6.632) 7.721 5.816 ( 7.622 -5.590 -1.950) 9.651 5.816 ( 7.622 5.590 -1.950) 9.651 6.705 ( -10.449 -15.750 5.511) 19.687 6.705 ( -10.449 15.750 5.511) 19.687 8.099 ( 3.010 -4.059 4.914) 7.048 8.099 ( 3.010 4.059 4.914) 7.048 8.361 ( -3.386 -5.549 1.645) 6.705 8.361 ( -3.386 5.549 1.644) 6.705 9.432 ( 6.832 -4.746 -7.262) 11.043 9.432 ( 6.832 4.746 -7.262) 11.043 10.020 ( -5.261 -4.642 6.296) 9.427 10.020 ( -5.261 4.642 6.296) 9.427 10.645 ( -0.405 -2.608 0.643) 2.716 10.645 ( -0.405 2.608 0.643) 2.716 10.911 ( -2.508 -0.786 2.545) 3.658 10.911 ( -2.508 0.786 2.545) 3.658 11.460 ( 2.558 -2.327 -10.979) 11.511 11.460 ( 2.558 2.327 -10.979) 11.511 11.589 ( 0.068 -1.629 -13.796) 13.892 11.589 ( 0.068 1.629 -13.796) 13.892 13.616 ( 0.920 -2.500 -3.959) 4.772 13.616 ( 0.920 2.500 -3.959) 4.772 13.696 ( 1.097 -4.021 -2.196) 4.711 13.696 ( 1.097 4.021 -2.196) 4.711 14.344 ( -1.269 -2.575 4.990) 5.757 14.344 ( -1.269 2.575 4.990) 5.757 14.484 ( -2.885 -7.195 5.873) 9.725 14.484 ( -2.885 7.195 5.873) 9.725 16.518 ( 3.401 -3.994 -0.564) 5.276 16.518 ( 3.401 3.994 -0.564) 5.276 16.735 ( -1.754 -6.675 -1.985) 7.181 16.735 ( -1.754 6.675 -1.985) 7.181 29.234 ( 1.695 -0.310 1.133) 2.062 29.234 ( 1.695 0.310 1.133) 2.062 29.389 ( -1.913 -2.240 0.273) 2.959 29.389 ( -1.913 2.240 0.273) 2.959 31.202 ( 1.735 -3.206 -0.408) 3.668 31.202 ( 1.735 3.206 -0.408) 3.668 31.341 ( -1.515 -4.102 -0.117) 4.374 31.341 ( -1.515 4.102 -0.117) 4.374 85.921 ( 2.398 -0.325 1.222) 2.712 85.921 ( 2.398 0.325 1.222) 2.712 86.126 ( -2.391 -0.563 1.208) 2.738 86.126 ( -2.391 0.563 1.208) 2.738 ======================= Grid point 384 (135/162) ======================= q-point: ( 0.40 -0.50 0.36) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 248 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 5.027 ( 7.204 -8.695 -9.672) 14.868 5.027 ( 7.204 8.695 -9.672) 14.868 5.161 ( -5.521 -6.002 -8.477) 11.763 5.161 ( -5.521 6.002 -8.477) 11.763 6.069 ( 17.184 -12.050 0.329) 20.990 6.069 ( 17.184 12.050 0.329) 20.991 6.423 ( -17.492 -15.076 2.841) 23.267 6.423 ( -17.492 15.076 2.841) 23.267 8.179 ( 4.801 -4.507 4.881) 8.196 8.179 ( 4.801 4.507 4.881) 8.196 8.277 ( -4.940 -4.824 3.614) 7.793 8.277 ( -4.940 4.824 3.614) 7.793 9.615 ( 11.280 -6.724 -1.976) 13.280 9.615 ( 11.280 6.724 -1.976) 13.280 9.847 ( -11.531 -6.766 3.598) 13.845 9.847 ( -11.531 6.766 3.598) 13.845 10.700 ( 5.622 -2.877 -1.137) 6.417 10.700 ( 5.622 2.877 -1.137) 6.417 10.824 ( -6.075 -1.918 -0.106) 6.371 10.824 ( -6.075 1.918 -0.106) 6.371 11.520 ( 3.226 -1.452 -12.094) 12.601 11.520 ( 3.226 1.452 -12.094) 12.601 11.573 ( -1.871 -1.733 -13.532) 13.770 11.573 ( -1.871 1.733 -13.532) 13.770 13.651 ( 2.553 -2.887 -2.704) 4.708 13.651 ( 2.553 2.887 -2.704) 4.708 13.696 ( -1.390 -3.153 -2.908) 4.509 13.696 ( -1.390 3.153 -2.908) 4.509 14.344 ( 1.839 -3.531 6.756) 7.842 14.344 ( 1.839 3.531 6.756) 7.842 14.410 ( -4.251 -5.433 6.643) 9.577 14.410 ( -4.251 5.433 6.643) 9.577 16.600 ( 4.568 -5.406 -1.429) 7.220 16.600 ( 4.568 5.406 -1.429) 7.220 16.682 ( -3.571 -6.314 -1.943) 7.510 16.682 ( -3.571 6.314 -1.943) 7.510 29.280 ( 2.837 -0.883 0.877) 3.098 29.280 ( 2.837 0.883 0.877) 3.098 29.339 ( -2.970 -1.615 0.549) 3.425 29.339 ( -2.970 1.615 0.549) 3.425 31.247 ( 2.682 -3.506 -0.327) 4.426 31.247 ( 2.682 3.506 -0.327) 4.426 31.300 ( -2.547 -3.846 -0.216) 4.618 31.300 ( -2.547 3.846 -0.216) 4.618 85.985 ( 3.877 -0.450 1.216) 4.088 85.985 ( 3.877 0.451 1.216) 4.088 86.063 ( -3.873 -0.531 1.211) 4.092 86.063 ( -3.873 0.531 1.211) 4.092 ======================= Grid point 425 (136/162) ======================= q-point: ( 0.00 0.00 0.45) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 162 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.143 ( 0.000 0.000 21.444) 21.444 3.495 ( 0.000 0.000 25.133) 25.133 3.503 ( 0.000 0.000 -15.956) 15.956 3.902 ( 0.000 0.000 -16.309) 16.309 4.577 ( 0.000 0.000 11.980) 11.980 4.792 ( 0.000 0.000 -10.325) 10.325 5.211 ( 0.000 0.000 14.746) 14.746 5.321 ( 0.000 0.000 1.800) 1.800 6.540 ( 0.000 0.000 4.623) 4.623 6.651 ( 0.000 0.000 -7.022) 7.022 7.733 ( 0.000 0.000 1.735) 1.735 7.816 ( 0.000 0.000 -4.359) 4.359 8.380 ( 0.000 0.000 0.642) 0.642 8.396 ( 0.000 0.000 -1.023) 1.023 9.124 ( 0.000 0.000 0.162) 0.162 9.129 ( 0.000 0.000 -0.289) 0.289 9.455 ( 0.000 0.000 1.970) 1.970 9.531 ( 0.000 0.000 -6.199) 6.199 10.369 ( 0.000 0.000 8.654) 8.654 10.485 ( 0.000 0.000 -4.022) 4.022 11.243 ( 0.000 0.000 2.697) 2.697 11.323 ( 0.000 0.000 -5.397) 5.397 11.868 ( 0.000 0.000 7.889) 7.889 12.041 ( 0.000 0.000 -10.243) 10.243 12.087 ( 0.000 0.000 0.212) 0.212 12.091 ( 0.000 0.000 -0.177) 0.177 12.176 ( 0.000 0.000 -0.053) 0.053 12.177 ( 0.000 0.000 -0.087) 0.087 14.275 ( 0.000 0.000 2.410) 2.410 14.348 ( 0.000 0.000 -4.832) 4.832 15.491 ( 0.000 0.000 21.344) 21.344 15.904 ( 0.000 0.000 -20.781) 20.781 18.116 ( 0.000 0.000 8.210) 8.210 18.197 ( 0.000 0.000 -0.664) 0.664 19.051 ( 0.000 0.000 5.246) 5.246 19.190 ( 0.000 0.000 -8.717) 8.717 28.050 ( 0.000 0.000 10.139) 10.139 28.076 ( 0.000 0.000 8.297) 8.297 28.276 ( 0.000 0.000 -7.887) 7.887 28.282 ( 0.000 0.000 -9.376) 9.376 30.271 ( 0.000 0.000 8.902) 8.902 30.427 ( 0.000 0.000 -7.298) 7.298 31.982 ( 0.000 0.000 0.819) 0.819 32.023 ( 0.000 0.000 -3.259) 3.259 86.288 ( 0.000 0.000 6.910) 6.910 86.380 ( 0.000 0.000 -2.357) 2.357 88.937 ( 0.000 0.000 28.786) 28.786 89.479 ( 0.000 0.000 -27.281) 27.281 ======================= Grid point 426 (137/162) ======================= q-point: ( 0.20 0.00 0.45) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 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| 3.175 ( 3.172 0.000 18.533) 18.802 3.306 ( -14.765 0.000 19.609) 24.546 3.465 ( -3.689 0.000 -11.268) 11.856 3.621 ( -22.774 0.000 -12.513) 25.986 4.601 ( 2.392 0.000 8.648) 8.973 4.775 ( -1.752 0.000 -8.950) 9.120 5.406 ( 15.439 0.000 14.816) 21.398 5.528 ( 14.977 0.000 1.129) 15.020 6.579 ( 4.977 0.000 7.536) 9.031 6.722 ( 6.299 0.000 -7.468) 9.770 7.749 ( 1.418 0.000 2.841) 3.176 7.836 ( 1.761 0.000 -4.824) 5.135 8.382 ( 0.136 0.000 0.486) 0.505 8.395 ( -0.168 0.000 -0.861) 0.877 9.125 ( 0.058 0.000 0.116) 0.129 9.129 ( -0.023 0.000 -0.249) 0.250 9.334 ( -11.126 0.000 -2.171) 11.336 9.355 ( -14.816 0.000 -4.808) 15.577 10.438 ( 5.744 0.000 7.491) 9.440 10.533 ( 3.822 0.000 -2.592) 4.618 11.286 ( 4.570 0.000 5.073) 6.828 11.392 ( 6.214 0.000 -5.062) 8.015 11.852 ( -1.843 0.000 6.666) 6.916 12.019 ( -2.736 0.000 -10.351) 10.706 12.089 ( 0.206 0.000 0.181) 0.274 12.092 ( 0.141 0.000 -0.141) 0.200 12.174 ( -0.174 0.000 -0.050) 0.181 12.175 ( -0.170 0.000 -0.095) 0.195 14.320 ( 4.205 0.000 2.122) 4.710 14.387 ( 3.728 0.000 -4.575) 5.902 15.386 ( -8.705 0.000 17.446) 19.497 15.722 ( -15.867 0.000 -16.697) 23.034 18.270 ( 12.243 0.000 3.932) 12.859 18.311 ( 11.352 0.000 0.336) 11.357 19.000 ( -4.710 0.000 6.698) 8.188 19.147 ( -4.435 0.000 -7.805) 8.977 28.052 ( 0.246 0.000 9.979) 9.982 28.074 ( -0.255 0.000 8.491) 8.495 28.277 ( 0.064 0.000 -8.049) 8.049 28.282 ( -0.054 0.000 -9.248) 9.248 30.283 ( 1.268 0.000 7.195) 7.306 30.410 ( -1.678 0.000 -5.917) 6.150 31.987 ( 0.472 0.000 0.414) 0.627 32.020 ( -0.307 0.000 -2.895) 2.911 86.297 ( 0.925 0.000 6.374) 6.440 86.372 ( -0.781 0.000 -1.129) 1.372 88.970 ( 3.436 0.000 23.448) 23.698 89.408 ( -6.851 0.000 -21.726) 22.781 ======================= Grid point 427 (138/162) ======================= q-point: ( 0.40 0.00 0.45) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 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| 3.095 ( -3.674 0.000 8.031) 8.831 3.214 ( -15.385 0.000 -4.089) 15.919 3.261 ( 5.290 0.000 10.507) 11.764 3.370 ( -5.588 0.000 -0.619) 5.623 4.661 ( 3.432 0.000 1.629) 3.799 4.726 ( -3.057 0.000 -4.842) 5.727 5.662 ( 8.799 0.000 10.610) 13.784 5.722 ( 3.216 0.000 4.025) 5.152 6.739 ( 9.324 0.000 7.268) 11.822 6.827 ( 1.770 0.000 -1.894) 2.592 7.791 ( 3.234 0.000 2.669) 4.193 7.850 ( -1.345 0.000 -2.937) 3.230 8.385 ( 0.235 0.000 0.075) 0.247 8.390 ( -0.255 0.000 -0.440) 0.508 9.095 ( -7.730 0.000 -5.581) 9.534 9.116 ( -8.732 0.000 -7.498) 11.509 9.126 ( 0.077 0.000 -0.002) 0.077 9.128 ( -0.055 0.000 -0.141) 0.152 10.544 ( 4.206 0.000 4.911) 6.466 10.583 ( 0.429 0.000 0.815) 0.921 11.416 ( 7.838 0.000 7.871) 11.108 11.502 ( 1.900 0.000 1.537) 2.444 11.819 ( 0.799 0.000 -1.442) 1.648 11.921 ( -6.934 0.000 -9.754) 11.968 12.094 ( 0.177 0.000 0.090) 0.198 12.095 ( 0.056 0.000 -0.039) 0.068 12.171 ( -0.104 0.000 -0.065) 0.123 12.172 ( -0.127 0.000 -0.091) 0.156 14.413 ( 4.480 0.000 1.467) 4.714 14.453 ( 1.316 0.000 -2.347) 2.691 15.266 ( -0.640 0.000 6.267) 6.299 15.405 ( -13.773 0.000 -7.649) 15.755 18.487 ( 9.433 0.000 1.456) 9.545 18.544 ( 6.878 0.000 -4.391) 8.160 18.917 ( -0.849 0.000 8.153) 8.197 19.020 ( -7.999 0.000 -2.710) 8.446 28.059 ( 0.402 0.000 9.545) 9.554 28.067 ( -0.408 0.000 8.979) 8.988 28.278 ( 0.098 0.000 -8.448) 8.449 28.280 ( -0.092 0.000 -8.903) 8.904 30.319 ( 2.272 0.000 2.880) 3.668 30.367 ( -2.525 0.000 -2.132) 3.305 31.999 ( 0.689 0.000 -0.640) 0.940 32.012 ( -0.587 0.000 -1.909) 1.997 86.321 ( 1.475 0.000 4.628) 4.857 86.351 ( -1.387 0.000 1.760) 2.241 89.075 ( 7.190 0.000 9.579) 11.977 89.241 ( -9.285 0.000 -7.562) 11.975 ======================= Grid point 430 (139/162) ======================= q-point: ( 0.00 0.06 0.45) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 264 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.485 ( 0.000 30.013 19.266) 35.665 3.535 ( 0.000 4.770 22.207) 22.713 3.830 ( 0.000 29.963 -13.005) 32.664 3.926 ( 0.000 4.858 -13.937) 14.759 4.778 ( 0.000 17.205 11.967) 20.958 4.990 ( 0.000 17.424 -9.891) 20.036 5.316 ( 0.000 11.977 12.646) 17.417 5.412 ( 0.000 10.919 1.088) 10.974 6.559 ( 0.000 3.039 5.157) 5.986 6.683 ( 0.000 3.916 -7.326) 8.307 7.694 ( 0.000 -3.217 -0.267) 3.228 7.737 ( 0.000 -6.302 -2.904) 6.939 8.592 ( 0.000 19.554 1.656) 19.624 8.611 ( 0.000 19.425 0.345) 19.428 9.105 ( 0.000 -1.847 -0.187) 1.857 9.136 ( 0.000 1.436 -2.654) 3.018 9.498 ( 0.000 3.979 3.988) 5.634 9.608 ( 0.000 7.110 -7.260) 10.161 10.333 ( 0.000 -3.217 8.382) 8.978 10.448 ( 0.000 -3.643 -3.983) 5.397 11.173 ( 0.000 -6.295 1.524) 6.476 11.226 ( 0.000 -8.648 -3.771) 9.434 11.819 ( 0.000 -3.770 6.447) 7.468 11.933 ( 0.000 -5.521 -4.759) 7.289 12.181 ( 0.000 8.486 0.539) 8.503 12.203 ( 0.000 9.089 -1.927) 9.291 12.331 ( 0.000 14.072 1.238) 14.126 12.384 ( 0.000 16.569 -4.765) 17.241 14.260 ( 0.000 -1.446 2.462) 2.855 14.331 ( 0.000 -1.611 -4.632) 4.904 15.381 ( 0.000 -11.005 20.472) 23.243 15.778 ( 0.000 -12.534 -20.077) 23.668 18.055 ( 0.000 -6.103 7.530) 9.693 18.129 ( 0.000 -6.739 -0.684) 6.774 18.953 ( 0.000 -9.816 4.556) 10.822 19.073 ( 0.000 -11.552 -7.513) 13.780 28.124 ( 0.000 7.135 10.505) 12.699 28.170 ( 0.000 9.043 8.078) 12.126 28.332 ( 0.000 5.201 -9.788) 11.084 28.336 ( 0.000 6.214 -7.850) 10.012 30.282 ( 0.000 1.240 8.404) 8.495 30.431 ( 0.000 0.439 -6.974) 6.988 31.955 ( 0.000 -2.745 0.833) 2.868 31.996 ( 0.000 -2.809 -3.191) 4.251 86.260 ( 0.000 -2.715 6.364) 6.919 86.343 ( 0.000 -3.663 -1.917) 4.134 88.795 ( 0.000 -14.181 26.657) 30.194 89.285 ( 0.000 -19.207 -23.839) 30.614 ======================= Grid point 431 (140/162) ======================= q-point: ( 0.20 0.06 0.45) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 440 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.345 ( -13.534 5.398 17.359) 22.664 3.510 ( -2.299 22.788 12.954) 26.313 3.645 ( -14.025 15.949 -4.252) 21.660 3.844 ( -5.012 30.057 -12.318) 32.867 4.820 ( 3.733 19.778 9.415) 22.220 5.000 ( -0.372 20.551 -8.898) 22.398 5.467 ( 12.406 7.158 12.971) 19.323 5.574 ( 12.303 5.605 0.953) 13.553 6.603 ( 5.273 3.468 7.702) 9.958 6.751 ( 6.118 3.649 -7.590) 10.409 7.704 ( 0.927 -3.842 1.459) 4.213 7.762 ( 2.076 -5.659 -4.053) 7.263 8.586 ( -0.493 18.590 2.145) 18.720 8.609 ( -0.273 19.261 0.543) 19.271 9.068 ( -4.030 -3.980 -1.081) 5.766 9.112 ( -3.017 -0.430 -4.520) 5.452 9.407 ( -7.448 6.485 1.243) 9.954 9.468 ( -10.627 9.423 -4.856) 15.010 10.414 ( 6.488 -2.222 7.102) 9.873 10.506 ( 4.636 -2.708 -2.563) 5.949 11.215 ( 4.544 -6.490 4.069) 8.906 11.298 ( 6.569 -8.287 -3.964) 11.293 11.783 ( -3.510 -5.101 5.948) 8.586 11.899 ( -3.538 -6.573 -5.271) 9.138 12.188 ( 0.593 8.949 0.485) 8.982 12.208 ( 0.359 9.614 -1.774) 9.783 12.335 ( 0.323 14.067 0.790) 14.093 12.382 ( -0.406 16.331 -4.441) 16.929 14.302 ( 3.886 -1.804 2.188) 4.810 14.367 ( 3.415 -1.931 -4.378) 5.879 15.285 ( -7.977 -10.133 16.754) 21.142 15.610 ( -14.810 -11.243 -16.281) 24.714 18.201 ( 11.912 -6.850 3.549) 14.192 18.236 ( 10.570 -7.449 0.450) 12.939 18.902 ( -4.758 -9.806 5.854) 12.372 19.030 ( -4.426 -11.556 -6.755) 14.098 28.128 ( 0.424 7.304 10.310) 12.642 28.166 ( -0.449 8.846 8.357) 12.178 28.333 ( 0.043 5.306 -9.624) 10.990 28.336 ( -0.027 6.124 -8.056) 10.120 30.294 ( 1.216 1.190 6.784) 6.994 30.415 ( -1.581 0.541 -5.662) 5.904 31.959 ( 0.456 -2.761 0.433) 2.832 31.992 ( -0.311 -2.815 -2.830) 4.003 86.269 ( 0.840 -2.796 5.882) 6.566 86.336 ( -0.687 -3.569 -0.825) 3.727 88.825 ( 3.167 -14.428 21.819) 26.349 89.221 ( -6.120 -18.472 -18.891) 27.120 ======================= Grid point 432 (141/162) ======================= q-point: ( 0.40 0.06 0.45) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 440 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.147 ( -3.722 5.749 7.907) 10.461 3.247 ( -13.327 4.870 -2.011) 14.331 3.632 ( 4.790 34.516 9.140) 36.026 3.739 ( -5.669 34.040 -1.435) 34.539 4.899 ( 3.933 22.174 1.974) 22.606 4.966 ( -2.806 22.423 -4.736) 23.088 5.681 ( 7.630 2.467 9.654) 12.550 5.735 ( 2.612 1.860 3.675) 4.877 6.765 ( 9.245 3.515 7.096) 12.172 6.852 ( 1.671 3.323 -1.954) 4.201 7.736 ( 2.555 -4.468 1.566) 5.380 7.782 ( -0.941 -5.198 -3.063) 6.107 8.581 ( 0.229 17.027 3.059) 17.301 8.597 ( -0.997 18.077 2.213) 18.239 8.969 ( -3.400 -4.798 -6.216) 8.557 9.007 ( -6.127 -3.106 -9.043) 11.356 9.303 ( -2.004 10.805 -0.157) 10.990 9.320 ( -3.752 11.860 -1.817) 12.571 10.530 ( 4.481 -1.319 4.680) 6.612 10.569 ( 0.814 -1.460 0.706) 1.814 11.345 ( 7.783 -6.574 6.993) 12.357 11.422 ( 2.910 -7.358 0.884) 7.961 11.715 ( -1.057 -7.472 0.661) 7.575 11.796 ( -6.585 -8.134 -5.912) 12.020 12.201 ( 0.697 9.948 0.083) 9.973 12.211 ( -0.187 10.385 -0.909) 10.426 12.344 ( 0.646 14.230 -0.950) 14.277 12.364 ( -1.269 15.360 -3.162) 15.733 14.388 ( 4.191 -2.479 1.528) 5.104 14.426 ( 1.094 -2.587 -2.161) 3.544 15.177 ( -0.330 -8.899 5.927) 10.698 15.312 ( -13.065 -9.333 -7.561) 17.747 18.413 ( 9.193 -7.477 1.215) 11.912 18.463 ( 7.224 -8.082 -3.937) 11.533 18.812 ( -1.647 -10.438 7.465) 12.938 18.904 ( -7.816 -11.422 -2.268) 14.025 28.139 ( 0.697 7.759 9.769) 12.495 28.154 ( -0.713 8.347 9.030) 12.317 28.334 ( 0.067 5.572 -9.173) 10.733 28.335 ( -0.058 5.883 -8.574) 10.398 30.328 ( 2.164 1.031 2.689) 3.602 30.374 ( -2.389 0.783 -2.068) 3.255 31.971 ( 0.672 -2.796 -0.605) 2.939 31.984 ( -0.583 -2.818 -1.855) 3.423 86.291 ( 1.328 -3.023 4.314) 5.432 86.317 ( -1.234 -3.322 1.748) 3.951 88.921 ( 6.544 -15.293 9.263) 19.039 89.071 ( -8.357 -16.824 -6.199) 19.782 ======================= Grid point 435 (142/162) ======================= q-point: ( 0.00 0.12 0.45) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 267 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.688 ( 0.000 10.956 18.425) 21.437 3.900 ( 0.000 10.298 0.435) 