----------------------------- ------- calculate fc2 ------- ----------------------------- _ _ __ | |__ ___ _ __ ___ _ __ _ _ | '_ \| '_ \ / _ \| '_ \ / _ \ | '_ \| | | | | |_) | | | | (_) | | | | (_) || |_) | |_| | | .__/|_| |_|\___/|_| |_|\___(_) .__/ \__, | |_| |_| |___/ 2.47.1 -------------------------[time 2026-01-08 05:35:33]------------------------- 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: [3 1 1] Primitive matrix: [ 1. 0. -0.] [0. 1. 0.] [0. 0. 1.] Spacegroup: P2_1/c (14) Number of symmetry operations in supercell: 12 ------------------------------ primitive cell ------------------------------ Lattice vectors: a 3.120968040022496 0.000000000000000 0.000000000000000 b 0.000000000000000 10.376370840000000 0.000000000000000 c -1.317559086450700 0.000000000000000 12.532975707451744 Atomic positions (fractional): *1 H 0.88270026404960 0.75337900100088 0.66212853961782 1.008 2 H 0.11729973595040 0.25337900100088 0.83787146038218 1.008 3 H 0.11729973595040 0.24662099899912 0.33787146038218 1.008 4 H 0.88270026404960 0.74662099899912 0.16212853961782 1.008 *5 H 0.30771161651133 0.87950093464943 0.80852720392042 1.008 6 H 0.69228838348866 0.37950093464943 0.69147279607958 1.008 7 H 0.69228838348866 0.12049906535058 0.19147279607958 1.008 8 H 0.30771161651133 0.62049906535057 0.30852720392042 1.008 *9 B 0.23490139404508 0.83159515903184 0.36113048015482 10.811 10 B 0.76509860595492 0.33159515903184 0.13886951984518 10.811 11 B 0.76509860595492 0.16840484096816 0.63886951984518 10.811 12 B 0.23490139404508 0.66840484096816 0.86113048015482 10.811 *13 B 0.37227735167823 0.95287148908310 0.19293832180928 10.811 14 B 0.62772264832177 0.45287148908310 0.30706167819072 10.811 15 B 0.62772264832177 0.04712851091690 0.80706167819072 10.811 16 B 0.37227735167823 0.54712851091690 0.69293832180928 10.811 *17 O 0.22025663538136 0.93744095278599 0.42412126801838 15.999 18 O 0.77974336461864 0.43744095278599 0.07587873198162 15.999 19 O 0.77974336461864 0.06255904721401 0.57587873198162 15.999 20 O 0.22025663538136 0.56255904721401 0.92412126801838 15.999 *21 O 0.22377572956726 0.70653358449632 0.39724588766958 15.999 22 O 0.77622427043274 0.20653358449632 0.10275411233042 15.999 23 O 0.77622427043274 0.29346641550368 0.60275411233042 15.999 24 O 0.22377572956726 0.79346641550368 0.89724588766958 15.999 *25 O 0.26133436961803 0.84555162557869 0.25065629040593 15.999 26 O 0.73866563038197 0.34555162557869 0.24934370959407 15.999 27 O 0.73866563038197 0.15444837442131 0.74934370959407 15.999 28 O 0.26133436961803 0.65444837442131 0.75065629040593 15.999 *29 O 0.39382516950602 0.55079712798259 0.25355825668977 15.999 30 O 0.60617483049397 0.05079712798259 0.24644174331023 15.999 31 O 0.60617483049397 0.44920287201741 0.74644174331022 15.999 32 O 0.39382516950602 0.94920287201741 0.75355825668978 15.999 *33 O 0.28007911893248 0.95661667198820 0.08472308250908 15.999 34 O 0.71992088106752 0.45661667198820 0.41527691749092 15.999 35 O 0.71992088106752 0.04338332801180 0.91527691749092 15.999 36 O 0.28007911893248 0.54338332801180 0.58472308250908 15.999 *37 O 0.79866312865581 0.70664195043336 0.09198480018065 15.999 38 O 0.20133687134419 0.20664195043336 0.40801519981935 15.999 39 O 0.20133687134419 0.29335804956664 0.90801519981935 15.999 40 O 0.79866312865581 0.79335804956664 0.59198480018065 15.999 *41 Mg 0.29569900027483 0.92030284202953 0.58866095180894 24.305 42 Mg 0.70430099972517 0.42030284202953 0.91133904819106 24.305 43 Mg 0.70430099972517 0.07969715797047 0.41133904819106 24.305 44 Mg 0.29569900027483 0.57969715797047 0.08866095180894 24.305 *45 Mg 0.76225325969967 0.63656840031764 0.49564739191111 24.305 46 Mg 0.23774674030033 0.13656840031764 0.00435260808889 24.305 47 Mg 0.23774674030033 0.36343159968236 0.50435260808889 24.305 48 Mg 0.76225325969967 0.86343159968236 0.99564739191111 24.305 -------------------------------- unit cell --------------------------------- Lattice vectors: a 3.120968040022496 0.000000000000000 0.000000000000000 b 0.000000000000000 10.376370840000000 0.000000000000000 c -1.317559086450700 0.000000000000000 12.532975707451744 Atomic positions (fractional): *1 H 0.88270026404960 0.75337900100088 0.66212853961782 