10.307 4.297 ( 0.000 27.850 4.959) 28.288 4.456 ( 0.000 27.030 -8.393) 28.303 5.170 ( 0.000 24.851 13.502) 28.282 5.391 ( 0.000 25.674 -9.011) 27.210 5.679 ( 0.000 22.427 8.392) 23.946 5.780 ( 0.000 23.900 -3.687) 24.183 6.743 ( 0.000 18.673 5.724) 19.530 6.868 ( 0.000 17.575 -6.576) 18.765 7.608 ( 0.000 -6.700 -0.317) 6.708 7.627 ( 0.000 -3.457 -3.232) 4.732 8.996 ( 0.000 14.716 4.237) 15.314 9.040 ( 0.000 15.043 10.933) 18.596 9.102 ( 0.000 9.521 -6.425) 11.486 9.240 ( 0.000 14.322 -8.549) 16.679 9.583 ( 0.000 3.836 7.561) 8.478 9.772 ( 0.000 8.803 -10.759) 13.902 10.268 ( 0.000 -2.650 7.001) 7.485 10.359 ( 0.000 -4.841 -2.783) 5.584 11.032 ( 0.000 -7.476 -0.938) 7.535 11.035 ( 0.000 -10.144 -1.178) 10.213 11.737 ( 0.000 -4.782 5.344) 7.171 11.827 ( 0.000 -5.694 -3.632) 6.753 12.403 ( 0.000 13.743 0.738) 13.763 12.433 ( 0.000 13.891 -2.521) 14.117 12.662 ( 0.000 18.670 2.074) 18.785 12.741 ( 0.000 18.879 -6.423) 19.942 14.225 ( 0.000 -1.920 2.622) 3.250 14.291 ( 0.000 -2.214 -4.031) 4.599 15.082 ( 0.000 -18.909 18.106) 26.179 15.438 ( 0.000 -21.441 -18.290) 28.182 17.888 ( 0.000 -10.589 5.698) 12.025 17.945 ( 0.000 -11.777 -0.618) 11.793 18.684 ( 0.000 -17.127 3.135) 17.411 18.766 ( 0.000 -19.004 -5.088) 19.674 28.298 ( 0.000 9.924 9.066) 13.442 28.377 ( 0.000 10.398 4.141) 11.192 28.505 ( 0.000 13.187 -7.079) 14.967 28.521 ( 0.000 12.590 -5.448) 13.718 30.323 ( 0.000 2.985 7.002) 7.612 30.449 ( 0.000 1.549 -6.085) 6.280 31.879 ( 0.000 -4.894 0.876) 4.972 31.918 ( 0.000 -4.999 -3.005) 5.832 86.187 ( 0.000 -4.616 4.950) 6.768 86.245 ( 0.000 -6.057 -0.867) 6.119 88.414 ( 0.000 -23.852 21.319) 31.991 88.780 ( 0.000 -30.956 -16.095) 34.890 ======================= Grid point 436 (143/162) ======================= q-point: ( 0.20 0.12 0.45) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 441 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.509 ( -12.949 11.535 14.818) 22.810 3.715 ( -16.677 9.405 -5.470) 19.913 4.314 ( 4.332 35.117 13.802) 37.979 4.540 ( 2.470 33.406 -8.741) 34.619 5.251 ( 7.141 23.166 11.004) 26.622 5.437 ( 3.047 23.056 -7.334) 24.386 5.724 ( 3.998 18.514 8.080) 20.592 5.815 ( 3.062 20.087 -2.270) 20.445 6.795 ( 5.545 18.879 6.725) 20.794 6.924 ( 5.183 16.301 -6.524) 18.307 7.612 ( 0.884 -5.475 1.140) 5.662 7.661 ( 2.417 -4.337 -4.373) 6.616 8.937 ( -5.963 9.605 6.871) 13.229 8.974 ( -6.484 5.104 8.375) 11.758 9.092 ( -0.293 18.178 -7.091) 19.514 9.208 ( -3.246 15.906 -11.513) 19.902 9.550 ( -2.240 7.397 5.848) 9.692 9.676 ( -6.899 11.314 -6.424) 14.726 10.367 ( 7.418 -2.183 5.135) 9.283 10.433 ( 6.153 -4.728 -1.636) 7.930 11.064 ( 4.434 -8.382 2.440) 9.791 11.118 ( 6.814 -9.228 -2.723) 11.790 11.681 ( -5.252 -5.440 5.449) 9.320 11.778 ( -4.908 -6.076 -4.165) 8.852 12.417 ( 1.325 13.958 0.713) 14.039 12.447 ( 1.247 14.162 -2.509) 14.436 12.658 ( -0.507 17.874 1.528) 17.946 12.730 ( -1.299 18.264 -6.178) 19.324 14.257 ( 2.999 -2.531 2.394) 4.597 14.319 ( 2.546 -2.771 -3.777) 5.331 15.010 ( -5.863 -17.288 14.840) 23.526 15.304 ( -11.899 -19.265 -15.107) 27.220 18.014 ( 10.790 -11.924 2.616) 16.292 18.035 ( 8.763 -12.701 0.553) 15.441 18.635 ( -4.774 -17.038 4.068) 18.156 18.723 ( -4.394 -18.990 -4.647) 20.038 28.305 ( 0.744 10.036 8.712) 13.310 28.370 ( -0.738 10.464 4.789) 11.531 28.506 ( 0.115 12.992 -7.022) 14.769 28.520 ( -0.165 12.580 -5.686) 13.806 30.333 ( 1.074 2.900 5.623) 6.417 30.436 ( -1.306 1.736 -4.968) 5.422 31.883 ( 0.412 -4.925 0.490) 4.967 31.915 ( -0.326 -5.012 -2.652) 5.679 86.194 ( 0.639 -4.728 4.608) 6.633 86.241 ( -0.438 -5.899 -0.112) 5.916 88.438 ( 2.465 -24.261 17.691) 30.127 88.733 ( -4.453 -29.988 -12.516) 32.798 ======================= Grid point 437 (144/162) ======================= q-point: ( 0.40 0.12 0.45) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 441 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.328 ( -3.358 12.762 6.979) 14.928 3.411 ( -11.432 11.848 -1.369) 16.521 4.419 ( 5.637 39.887 9.665) 41.427 4.517 ( -3.864 39.655 -0.075) 39.843 5.388 ( 5.721 23.719 2.754) 24.554 5.458 ( -1.321 23.586 -3.838) 23.932 5.809 ( 3.968 13.004 6.488) 15.065 5.853 ( -0.092 13.387 1.525) 13.474 6.942 ( 7.767 16.809 5.467) 19.307 7.013 ( 1.600 15.072 -1.830) 15.267 7.644 ( 2.415 -4.738 0.527) 5.344 7.685 ( -0.662 -4.526 -3.664) 5.861 8.814 ( -4.136 1.822 6.500) 7.917 8.835 ( -5.831 1.629 4.814) 7.734 9.099 ( 1.106 21.281 -8.644) 22.996 9.140 ( -3.030 19.684 -11.636) 23.066 9.530 ( 0.423 11.986 2.412) 12.234 9.569 ( -3.671 13.339 -1.549) 13.921 10.494 ( 4.640 -2.562 3.711) 6.470 10.524 ( 1.870 -3.380 0.638) 3.915 11.190 ( 7.402 -8.497 5.319) 12.461 11.251 ( 3.930 -9.210 0.017) 10.014 11.577 ( -2.684 -6.498 2.114) 7.342 11.649 ( -7.427 -6.879 -4.345) 11.016 12.449 ( 1.701 14.718 0.441) 14.822 12.467 ( 0.253 15.032 -1.269) 15.088 12.652 ( 0.565 16.434 -1.276) 16.493 12.689 ( -2.608 16.883 -4.875) 17.765 14.324 ( 3.361 -3.737 1.748) 5.321 14.360 ( 0.458 -3.953 -1.554) 4.272 14.938 ( 0.610 -14.876 4.967) 15.695 15.060 ( -10.973 -15.726 -7.236) 20.496 18.208 ( 8.663 -13.132 0.807) 15.753 18.245 ( 7.897 -13.746 -2.940) 16.123 18.531 ( -3.455 -17.695 5.737) 18.920 18.601 ( -7.492 -18.853 -1.549) 20.346 28.325 ( 1.215 10.289 7.704) 12.910 28.350 ( -1.215 10.479 6.241) 12.257 28.510 ( 0.253 12.689 -6.746) 14.373 28.515 ( -0.280 12.571 -6.225) 14.031 30.363 ( 1.865 2.624 2.140) 3.865 30.402 ( -2.008 2.178 -1.907) 3.523 31.893 ( 0.627 -4.987 -0.507) 5.051 31.906 ( -0.573 -5.021 -1.709) 5.335 86.210 ( 0.968 -5.050 3.494) 6.217 86.228 ( -0.844 -5.500 1.683) 5.814 88.511 ( 4.963 -25.588 8.286) 27.350 88.624 ( -6.187 -27.763 -3.214) 28.625 ======================= Grid point 440 (145/162) ======================= q-point: ( 0.00 0.19 0.45) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 264 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.957 ( 0.000 16.344 13.333) 21.093 4.097 ( 0.000 10.823 0.599) 10.839 4.656 ( 0.000 10.562 6.620) 12.466 4.766 ( 0.000 7.309 -4.172) 8.416 5.604 ( 0.000 10.592 10.976) 15.253 5.838 ( 0.000 10.821 -12.568) 16.585 6.266 ( 0.000 43.022 7.568) 43.682 6.389 ( 0.000 43.308 -5.406) 43.644 7.303 ( 0.000 34.302 5.587) 34.754 7.390 ( 0.000 30.563 -1.216) 30.587 7.484 ( 0.000 -3.972 0.379) 3.991 7.569 ( 0.000 -1.574 -6.384) 6.575 9.109 ( 0.000 1.074 0.767) 1.320 9.127 ( 0.000 6.038 0.381) 6.050 9.480 ( 0.000 14.851 6.941) 16.393 9.639 ( 0.000 3.170 8.518) 9.089 9.678 ( 0.000 24.293 -4.308) 24.672 9.939 ( 0.000 9.371 -14.445) 17.218 10.248 ( 0.000 0.339 4.741) 4.753 10.294 ( 0.000 -0.808 -0.173) 0.827 10.854 ( 0.000 -7.691 0.823) 7.735 10.902 ( 0.000 -5.278 -4.226) 6.762 11.629 ( 0.000 -6.248 4.577) 7.745 11.705 ( 0.000 -6.888 -2.907) 7.476 12.696 ( 0.000 15.597 0.393) 15.601 12.722 ( 0.000 15.124 -2.403) 15.314 13.020 ( 0.000 16.948 1.019) 16.979 13.081 ( 0.000 14.867 -5.635) 15.899 14.193 ( 0.000 -1.198 2.974) 3.207 14.254 ( 0.000 -1.402 -3.116) 3.417 14.687 ( 0.000 -20.021 14.805) 24.900 14.988 ( 0.000 -23.191 -15.921) 28.131 17.654 ( 0.000 -13.134 3.151) 13.506 17.683 ( 0.000 -14.799 -0.161) 14.800 18.309 ( 0.000 -20.685 2.213) 20.803 18.365 ( 0.000 -21.310 -3.483) 21.592 28.496 ( 0.000 10.206 5.784) 11.731 28.567 ( 0.000 9.456 -1.220) 9.535 28.803 ( 0.000 15.356 -1.149) 15.399 28.812 ( 0.000 16.759 -2.518) 16.947 30.404 ( 0.000 5.404 4.967) 7.340 30.498 ( 0.000 3.597 -4.816) 6.011 31.771 ( 0.000 -5.973 0.961) 6.050 31.808 ( 0.000 -6.069 -2.749) 6.663 86.089 ( 0.000 -5.254 3.198) 6.151 86.119 ( 0.000 -6.603 0.214) 6.606 87.904 ( 0.000 -27.360 14.939) 31.173 88.135 ( 0.000 -33.738 -8.496) 34.791 ======================= Grid point 441 (146/162) ======================= q-point: ( 0.20 0.19 0.45) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 440 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.787 ( -11.493 16.466 11.578) 23.179 3.943 ( -13.748 13.767 -3.982) 19.859 4.761 ( 10.612 11.886 13.655) 20.984 4.943 ( 10.411 9.281 -5.282) 14.914 5.620 ( 2.081 9.074 10.492) 14.027 5.831 ( -0.922 10.721 -10.354) 14.933 6.287 ( 1.887 42.684 6.595) 43.232 6.388 ( -0.228 41.206 -4.533) 41.456 7.349 ( 4.439 33.454 3.265) 33.905 7.398 ( 1.208 27.019 -1.808) 27.106 7.501 ( 1.772 -5.248 2.556) 6.100 7.604 ( 2.526 0.988 -7.025) 7.530 9.013 ( -8.569 3.190 3.095) 9.653 9.031 ( -8.079 5.144 1.023) 9.632 9.487 ( 0.862 16.189 2.766) 16.446 9.622 ( -3.180 17.172 -10.032) 20.140 9.696 ( 3.095 11.854 11.836) 17.035 9.904 ( -3.272 12.386 -8.631) 15.447 10.325 ( 5.437 -5.841 1.620) 8.143 10.340 ( 4.661 -0.874 0.147) 4.744 10.909 ( 5.458 -6.641 2.255) 8.887 10.973 ( 6.600 -5.036 -4.150) 9.281 11.568 ( -5.725 -6.191 5.074) 9.841 11.655 ( -4.977 -6.526 -3.670) 8.991 12.710 ( 1.483 15.481 0.304) 15.555 12.736 ( 1.456 14.850 -2.458) 15.122 12.995 ( -2.343 15.748 0.854) 15.945 13.056 ( -2.551 14.201 -5.685) 15.508 14.213 ( 1.871 -1.774 2.803) 3.808 14.270 ( 1.371 -2.010 -2.768) 3.685 14.652 ( -2.629 -17.923 12.026) 21.744 14.901 ( -7.784 -20.626 -13.271) 25.732 17.752 ( 8.733 -14.529 1.137) 16.990 17.756 ( 7.223 -15.574 0.814) 17.186 18.262 ( -4.624 -20.521 2.756) 21.215 18.323 ( -4.302 -21.234 -3.329) 21.920 28.504 ( 0.814 10.202 5.222) 11.490 28.562 ( -0.490 9.587 -0.474) 9.611 28.801 ( -0.134 15.455 -1.316) 15.512 28.809 ( -0.298 16.484 -2.390) 16.659 30.412 ( 0.881 5.308 3.932) 6.664 30.489 ( -0.897 3.841 -3.981) 5.604 31.774 ( 0.348 -6.013 0.593) 6.052 31.804 ( -0.353 -6.092 -2.408) 6.560 86.093 ( 0.435 -5.338 3.029) 6.153 86.118 ( -0.115 -6.428 0.589) 6.456 87.919 ( 1.575 -27.810 12.653) 30.594 88.106 ( -2.780 -32.960 -6.299) 33.672 ======================= Grid point 442 (147/162) ======================= q-point: ( 0.40 0.19 0.45) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 440 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.633 ( -2.805 17.927 5.797) 19.049 3.697 ( -9.083 17.025 -0.731) 19.311 4.961 ( 8.250 14.236 10.553) 19.547 5.050 ( -0.076 13.217 1.431) 13.295 5.697 ( 5.310 7.401 5.298) 10.538 5.790 ( -3.526 9.367 -3.437) 10.583 6.330 ( 2.326 40.879 2.626) 41.029 6.371 ( -1.611 39.460 -2.150) 39.552 7.428 ( 2.756 26.741 2.569) 27.005 7.446 ( 1.861 24.858 0.981) 24.947 7.554 ( 4.129 -3.470 -1.317) 5.552 7.623 ( -1.408 1.617 -6.694) 7.029 8.863 ( -4.548 6.329 3.860) 8.697 8.878 ( -5.742 5.966 2.051) 8.530 9.513 ( 1.841 18.325 -2.738) 18.620 9.559 ( -2.866 19.748 -7.233) 21.225 9.759 ( 3.334 11.559 5.490) 13.224 9.830 ( -3.880 13.245 -1.496) 13.883 10.410 ( 3.152 -7.259 1.451) 8.046 10.424 ( 2.097 -6.350 -0.210) 6.690 11.047 ( 7.559 -5.119 3.886) 9.922 11.105 ( 4.037 -4.640 -1.503) 6.332 11.456 ( -3.016 -6.092 2.575) 7.269 11.524 ( -7.496 -6.084 -3.803) 10.376 12.750 ( 2.239 15.445 0.142) 15.607 12.768 ( 0.982 15.145 -1.684) 15.270 12.952 ( -0.958 13.369 -1.210) 13.458 12.988 ( -3.818 12.893 -4.841) 14.291 14.255 ( 2.207 -2.995 2.244) 4.345 14.285 ( -0.397 -3.330 -0.332) 3.370 14.636 ( 2.057 -14.759 3.404) 15.286 14.738 ( -7.692 -16.075 -6.555) 18.988 17.916 ( 8.379 -16.385 1.014) 18.431 17.949 ( 8.437 -16.108 -2.371) 18.338 18.148 ( -5.351 -20.885 4.006) 21.929 18.202 ( -7.499 -21.132 -1.695) 22.488 28.525 ( 1.204 10.125 3.635) 10.824 28.547 ( -1.003 9.884 1.442) 10.039 28.800 ( 0.014 15.658 -1.706) 15.751 28.803 ( -0.282 15.982 -2.095) 16.121 30.436 ( 1.439 4.975 1.325) 5.345 30.465 ( -1.448 4.412 -1.696) 4.944 31.783 ( 0.566 -6.087 -0.356) 6.124 31.795 ( -0.569 -6.118 -1.502) 6.325 86.104 ( 0.574 -5.601 2.455) 6.142 86.113 ( -0.376 -6.017 1.508) 6.215 87.966 ( 3.157 -29.141 6.716) 30.071 88.038 ( -3.901 -31.102 -0.518) 31.350 ======================= Grid point 445 (148/162) ======================= q-point: ( 0.00 0.25 0.45) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 267 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 4.310 ( 0.000 10.131 7.024) 12.328 4.311 ( 0.000 19.324 6.613) 20.424 4.821 ( 0.000 8.233 1.478) 8.364 4.844 ( 0.000 2.229 -1.929) 2.948 5.643 ( 0.000 -3.129 8.320) 8.889 5.877 ( 0.000 -3.801 -14.740) 15.222 7.194 ( 0.000 46.496 6.998) 47.020 7.240 ( 0.000 21.878 5.364) 22.526 7.420 ( 0.000 18.191 -2.115) 18.314 7.499 ( 0.000 -1.809 -7.285) 7.506 7.962 ( 0.000 20.990 0.320) 20.993 7.967 ( 0.000 26.336 1.577) 26.383 9.049 ( 0.000 -7.404 6.461) 9.827 9.255 ( 0.000 1.214 -13.500) 13.555 9.702 ( 0.000 17.282 12.445) 21.297 9.811 ( 0.000 16.251 5.580) 17.183 10.105 ( 0.000 18.857 -2.233) 18.989 10.160 ( 0.000 9.869 -2.884) 10.281 10.250 ( 0.000 -0.231 1.995) 2.008 10.336 ( 0.000 5.615 -6.987) 8.964 10.767 ( 0.000 -0.643 1.629) 1.752 10.844 ( 0.000 -0.356 -6.833) 6.842 11.496 ( 0.000 -7.178 4.339) 8.387 11.564 ( 0.000 -7.202 -2.501) 7.624 12.990 ( 0.000 14.073 -0.077) 14.073 13.004 ( 0.000 13.389 -1.205) 13.443 13.280 ( 0.000 4.742 -2.759) 5.486 13.284 ( 0.000 9.137 -2.431) 9.455 14.181 ( 0.000 0.117 3.931) 3.933 14.244 ( 0.000 0.592 -2.268) 2.344 14.370 ( 0.000 -10.744 10.591) 15.087 14.597 ( 0.000 -15.180 -12.611) 19.735 17.377 ( 0.000 -16.256 0.818) 16.276 17.384 ( 0.000 -14.371 0.376) 14.375 17.898 ( 0.000 -20.942 2.487) 21.090 17.957 ( 0.000 -20.208 -3.502) 20.509 28.692 ( 0.000 9.774 3.679) 10.444 28.748 ( 0.000 8.981 -2.122) 9.228 29.089 ( 0.000 13.229 1.551) 13.319 29.120 ( 0.000 14.048 -1.673) 14.148 30.535 ( 0.000 8.057 2.716) 8.503 30.593 ( 0.000 6.169 -3.324) 7.008 31.654 ( 0.000 -5.799 1.126) 5.908 31.690 ( 0.000 -5.825 -2.487) 6.334 85.990 ( 0.000 -4.622 1.653) 4.909 85.999 ( 0.000 -5.483 0.863) 5.550 87.378 ( 0.000 -25.893 9.222) 27.486 87.502 ( 0.000 -30.452 -3.260) 30.626 ======================= Grid point 446 (149/162) ======================= q-point: ( 0.20 0.25 0.45) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 441 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 4.124 ( -9.452 17.069 9.094) 21.526 4.241 ( -10.093 16.569 -2.542) 19.567 4.905 ( 10.561 5.152 9.956) 15.401 5.034 ( 10.336 2.230 -3.804) 11.238 5.656 ( 1.919 -2.629 9.372) 9.922 5.887 ( 0.398 -2.466 -12.989) 13.227 7.198 ( -0.337 41.855 4.755) 42.125 7.214 ( -1.670 28.229 3.609) 28.508 7.443 ( 2.151 12.578 -0.095) 12.761 7.507 ( 0.712 -0.002 -6.500) 6.539 7.945 ( -1.390 18.131 -0.479) 18.191 7.970 ( -0.115 23.097 -1.640) 23.155 9.038 ( 0.103 -0.606 10.636) 10.654 9.266 ( -0.677 14.371 -10.269) 17.676 9.686 ( 0.194 8.689 10.744) 13.819 9.846 ( 2.447 15.285 0.000) 15.479 10.051 ( -4.415 16.969 0.701) 17.548 10.156 ( -1.435 11.487 -4.415) 12.389 10.229 ( -0.992 -2.306 3.141) 4.021 10.330 ( -0.683 0.699 -7.840) 7.901 10.844 ( 7.225 0.340 2.739) 7.734 10.931 ( 7.871 0.674 -6.323) 10.119 11.440 ( -5.213 -6.690 5.030) 9.860 11.526 ( -4.068 -6.566 -3.589) 8.517 13.000 ( 1.143 13.680 -0.461) 13.736 13.008 ( 0.568 12.712 -0.999) 12.764 13.229 ( -4.075 6.680 -1.300) 7.933 13.256 ( -3.373 6.621 -3.917) 8.400 14.193 ( 1.093 -0.140 3.781) 3.938 14.248 ( 0.145 -0.131 -0.986) 1.006 14.375 ( 0.816 -9.017 7.683) 11.874 14.559 ( -3.458 -12.989 -10.524) 17.071 17.436 ( 5.691 -16.921 1.472) 17.913 17.459 ( 7.067 -15.390 -0.693) 16.949 17.855 ( -4.290 -20.690 2.724) 21.305 17.917 ( -4.047 -20.018 -3.554) 20.730 28.700 ( 0.765 9.746 3.146) 10.270 28.745 ( -0.271 9.093 -1.579) 9.233 29.088 ( -0.049 13.233 1.281) 13.295 29.113 ( -0.654 13.896 -1.289) 13.971 30.542 ( 0.681 7.968 2.071) 8.261 30.589 ( -0.413 6.436 -2.807) 7.034 31.656 ( 0.274 -5.844 0.768) 5.901 31.685 ( -0.403 -5.864 -2.154) 6.260 85.994 ( 0.322 -4.645 1.635) 4.935 86.001 ( 0.194 -5.322 0.946) 5.409 87.385 ( 0.726 -26.294 8.015) 27.498 87.485 ( -1.597 -29.980 -2.098) 30.096 ======================= Grid point 447 (150/162) ======================= q-point: ( 0.40 0.25 0.45) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 441 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 4.006 ( -1.892 19.706 4.814) 20.374 4.058 ( -6.860 19.430 -0.382) 20.609 5.095 ( 7.115 2.508 7.246) 10.460 5.156 ( 1.355 0.783 0.517) 1.648 5.742 ( 6.591 -1.065 6.548) 9.352 5.859 ( -3.952 -0.564 -4.352) 5.906 7.178 ( -0.074 31.872 -0.143) 31.872 7.196 ( -1.216 37.792 -0.969) 37.824 7.490 ( 2.245 5.853 1.506) 6.447 7.516 ( -0.240 3.203 -1.626) 3.600 7.928 ( 0.206 14.913 -3.250) 15.265 7.952 ( -1.630 16.233 -5.140) 17.105 9.084 ( 4.605 15.842 12.325) 20.594 9.196 ( -5.781 25.485 3.660) 26.387 9.744 ( 5.291 3.652 -0.172) 6.431 9.849 ( -3.734 10.047 -8.331) 13.575 10.004 ( 1.649 13.873 6.408) 15.370 10.082 ( -4.965 12.521 0.059) 13.470 10.250 ( 2.517 -5.098 -1.774) 5.956 10.301 ( -2.280 -4.385 -6.320) 8.023 11.012 ( 8.704 1.095 3.652) 9.502 11.085 ( 4.565 2.031 -3.246) 5.958 11.334 ( -2.925 -6.397 2.792) 7.568 11.409 ( -7.208 -5.559 -4.310) 10.072 13.031 ( 1.852 12.650 -0.415) 12.791 13.037 ( 1.959 12.218 -1.146) 12.427 13.148 ( -3.052 6.424 -1.600) 7.290 13.170 ( -4.407 6.129 -3.803) 8.453 14.218 ( 1.287 -0.709 3.341) 3.650 14.240 ( -0.908 -1.069 1.975) 2.422 14.412 ( 2.974 -7.209 0.687) 7.828 14.482 ( -3.992 -9.074 -5.615) 11.393 17.578 ( 8.152 -18.075 2.299) 19.961 17.627 ( 9.038 -16.857 -2.762) 19.326 17.739 ( -7.062 -20.409 3.285) 21.844 17.802 ( -7.534 -19.484 -3.188) 21.132 28.718 ( 1.023 9.619 1.707) 9.822 28.736 ( -0.708 9.362 -0.118) 9.390 29.089 ( 0.242 13.315 0.564) 13.329 29.098 ( -0.685 13.568 -0.393) 13.591 30.559 ( 0.965 7.640 0.458) 7.714 30.577 ( -0.799 7.052 -1.400) 7.233 31.664 ( 0.507 -5.918 -0.156) 5.942 31.675 ( -0.588 -5.925 -1.271) 6.088 86.001 ( 0.305 -4.745 1.493) 4.984 86.004 ( 0.016 -4.995 1.201) 5.138 87.408 ( 1.625 -27.379 4.855) 27.853 87.446 ( -2.165 -28.785 0.983) 28.883 ======================= Grid point 450 (151/162) ======================= q-point: ( 0.00 0.31 0.45) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 264 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 4.463 ( 0.000 5.378 12.232) 13.362 4.662 ( 0.000 13.315 -6.764) 14.934 4.913 ( 0.000 8.024 5.882) 9.949 5.020 ( 0.000 12.395 -2.652) 12.676 5.539 ( 0.000 -6.866 4.490) 8.204 5.736 ( 0.000 -10.175 -14.697) 17.876 7.189 ( 0.000 -7.034 14.318) 15.953 7.441 ( 0.000 -3.479 -11.709) 12.215 7.961 ( 0.000 27.152 10.295) 29.038 8.133 ( 0.000 32.223 -6.739) 32.920 8.198 ( 0.000 5.155 4.841) 7.071 8.303 ( 0.000 9.220 -1.963) 9.426 8.893 ( 0.000 -4.905 7.277) 8.776 9.136 ( 0.000 -8.651 -13.985) 16.444 10.082 ( 0.000 2.812 14.863) 15.126 10.206 ( 0.000 7.711 7.100) 10.482 10.266 ( 0.000 23.680 0.925) 23.698 10.339 ( 0.000 14.119 1.611) 14.210 10.486 ( 0.000 21.939 -10.468) 24.309 10.524 ( 0.000 11.236 -10.634) 15.471 10.814 ( 0.000 4.507 1.505) 4.752 10.887 ( 0.000 4.293 -7.465) 8.612 11.362 ( 0.000 -6.076 4.612) 7.628 11.437 ( 0.000 -5.406 -3.031) 6.197 13.228 ( 0.000 7.991 3.656) 8.788 13.231 ( 0.000 10.283 0.038) 10.283 13.302 ( 0.000 1.533 -2.915) 3.294 13.379 ( 0.000 2.349 -7.154) 7.530 14.206 ( 0.000 2.771 6.018) 6.625 14.280 ( 0.000 0.093 6.259) 6.259 14.287 ( 0.000 4.007 -2.158) 4.551 14.423 ( 0.000 -3.325 -8.223) 8.870 17.058 ( 0.000 -16.168 2.009) 16.292 17.099 ( 0.000 -14.669 -2.031) 14.808 17.500 ( 0.000 -19.713 3.644) 20.047 17.579 ( 0.000 -18.612 -4.420) 19.129 28.874 ( 0.000 8.828 2.342) 9.133 28.913 ( 0.000 7.925 -1.752) 8.116 29.300 ( 0.000 8.183 2.685) 8.613 29.342 ( 0.000 8.436 -1.554) 8.578 30.713 ( 0.000 9.957 0.738) 9.984 30.736 ( 0.000 8.301 -1.721) 8.478 31.550 ( 0.000 -4.783 1.403) 4.985 31.586 ( 0.000 -4.720 -2.273) 5.239 85.912 ( 0.000 -3.261 0.957) 3.398 85.915 ( 0.000 -2.980 0.659) 3.052 86.911 ( 0.000 -21.637 4.907) 22.187 86.964 ( 0.000 -24.418 -0.390) 24.422 ======================= Grid point 451 (152/162) ======================= q-point: ( 0.20 0.31 0.45) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 440 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 4.409 ( -3.546 11.374 9.902) 15.492 4.569 ( -7.388 15.529 -5.913) 18.185 5.009 ( 7.403 6.072 5.547) 11.065 5.087 ( 4.376 4.662 -2.299) 6.795 5.569 ( 3.801 -5.613 7.056) 9.784 5.785 ( 3.833 -7.143 -13.649) 15.875 7.182 ( -0.366 -8.260 12.114) 14.667 7.411 ( -3.257 -4.984 -11.072) 12.572 7.965 ( 0.414 24.303 10.007) 26.286 8.103 ( -2.802 28.355 0.218) 28.494 8.159 ( -1.835 10.065 -2.994) 10.659 8.245 ( -5.974 7.952 -7.385) 12.388 8.990 ( 11.158 -2.202 16.041) 19.664 9.321 ( 15.473 -5.644 -15.949) 22.927 9.959 ( -11.805 9.175 18.281) 23.616 10.199 ( -5.892 8.658 -2.992) 10.892 10.236 ( 1.865 7.786 4.617) 9.242 10.330 ( -3.546 14.055 4.982) 15.328 10.389 ( -3.453 21.014 -13.176) 25.043 10.509 ( -2.669 17.300 -10.411) 20.367 10.897 ( 7.148 4.109 2.518) 8.621 10.982 ( 8.204 3.824 -6.879) 11.369 11.319 ( -4.149 -5.166 5.177) 8.409 11.412 ( -2.849 -4.719 -4.282) 6.980 13.205 ( -1.248 6.841 2.445) 7.371 13.245 ( 0.585 10.931 -0.345) 10.952 13.278 ( -2.284 1.942 -1.856) 3.526 13.352 ( -2.475 4.350 -6.175) 7.949 14.213 ( 0.690 2.434 5.902) 6.422 14.264 ( -0.851 1.633 4.059) 4.458 14.315 ( 1.931 1.906 -0.585) 2.776 14.414 ( -0.919 -2.618 -7.275) 7.786 17.105 ( 4.572 -16.732 2.571) 17.535 17.157 ( 5.480 -15.461 -2.574) 16.604 17.464 ( -3.629 -19.296 3.617) 19.964 17.544 ( -3.532 -18.301 -4.557) 19.188 28.881 ( 0.698 8.803 1.938) 9.041 28.913 ( -0.039 8.063 -1.386) 8.181 29.299 ( -0.088 8.120 2.327) 8.447 29.332 ( -0.885 8.332 -1.077) 8.448 30.719 ( 0.513 9.899 0.468) 9.923 30.737 ( 0.075 8.553 -1.505) 8.685 31.551 ( 0.189 -4.841 1.038) 4.955 31.581 ( -0.492 -4.784 -1.942) 5.186 85.917 ( 0.426 -3.094 0.945) 3.263 85.919 ( 0.395 -2.924 0.669) 3.025 86.911 ( 0.022 -21.971 4.410) 22.410 86.954 ( -0.959 -24.224 0.107) 24.243 ======================= Grid point 452 (153/162) ======================= q-point: ( 0.40 0.31 0.45) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 440 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 4.376 ( 0.633 17.436 4.798) 18.095 4.436 ( -5.349 18.700 -1.190) 19.487 5.117 ( 3.133 0.280 1.763) 3.606 5.140 ( 0.739 -1.561 -0.910) 1.952 5.700 ( 8.391 -2.369 6.521) 10.888 5.818 ( -2.084 -2.676 -4.506) 5.640 7.205 ( 3.493 -9.872 2.869) 10.858 7.312 ( -6.332 -8.284 -7.400) 12.786 7.985 ( 1.941 18.905 7.475) 20.422 8.044 ( -3.539 20.729 3.926) 21.393 8.134 ( -0.758 16.225 -5.530) 17.158 8.146 ( -2.438 12.437 -9.027) 15.560 9.292 ( 18.147 2.986 20.699) 27.689 9.644 ( -2.015 -8.643 7.954) 11.918 9.671 ( 1.871 15.986 -2.794) 16.335 9.989 ( -14.978 4.300 -10.707) 18.907 10.259 ( 0.427 7.079 0.121) 7.093 10.269 ( -1.062 8.130 -0.360) 8.207 10.390 ( 1.866 22.691 -4.664) 23.240 10.445 ( -3.412 19.906 -6.994) 21.374 11.053 ( 8.194 2.071 4.173) 9.426 11.154 ( 7.298 3.885 -6.002) 10.217 11.214 ( -5.132 -5.027 4.572) 8.515 11.320 ( -6.490 -2.916 -5.980) 9.294 13.193 ( 0.404 4.958 1.214) 5.121 13.224 ( -2.492 3.356 -1.439) 4.421 13.263 ( 1.252 10.496 -1.041) 10.621 13.300 ( -2.433 8.341 -3.898) 9.522 14.229 ( 0.895 1.894 5.414) 5.805 14.247 ( -0.883 1.645 4.697) 5.055 14.355 ( 2.001 0.543 -2.646) 3.361 14.390 ( -1.519 -1.099 -5.079) 5.414 17.220 ( 6.687 -18.153 3.562) 19.671 17.284 ( 5.768 -18.115 -1.993) 19.115 17.372 ( -4.399 -17.214 1.938) 17.872 17.445 ( -6.312 -17.260 -4.662) 18.960 28.897 ( 0.817 8.676 0.881) 8.759 28.910 ( -0.393 8.387 -0.396) 8.406 29.300 ( 0.318 8.043 1.364) 8.164 29.313 ( -0.934 8.129 0.080) 8.183 30.730 ( 0.524 9.642 -0.188) 9.658 30.737 ( -0.160 9.124 -0.932) 9.173 31.558 ( 0.462 -4.926 0.092) 4.948 31.569 ( -0.651 -4.900 -1.050) 5.053 85.925 ( 0.312 -2.842 0.869) 2.989 85.926 ( 0.203 -2.802 0.743) 2.906 86.915 ( 0.516 -22.786 3.086) 23.000 86.932 ( -1.103 -23.648 1.431) 23.717 ======================= Grid point 455 (154/162) ======================= q-point: ( 0.00 0.38 0.45) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 267 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 4.537 ( 0.000 2.918 10.656) 11.048 4.763 ( 0.000 0.741 -11.907) 11.930 5.216 ( 0.000 18.910 5.678) 19.744 5.266 ( 0.000 8.419 3.084) 8.966 5.412 ( 0.000 -2.258 -4.600) 5.124 5.499 ( 0.000 -13.402 -11.663) 17.766 7.041 ( 0.000 -7.935 16.424) 18.241 7.329 ( 0.000 -8.615 -12.943) 15.548 8.162 ( 0.000 -1.411 9.459) 9.563 8.217 ( 0.000 -1.550 2.134) 2.638 8.405 ( 0.000 1.271 4.019) 4.215 8.514 ( 0.000 5.142 -6.813) 8.535 8.971 ( 0.000 10.605 0.288) 10.609 9.074 ( 0.000 4.396 -8.585) 9.645 10.091 ( 0.000 0.999 8.548) 8.606 10.187 ( 0.000 -1.623 -1.025) 1.919 10.555 ( 0.000 7.892 5.802) 9.795 10.637 ( 0.000 6.695 0.422) 6.709 10.873 ( 0.000 20.564 -2.962) 20.776 10.880 ( 0.000 6.921 1.319) 7.045 10.975 ( 0.000 18.330 -8.534) 20.219 10.990 ( 0.000 6.944 -8.567) 11.028 11.278 ( 0.000 -1.982 3.749) 4.240 11.364 ( 0.000 -2.158 -4.708) 5.179 13.311 ( 0.000 6.134 4.479) 7.595 13.377 ( 0.000 5.790 -1.997) 6.125 13.437 ( 0.000 7.678 -2.735) 8.150 13.467 ( 0.000 6.776 -5.843) 8.947 14.297 ( 0.000 6.522 7.669) 10.068 14.317 ( 0.000 3.120 4.662) 5.610 14.391 ( 0.000 4.891 -1.987) 5.279 14.422 ( 0.000 3.402 -5.582) 6.537 16.761 ( 0.000 -13.733 2.620) 13.981 16.820 ( 0.000 -13.626 -3.242) 14.006 17.131 ( 0.000 -17.879 4.553) 18.450 17.225 ( 0.000 -17.658 -5.027) 18.359 29.035 ( 0.000 7.693 1.294) 7.801 29.057 ( 0.000 6.746 -0.905) 6.807 29.405 ( 0.000 2.690 2.653) 3.778 29.446 ( 0.000 2.376 -1.502) 2.811 30.908 ( 0.000 9.033 -0.259) 9.036 30.913 ( 0.000 10.180 -0.645) 10.200 31.466 ( 0.000 -3.963 1.714) 4.318 31.503 ( 0.000 -3.944 -2.088) 4.462 85.874 ( 0.000 -0.551 0.671) 0.868 85.878 ( 0.000 -0.692 0.295) 0.752 86.540 ( 0.000 -16.285 2.091) 16.419 86.553 ( 0.000 -17.661 0.806) 17.680 ======================= Grid point 456 (155/162) ======================= q-point: ( 0.20 0.38 0.45) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 441 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 4.568 ( 3.248 5.602 9.363) 11.384 4.773 ( 0.484 4.855 -11.102) 12.126 5.142 ( -4.508 5.784 3.894) 8.303 5.235 ( -4.922 7.758 -4.512) 10.236 5.474 ( 9.368 -1.510 6.303) 11.392 5.657 ( 10.583 -3.633 -11.330) 15.924 6.996 ( -3.784 -10.360 14.374) 18.118 7.260 ( -6.897 -10.807 -12.283) 17.755 8.116 ( -2.451 0.887 7.190) 7.648 8.199 ( -2.854 -1.242 -0.841) 3.224 8.421 ( 1.316 3.757 3.785) 5.494 8.491 ( -1.569 6.313 -3.837) 7.552 9.059 ( 10.325 9.326 7.094) 15.617 9.252 ( 14.528 1.025 -11.019) 18.263 10.029 ( -7.009 2.071 11.170) 13.349 10.180 ( -2.319 -1.755 -3.555) 4.594 10.466 ( -6.479 8.542 4.062) 11.465 10.532 ( -7.225 7.372 -1.267) 10.400 10.855 ( -1.542 16.888 -4.703) 17.598 10.887 ( -2.442 12.963 -5.650) 14.350 10.997 ( 4.909 9.221 0.362) 10.453 11.067 ( 4.940 7.072 -6.364) 10.720 11.268 ( -0.939 0.403 2.919) 3.093 11.355 ( -1.070 -0.997 -5.546) 5.736 13.313 ( 0.201 7.520 3.214) 8.181 13.365 ( -1.296 6.503 -2.246) 7.002 13.433 ( 0.240 8.175 -1.298) 8.281 13.473 ( 0.147 7.248 -4.806) 8.698 14.294 ( -0.278 5.777 7.781) 9.695 14.309 ( -0.712 2.942 5.134) 5.959 14.396 ( 0.404 4.359 -2.652) 5.119 14.417 ( -0.415 3.235 -5.411) 6.317 16.798 ( 3.583 -14.206 3.094) 14.974 16.863 ( 4.112 -14.226 -3.427) 15.200 17.104 ( -2.658 -17.399 4.251) 18.107 17.196 ( -2.852 -17.301 -5.132) 18.270 29.043 ( 0.679 7.728 1.046) 7.828 29.060 ( 0.271 6.947 -0.720) 6.990 29.402 ( -0.281 2.520 2.311) 3.431 29.435 ( -1.049 2.287 -1.056) 2.728 30.914 ( 0.514 9.270 -0.265) 9.288 30.918 ( 0.450 10.201 -0.625) 10.230 31.466 ( 0.048 -4.086 1.338) 4.299 31.496 ( -0.638 -4.048 -1.767) 4.463 85.882 ( 0.720 -0.345 0.625) 1.014 85.885 ( 0.654 -0.458 0.314) 0.858 86.534 ( -0.583 -16.617 1.984) 16.746 86.544 ( -0.817 -17.740 0.937) 17.783 ======================= Grid point 457 (156/162) ======================= q-point: ( 0.40 0.38 0.45) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 441 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 4.659 ( 5.557 10.982 5.144) 13.339 4.753 ( -3.138 12.781 -3.666) 13.661 5.086 ( -0.244 -2.639 -1.098) 2.869 5.135 ( -4.511 0.033 -5.173) 6.864 5.693 ( 10.666 3.067 6.407) 12.815 5.799 ( 1.520 2.065 -3.812) 4.594 6.957 ( 1.779 -15.114 4.496) 15.868 7.084 ( -9.689 -14.846 -7.906) 19.411 8.098 ( 0.576 2.637 3.296) 4.260 8.134 ( -2.954 1.639 -0.282) 3.390 8.445 ( 1.112 6.370 1.929) 6.748 8.466 ( -1.092 6.912 -0.343) 7.007 9.340 ( 16.449 5.354 11.945) 21.022 9.523 ( 6.885 -0.571 -2.736) 7.431 9.847 ( -5.419 3.442 6.033) 8.810 10.016 ( -13.578 -0.902 -6.943) 15.277 10.407 ( 0.397 8.250 -0.112) 8.261 10.437 ( -2.552 8.398 -2.830) 9.222 10.824 ( -0.955 14.246 -4.463) 14.960 10.834 ( -2.036 12.760 -4.668) 13.739 11.094 ( 4.180 5.052 1.807) 6.801 11.136 ( 0.764 2.075 -1.209) 2.520 11.263 ( 1.437 4.978 -2.345) 5.687 11.316 ( -2.867 2.168 -6.152) 7.126 13.320 ( 0.536 9.206 1.098) 9.287 13.337 ( -1.244 8.615 -0.853) 8.746 13.448 ( 1.014 8.335 -1.106) 8.469 13.466 ( -0.759 8.091 -2.820) 8.602 14.290 ( -0.003 4.286 7.377) 8.531 14.296 ( -0.550 3.152 6.260) 7.030 14.403 ( 0.313 3.299 -3.828) 5.063 14.409 ( -0.371 3.035 -4.787) 5.680 16.887 ( 5.035 -15.426 3.811) 16.669 16.945 ( 1.824 -15.984 -0.505) 16.095 17.051 ( -0.674 -15.799 0.316) 15.816 17.118 ( -4.851 -16.297 -5.017) 17.728 29.057 ( 0.630 7.708 0.439) 7.747 29.064 ( -0.004 7.399 -0.226) 7.402 29.399 ( 0.198 2.207 1.362) 2.601 29.412 ( -1.056 2.132 0.071) 2.381 30.924 ( 0.395 9.772 -0.347) 9.786 30.926 ( 0.207 10.135 -0.513) 10.150 31.470 ( 0.398 -4.274 0.340) 4.306 31.481 ( -0.771 -4.245 -0.865) 4.400 85.896 ( 0.500 0.009 0.507) 0.713 85.897 ( 0.384 -0.034 0.385) 0.545 86.524 ( -0.255 -17.327 1.684) 17.410 86.528 ( -0.646 -17.761 1.279) 17.819 ======================= Grid point 460 (157/162) ======================= q-point: ( 0.00 0.44 0.45) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 264 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 4.604 ( 0.000 4.420 4.618) 6.393 4.760 ( 0.000 -0.991 -10.708) 10.754 5.198 ( 0.000 -6.753 0.075) 6.754 5.237 ( 0.000 -11.078 -4.568) 11.983 5.564 ( 0.000 14.135 -0.180) 14.137 5.587 ( 0.000 11.122 -2.568) 11.415 6.902 ( 0.000 -5.150 12.631) 13.641 7.107 ( 0.000 -12.977 -7.918) 15.202 8.128 ( 0.000 -0.356 5.764) 5.775 8.175 ( 0.000 -2.115 0.754) 2.245 8.389 ( 0.000 -1.387 3.677) 3.930 8.475 ( 0.000 -5.032 -4.822) 6.970 9.154 ( 0.000 6.756 -1.798) 6.991 9.196 ( 0.000 4.828 -5.638) 7.423 10.127 ( 0.000 2.098 4.648) 5.100 10.167 ( 0.000 -0.476 0.773) 0.908 10.670 ( 0.000 4.125 4.309) 5.965 10.713 ( 0.000 1.935 0.646) 2.040 10.949 ( 0.000 2.198 2.746) 3.517 10.998 ( 0.000 0.294 -1.864) 1.887 11.218 ( 0.000 6.956 -3.045) 7.594 11.253 ( 0.000 7.532 -7.247) 10.452 11.304 ( 0.000 5.260 -3.634) 6.394 11.346 ( 0.000 0.789 -5.743) 5.797 13.471 ( 0.000 7.469 0.425) 7.481 13.490 ( 0.000 4.744 -1.811) 5.078 13.564 ( 0.000 5.888 -0.804) 5.943 13.597 ( 0.000 5.859 -3.741) 6.951 14.374 ( 0.000 2.978 3.994) 4.982 14.430 ( 0.000 0.790 -1.230) 1.462 14.464 ( 0.000 9.163 6.724) 11.366 14.549 ( 0.000 6.263 -2.200) 6.639 16.546 ( 0.000 -7.648 1.732) 7.842 16.587 ( 0.000 -9.485 -2.411) 9.786 16.828 ( 0.000 -11.998 3.577) 12.520 16.905 ( 0.000 -14.230 -4.266) 14.855 29.170 ( 0.000 5.812 0.536) 5.837 29.174 ( 0.000 5.119 0.063) 5.119 29.418 ( 0.000 -0.805 1.771) 1.945 29.447 ( 0.000 -1.745 -1.165) 2.098 31.075 ( 0.000 7.722 0.645) 7.749 31.096 ( 0.000 8.006 -1.336) 8.117 31.391 ( 0.000 -3.683 1.745) 4.076 31.425 ( 0.000 -4.193 -1.731) 4.536 85.887 ( 0.000 1.490 0.401) 1.542 85.888 ( 0.000 1.685 0.361) 1.723 86.276 ( 0.000 -10.499 0.935) 10.540 86.280 ( 0.000 -10.199 0.614) 10.217 ======================= Grid point 461 (158/162) ======================= q-point: ( 0.20 0.44 0.45) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 440 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 4.662 ( 5.709 4.751 4.033) 8.451 4.806 ( 4.496 -0.468 -10.270) 11.221 5.158 ( -4.482 -2.855 0.488) 5.336 5.210 ( -3.315 -6.612 -5.202) 9.043 5.630 ( 8.078 12.415 3.261) 15.167 5.713 ( 11.177 7.344 -5.186) 14.344 6.807 ( -8.868 -7.649 11.562) 16.457 7.001 ( -10.293 -14.501 -7.972) 19.488 8.136 ( 0.928 1.767 4.979) 5.364 8.185 ( 0.597 0.117 0.022) 0.609 8.398 ( 0.833 -3.236 4.137) 5.318 8.465 ( -0.898 -5.282 -2.621) 5.965 9.240 ( 8.925 7.274 0.733) 11.537 9.315 ( 11.163 3.011 -6.611) 13.319 10.075 ( -6.199 2.482 6.688) 9.451 10.150 ( -3.487 -1.431 -0.658) 3.826 10.598 ( -4.965 5.260 2.932) 7.805 10.638 ( -4.809 3.620 -0.805) 6.073 10.938 ( -2.385 -0.228 0.181) 2.403 10.951 ( -4.226 -1.301 -1.287) 4.605 11.238 ( 1.888 8.330 -3.480) 9.223 11.265 ( 1.328 7.176 -6.284) 9.630 11.320 ( 1.321 4.527 -2.614) 5.392 11.364 ( 1.060 1.720 -5.959) 6.293 13.487 ( 1.428 7.496 0.054) 7.631 13.501 ( 1.161 5.965 -1.741) 6.322 13.570 ( 0.564 6.382 -0.157) 6.409 13.605 ( 0.440 5.843 -3.435) 6.792 14.367 ( -0.422 3.157 4.538) 5.544 14.417 ( -1.008 3.226 2.489) 4.197 14.458 ( -0.591 6.050 3.049) 6.800 14.532 ( -1.631 5.534 -2.163) 6.161 16.575 ( 2.828 -7.909 2.062) 8.649 16.622 ( 3.300 -9.769 -2.670) 10.651 16.808 ( -1.931 -11.751 3.301) 12.358 16.883 ( -2.188 -13.925 -4.300) 14.737 29.180 ( 0.902 6.059 0.413) 6.140 29.183 ( 0.788 5.498 0.085) 5.555 29.409 ( -0.798 -1.235 1.587) 2.163 29.433 ( -1.292 -1.946 -0.862) 2.489 31.086 ( 0.988 8.036 0.546) 8.114 31.104 ( 0.701 8.354 -1.184) 8.466 31.386 ( -0.364 -4.104 1.438) 4.364 31.415 ( -0.921 -4.425 -1.494) 4.761 85.901 ( 1.306 2.051 0.423) 2.468 85.903 ( 1.336 2.144 0.301) 2.544 86.262 ( -1.299 -10.988 0.936) 11.104 86.265 ( -1.340 -10.721 0.648) 10.824 ======================= Grid point 462 (159/162) ======================= q-point: ( 0.40 0.44 0.45) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 440 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 4.810 ( 8.691 5.370 2.295) 10.471 4.909 ( 3.589 3.124 -7.244) 8.666 5.040 ( -4.980 -1.542 -0.053) 5.213 5.105 ( -6.732 -3.008 -6.391) 9.758 5.850 ( 11.824 12.292 4.662) 17.682 5.930 ( 6.588 10.838 -3.193) 13.079 6.638 ( -4.318 -16.427 5.407) 17.825 6.751 ( -13.042 -18.375 -5.701) 23.243 8.163 ( 1.575 4.317 3.012) 5.495 8.186 ( -0.607 3.948 0.625) 4.043 8.418 ( 1.203 -5.867 3.348) 6.861 8.443 ( -1.283 -6.049 0.757) 6.229 9.483 ( 14.595 7.443 4.411) 16.966 9.577 ( 12.407 3.411 -4.288) 13.563 9.876 ( -11.103 0.729 6.078) 12.679 9.973 ( -13.557 -3.154 -2.737) 14.186 10.566 ( 1.463 7.675 -0.244) 7.817 10.591 ( -0.651 7.169 -2.701) 7.689 10.863 ( -2.990 -4.047 -0.680) 5.078 10.872 ( -3.436 -3.691 -1.688) 5.317 11.277 ( 1.622 8.433 -3.507) 9.277 11.289 ( 0.507 7.926 -4.550) 9.154 11.347 ( 1.441 3.330 -3.453) 5.009 11.370 ( -0.561 2.554 -5.332) 5.938 13.517 ( 1.371 8.575 -0.185) 8.686 13.525 ( 0.741 8.888 -1.113) 8.988 13.583 ( 0.762 5.367 -0.672) 5.462 13.601 ( -0.832 5.408 -2.461) 6.000 14.368 ( 0.748 4.340 5.867) 7.336 14.394 ( -1.483 5.859 6.510) 8.884 14.456 ( 0.880 2.355 -1.373) 2.865 14.491 ( -2.280 3.637 -2.009) 4.740 16.645 ( 3.890 -8.568 2.538) 9.746 16.688 ( 1.573 -9.530 -0.805) 9.692 16.769 ( -0.448 -12.089 0.328) 12.101 16.822 ( -3.791 -13.164 -4.052) 14.285 29.198 ( 0.666 6.558 0.200) 6.594 29.199 ( 0.579 6.446 0.101) 6.472 29.396 ( -0.270 -2.211 0.979) 2.433 29.406 ( -1.220 -2.421 -0.025) 2.711 31.107 ( 0.920 8.742 0.130) 8.791 31.115 ( 0.198 8.948 -0.624) 8.972 31.382 ( 0.139 -4.891 0.491) 4.918 31.394 ( -1.009 -4.927 -0.719) 5.081 85.928 ( 0.990 3.225 0.364) 3.393 85.929 ( 0.918 3.284 0.277) 3.421 86.237 ( -0.889 -12.070 0.900) 12.136 86.238 ( -1.016 -11.940 0.765) 12.008 ======================= Grid point 465 (160/162) ======================= q-point: ( 0.00 -0.50 0.45) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 150 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 4.704 ( 0.000 -4.904 -4.628) 6.743 4.704 ( 0.000 4.904 -4.628) 6.743 5.119 ( 0.000 -0.165 -1.635) 1.643 5.119 ( 0.000 0.165 -1.635) 1.643 5.713 ( 0.000 -0.001 -0.968) 0.968 5.713 ( 0.000 0.001 -0.968) 0.968 6.900 ( 0.000 -6.033 2.381) 6.486 6.900 ( 0.000 6.033 2.381) 6.486 8.143 ( 0.000 -1.296 2.515) 2.829 8.143 ( 0.000 1.296 2.515) 2.829 8.393 ( 0.000 -2.421 -0.558) 2.485 8.393 ( 0.000 2.421 -0.558) 2.485 9.230 ( 0.000 -1.159 -3.781) 3.955 9.230 ( 0.000 1.159 -3.782) 3.955 10.157 ( 0.000 -0.863 2.718) 2.851 10.157 ( 0.000 0.863 2.718) 2.851 10.721 ( 0.000 -1.121 2.424) 2.671 10.721 ( 0.000 1.121 2.424) 2.671 10.983 ( 0.000 -1.360 1.238) 1.840 10.983 ( 0.000 1.360 1.238) 1.840 11.279 ( 0.000 -1.568 -4.514) 4.778 11.279 ( 0.000 1.568 -4.514) 4.778 11.381 ( 0.000 -0.388 -6.305) 6.317 11.381 ( 0.000 0.388 -6.305) 6.317 13.537 ( 0.000 -0.017 -1.865) 1.865 13.537 ( 0.000 0.017 -1.865) 1.865 13.652 ( 0.000 -1.245 -1.159) 1.702 13.652 ( 0.000 1.246 -1.159) 1.702 14.422 ( 0.000 -1.667 1.916) 2.540 14.422 ( 0.000 1.667 1.916) 2.540 14.595 ( 0.000 -2.560 2.380) 3.495 14.595 ( 0.000 2.560 2.380) 3.495 16.480 ( 0.000 -1.054 -0.104) 1.059 16.480 ( 0.000 1.054 -0.104) 1.059 16.725 ( 0.000 -2.545 -0.754) 2.655 16.725 ( 0.000 2.545 -0.754) 2.655 29.235 ( 0.000 -0.113 0.522) 0.534 29.235 ( 0.000 0.113 0.522) 0.534 29.409 ( 0.000 -0.985 0.007) 0.985 29.409 ( 0.000 0.985 0.007) 0.985 31.179 ( 0.000 -1.243 -0.121) 1.249 31.179 ( 0.000 1.243 -0.121) 1.249 31.354 ( 0.000 -1.586 -0.096) 1.589 31.354 ( 0.000 1.586 -0.096) 1.589 85.914 ( 0.000 -0.113 0.460) 0.473 85.914 ( 0.000 0.114 0.460) 0.473 86.167 ( 0.000 -0.252 0.424) 0.493 86.167 ( 0.000 0.252 0.424) 0.493 ======================= Grid point 467 (161/162) ======================= q-point: ( 0.20 -0.50 0.45) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 248 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 4.758 ( 5.270 -4.411 -4.285) 8.099 4.758 ( 5.270 4.411 -4.285) 8.099 5.123 ( -0.875 -1.033 -2.241) 2.619 5.123 ( -0.875 1.034 -2.241) 2.619 5.792 ( 8.980 -2.138 -0.564) 9.248 5.792 ( 8.980 2.138 -0.564) 9.248 6.776 ( -12.167 -5.983 1.804) 13.678 6.776 ( -12.167 5.983 1.804) 13.678 8.177 ( 3.221 -1.681 2.606) 4.471 8.177 ( 3.221 1.681 2.606) 4.471 8.376 ( -1.730 -2.287 0.127) 2.871 8.376 ( -1.730 2.287 0.127) 2.871 9.328 ( 9.708 -1.864 -3.045) 10.344 9.328 ( 9.708 1.864 -3.045) 10.344 10.119 ( -5.323 -1.927 3.066) 6.438 10.119 ( -5.323 1.927 3.066) 6.438 10.664 ( -3.298 -1.183 1.146) 3.686 10.664 ( -3.298 1.183 1.146) 3.686 10.931 ( -5.135 -0.207 -0.340) 5.150 10.931 ( -5.135 0.207 -0.340) 5.150 11.309 ( 2.570 -0.814 -4.029) 4.848 11.309 ( 2.570 0.814 -4.029) 4.848 11.390 ( 0.641 -0.814 -5.761) 5.854 11.390 ( 0.641 0.814 -5.761) 5.854 13.556 ( 1.906 -0.328 -1.692) 2.570 13.556 ( 1.906 0.328 -1.692) 2.570 13.661 ( 0.555 -1.145 -1.164) 1.725 13.661 ( 0.555 1.145 -1.164) 1.725 14.420 ( 0.149 -1.768 2.350) 2.944 14.420 ( 0.149 1.768 2.350) 2.944 14.570 ( -2.469 -2.533 2.483) 4.322 14.570 ( -2.469 2.533 2.483) 4.322 16.509 ( 2.852 -1.350 -0.263) 3.166 16.509 ( 2.852 1.350 -0.263) 3.166 16.707 ( -1.823 -2.504 -0.787) 3.196 16.707 ( -1.823 2.504 -0.787) 3.196 29.251 ( 1.548 -0.199 0.475) 1.632 29.251 ( 1.548 0.199 0.475) 1.632 29.391 ( -1.749 -0.897 0.059) 1.967 29.391 ( -1.749 0.897 0.059) 1.967 31.197 ( 1.755 -1.283 -0.121) 2.177 31.197 ( 1.755 1.283 -0.121) 2.177 31.338 ( -1.550 -1.559 -0.102) 2.201 31.338 ( -1.550 1.559 -0.102) 2.201 85.938 ( 2.390 -0.145 0.456) 2.437 85.938 ( 2.390 0.145 0.456) 2.437 86.142 ( -2.385 -0.248 0.427) 2.436 86.142 ( -2.385 0.248 0.427) 2.436 ======================= Grid point 469 (162/162) ======================= q-point: ( 0.40 -0.50 0.45) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 248 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 4.895 ( 8.160 -3.348 -3.675) 9.555 4.895 ( 8.160 3.348 -3.675) 9.555 5.048 ( -6.614 -2.159 -3.077) 7.607 5.048 ( -6.613 2.160 -3.077) 7.607 6.072 ( 18.569 -4.384 0.074) 19.080 6.072 ( 18.569 4.384 0.074) 19.080 6.458 ( -19.279 -5.565 0.814) 20.082 6.458 ( -19.279 5.565 0.814) 20.082 8.253 ( 4.098 -2.056 2.332) 5.144 8.253 ( 4.098 2.056 2.332) 5.144 8.327 ( -3.275 -2.156 1.394) 4.162 8.327 ( -3.275 2.156 1.394) 4.162 9.588 ( 16.015 -2.725 -0.731) 16.262 9.588 ( 16.015 2.725 -0.731) 16.262 9.909 ( -15.240 -2.864 2.137) 15.654 9.909 ( -15.240 2.864 2.137) 15.654 10.675 ( 4.512 -1.284 -0.926) 4.782 10.675 ( 4.512 1.284 -0.926) 4.782 10.802 ( -7.345 -0.879 -1.493) 7.546 10.802 ( -7.345 0.879 -1.493) 7.546 11.360 ( 2.318 -0.589 -4.099) 4.746 11.360 ( 2.318 0.589 -4.099) 4.746 11.391 ( -0.751 -0.870 -4.847) 4.981 11.391 ( -0.751 0.870 -4.847) 4.981 13.606 ( 2.908 -0.554 -1.420) 3.283 13.606 ( 2.908 0.554 -1.420) 3.283 13.654 ( -1.568 -0.806 -1.273) 2.175 13.654 ( -1.568 0.806 -1.273) 2.175 14.443 ( 2.380 -2.122 2.922) 4.325 14.443 ( 2.380 2.122 2.922) 4.325 14.507 ( -3.665 -2.425 2.811) 5.216 14.507 ( -3.665 2.425 2.810) 5.216 16.580 ( 4.029 -1.893 -0.580) 4.489 16.580 ( 4.029 1.893 -0.580) 4.489 16.655 ( -3.404 -2.313 -0.779) 4.188 16.655 ( -3.404 2.313 -0.779) 4.188 29.292 ( 2.591 -0.410 0.352) 2.647 29.292 ( 2.591 0.410 0.352) 2.647 29.346 ( -2.714 -0.674 0.193) 2.803 29.346 ( -2.714 0.674 0.193) 2.803 31.243 ( 2.721 -1.378 -0.120) 3.053 31.243 ( 2.721 1.378 -0.120) 3.053 31.297 ( -2.596 -1.483 -0.112) 2.992 31.297 ( -2.596 1.483 -0.112) 2.992 86.001 ( 3.865 -0.197 0.446) 3.895 86.001 ( 3.865 0.197 0.446) 3.895 86.079 ( -3.862 -0.232 0.435) 3.893 86.079 ( -3.862 0.232 0.435) 3.893 =================== 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 3/42240 10.0 13846.318 15100.410 27737.238 0.000 0.000 0.000 3/42240 20.0 4298.850 4198.069 4686.980 0.000 0.000 0.000 3/42240 30.0 1555.800 1950.080 1566.236 0.000 0.000 0.000 3/42240 40.0 716.761 1039.864 700.357 0.000 0.000 0.000 3/42240 50.0 392.555 614.439 375.174 0.000 0.000 0.000 3/42240 60.0 241.746 395.867 227.571 0.000 0.000 0.000 3/42240 70.0 162.120 273.881 151.018 0.000 0.000 0.000 3/42240 80.0 116.017 200.721 107.250 0.000 0.000 0.000 3/42240 90.0 87.359 154.082 80.296 0.000 0.000 0.000 3/42240 100.0 68.503 122.787 62.691 0.000 0.000 0.000 3/42240 110.0 55.505 100.867 50.628 0.000 0.000 0.000 3/42240 120.0 46.189 84.944 42.028 0.000 0.000 0.000 3/42240 130.0 39.290 73.014 35.687 0.000 0.000 0.000 3/42240 140.0 34.034 63.834 30.875 0.000 0.000 0.000 3/42240 150.0 29.933 56.606 27.132 0.000 0.000 0.000 3/42240 160.0 26.664 50.798 24.157 0.000 0.000 0.000 3/42240 170.0 24.010 46.050 21.747 0.000 0.000 0.000 3/42240 180.0 21.821 42.108 19.763 0.000 0.000 0.000 3/42240 190.0 19.989 38.789 18.106 0.000 0.000 0.000 3/42240 200.0 18.438 35.962 16.703 0.000 0.000 0.000 3/42240 210.0 17.108 33.527 15.502 0.000 0.000 0.000 3/42240 220.0 15.957 31.410 14.463 0.000 0.000 0.000 3/42240 230.0 14.953 29.554 13.556 0.000 0.000 0.000 3/42240 240.0 14.069 27.913 12.759 0.000 0.000 0.000 3/42240 250.0 13.285 26.453 12.052 0.000 0.000 0.000 3/42240 260.0 12.586 25.146 11.421 0.000 0.000 0.000 3/42240 270.0 11.958 23.968 10.855 0.000 0.000 0.000 3/42240 280.0 11.392 22.902 10.344 0.000 0.000 0.000 3/42240 290.0 10.879 21.932 9.880 0.000 0.000 0.000 3/42240 300.0 10.411 21.045 9.458 0.000 0.000 0.000 3/42240 310.0 9.983 20.232 9.071 0.000 0.000 0.000 3/42240 320.0 9.590 19.483 8.717 0.000 0.000 0.000 3/42240 330.0 9.228 18.791 8.389 0.000 0.000 0.000 3/42240 340.0 8.894 18.150 8.087 0.000 0.000 0.000 3/42240 350.0 8.583 17.553 7.806 0.000 0.000 0.000 3/42240 360.0 8.295 16.997 7.546 0.000 0.000 0.000 3/42240 370.0 8.026 16.478 7.302 0.000 0.000 0.000 3/42240 380.0 7.775 15.991 7.075 0.000 0.000 0.000 3/42240 390.0 7.539 15.534 6.862 0.000 0.000 0.000 3/42240 400.0 7.318 15.104 6.662 0.000 0.000 0.000 3/42240 410.0 7.110 14.698 6.473 0.000 0.000 0.000 3/42240 420.0 6.914 14.315 6.296 0.000 0.000 0.000 3/42240 430.0 6.730 13.953 6.128 0.000 0.000 0.000 3/42240 440.0 6.555 13.610 5.970 0.000 0.000 0.000 3/42240 450.0 6.389 13.284 5.820 0.000 0.000 0.000 3/42240 460.0 6.232 12.974 5.678 0.000 0.000 0.000 3/42240 470.0 6.083 12.679 5.542 0.000 0.000 0.000 3/42240 480.0 5.941 12.398 5.414 0.000 0.000 0.000 3/42240 490.0 5.805 12.130 5.291 0.000 0.000 0.000 3/42240 500.0 5.676 11.874 5.174 0.000 0.000 0.000 3/42240 510.0 5.553 11.629 5.063 0.000 0.000 0.000 3/42240 520.0 5.436 11.395 4.956 0.000 0.000 0.000 3/42240 530.0 5.323 11.170 4.854 0.000 0.000 0.000 3/42240 540.0 5.215 10.955 4.756 0.000 0.000 0.000 3/42240 550.0 5.112 10.748 4.663 0.000 0.000 0.000 3/42240 560.0 5.012 10.549 4.573 0.000 0.000 0.000 3/42240 570.0 4.917 10.358 4.487 0.000 0.000 0.000 3/42240 580.0 4.825 10.174 4.404 0.000 0.000 0.000 3/42240 590.0 4.737 9.997 4.324 0.000 0.000 0.000 3/42240 600.0 4.652 9.826 4.247 0.000 0.000 0.000 3/42240 610.0 4.571 9.661 4.173 0.000 0.000 0.000 3/42240 620.0 4.492 9.502 4.102 0.000 0.000 0.000 3/42240 630.0 4.416 9.349 4.033 0.000 0.000 0.000 3/42240 640.0 4.342 9.200 3.967 0.000 0.000 0.000 3/42240 650.0 4.271 9.057 3.903 0.000 0.000 0.000 3/42240 660.0 4.203 8.918 3.841 0.000 0.000 0.000 3/42240 670.0 4.136 8.783 3.781 0.000 0.000 0.000 3/42240 680.0 4.072 8.653 3.723 0.000 0.000 0.000 3/42240 690.0 4.010 8.527 3.667 0.000 0.000 0.000 3/42240 700.0 3.950 8.405 3.612 0.000 0.000 0.000 3/42240 710.0 3.891 8.286 3.560 0.000 0.000 0.000 3/42240 720.0 3.835 8.171 3.509 0.000 0.000 0.000 3/42240 730.0 3.780 8.059 3.459 0.000 0.000 0.000 3/42240 740.0 3.726 7.950 3.411 0.000 0.000 0.000 3/42240 750.0 3.674 7.844 3.364 0.000 0.000 0.000 3/42240 760.0 3.624 7.742 3.319 0.000 0.000 0.000 3/42240 770.0 3.575 7.642 3.275 0.000 0.000 0.000 3/42240 780.0 3.527 7.544 3.232 0.000 0.000 0.000 3/42240 790.0 3.481 7.450 3.190 0.000 0.000 0.000 3/42240 800.0 3.436 7.358 3.150 0.000 0.000 0.000 3/42240 810.0 3.392 7.268 3.110 0.000 0.000 0.000 3/42240 820.0 3.349 7.180 3.072 0.000 0.000 0.000 3/42240 830.0 3.307 7.095 3.034 0.000 0.000 0.000 3/42240 840.0 3.267 7.012 2.998 0.000 0.000 0.000 3/42240 850.0 3.227 6.931 2.962 0.000 0.000 0.000 3/42240 860.0 3.189 6.851 2.928 0.000 0.000 0.000 3/42240 870.0 3.151 6.774 2.894 0.000 0.000 0.000 3/42240 880.0 3.114 6.699 2.861 0.000 0.000 0.000 3/42240 890.0 3.078 6.625 2.829 0.000 0.000 0.000 3/42240 900.0 3.043 6.553 2.797 0.000 0.000 0.000 3/42240 910.0 3.009 6.483 2.766 0.000 0.000 0.000 3/42240 920.0 2.975 6.414 2.736 0.000 0.000 0.000 3/42240 930.0 2.942 6.346 2.707 0.000 0.000 0.000 3/42240 940.0 2.910 6.281 2.678 0.000 0.000 0.000 3/42240 950.0 2.879 6.216 2.650 0.000 0.000 0.000 3/42240 960.0 2.849 6.153 2.623 0.000 0.000 0.000 3/42240 970.0 2.819 6.092 2.596 0.000 0.000 0.000 3/42240 980.0 2.789 6.031 2.570 0.000 0.000 0.000 3/42240 990.0 2.760 5.972 2.544 0.000 0.000 0.000 3/42240 1000.0 2.732 5.914 2.519 0.000 0.000 0.000 3/42240 Thermal conductivity related properties were written into "kappa-m51611.hdf5". Summary of calculation was written in "phono3py.yaml". -------------------------[time 2026-01-08 20:35:10]------------------------- _ ___ _ __ __| | / _ \ '_ \ / _` | | __/ | | | (_| | \___|_| |_|\__,_|