1.008 > 1 2 H 0.11729973595040 0.25337900100088 0.83787146038218 1.008 > 2 3 H 0.11729973595040 0.24662099899912 0.33787146038218 1.008 > 3 4 H 0.88270026404960 0.74662099899912 0.16212853961782 1.008 > 4 *5 H 0.30771161651133 0.87950093464943 0.80852720392042 1.008 > 5 6 H 0.69228838348866 0.37950093464943 0.69147279607958 1.008 > 6 7 H 0.69228838348866 0.12049906535058 0.19147279607958 1.008 > 7 8 H 0.30771161651133 0.62049906535057 0.30852720392042 1.008 > 8 *9 B 0.23490139404508 0.83159515903184 0.36113048015482 10.811 > 9 10 B 0.76509860595492 0.33159515903184 0.13886951984518 10.811 > 10 11 B 0.76509860595492 0.16840484096816 0.63886951984518 10.811 > 11 12 B 0.23490139404508 0.66840484096816 0.86113048015482 10.811 > 12 *13 B 0.37227735167823 0.95287148908310 0.19293832180928 10.811 > 13 14 B 0.62772264832177 0.45287148908310 0.30706167819072 10.811 > 14 15 B 0.62772264832177 0.04712851091690 0.80706167819072 10.811 > 15 16 B 0.37227735167823 0.54712851091690 0.69293832180928 10.811 > 16 *17 O 0.22025663538136 0.93744095278599 0.42412126801838 15.999 > 17 18 O 0.77974336461864 0.43744095278599 0.07587873198162 15.999 > 18 19 O 0.77974336461864 0.06255904721401 0.57587873198162 15.999 > 19 20 O 0.22025663538136 0.56255904721401 0.92412126801838 15.999 > 20 *21 O 0.22377572956726 0.70653358449632 0.39724588766958 15.999 > 21 22 O 0.77622427043274 0.20653358449632 0.10275411233042 15.999 > 22 23 O 0.77622427043274 0.29346641550368 0.60275411233042 15.999 > 23 24 O 0.22377572956726 0.79346641550368 0.89724588766958 15.999 > 24 *25 O 0.26133436961803 0.84555162557869 0.25065629040593 15.999 > 25 26 O 0.73866563038197 0.34555162557869 0.24934370959407 15.999 > 26 27 O 0.73866563038197 0.15444837442131 0.74934370959407 15.999 > 27 28 O 0.26133436961803 0.65444837442131 0.75065629040593 15.999 > 28 *29 O 0.39382516950602 0.55079712798259 0.25355825668977 15.999 > 29 30 O 0.60617483049398 0.05079712798259 0.24644174331023 15.999 > 30 31 O 0.60617483049398 0.44920287201741 0.74644174331022 15.999 > 31 32 O 0.39382516950602 0.94920287201741 0.75355825668978 15.999 > 32 *33 O 0.28007911893248 0.95661667198820 0.08472308250908 15.999 > 33 34 O 0.71992088106752 0.45661667198820 0.41527691749092 15.999 > 34 35 O 0.71992088106752 0.04338332801180 0.91527691749092 15.999 > 35 36 O 0.28007911893248 0.54338332801180 0.58472308250908 15.999 > 36 *37 O 0.79866312865581 0.70664195043336 0.09198480018065 15.999 > 37 38 O 0.20133687134419 0.20664195043336 0.40801519981935 15.999 > 38 39 O 0.20133687134419 0.29335804956664 0.90801519981935 15.999 > 39 40 O 0.79866312865581 0.79335804956664 0.59198480018065 15.999 > 40 *41 Mg 0.29569900027483 0.92030284202953 0.58866095180894 24.305 > 41 42 Mg 0.70430099972517 0.42030284202953 0.91133904819106 24.305 > 42 43 Mg 0.70430099972517 0.07969715797047 0.41133904819106 24.305 > 43 44 Mg 0.29569900027483 0.57969715797047 0.08866095180894 24.305 > 44 *45 Mg 0.76225325969967 0.63656840031764 0.49564739191111 24.305 > 45 46 Mg 0.23774674030033 0.13656840031764 0.00435260808889 24.305 > 46 47 Mg 0.23774674030033 0.36343159968236 0.50435260808889 24.305 > 47 48 Mg 0.76225325969967 0.86343159968236 0.99564739191111 24.305 > 48 -------------------------------- super cell -------------------------------- Lattice vectors: a 9.362904120067487 0.000000000000000 0.000000000000000 b 0.000000000000000 10.376370840000000 0.000000000000000 c -1.317559086450700 0.000000000000000 12.532975707451744 Atomic positions (fractional): *1 H 0.29423342134987 0.75337900100088 0.66212853961782 1.008 > 1 2 H 0.62756675468320 0.75337900100088 0.66212853961782 1.008 > 1 3 H 0.96090008801653 0.75337900100088 0.66212853961782 1.008 > 1 4 H 0.03909991198347 0.25337900100088 0.83787146038218 1.008 > 2 5 H 0.37243324531680 0.25337900100088 0.83787146038218 1.008 > 2 6 H 0.70576657865013 0.25337900100088 0.83787146038218 1.008 > 2 7 H 0.03909991198347 0.24662099899912 0.33787146038218 1.008 > 3 8 H 0.37243324531680 0.24662099899912 0.33787146038218 1.008 > 3 9 H 0.70576657865013 0.24662099899912 0.33787146038218 1.008 > 3 10 H 0.29423342134987 0.74662099899912 0.16212853961782 1.008 > 4 11 H 0.62756675468320 0.74662099899912 0.16212853961782 1.008 > 4 12 H 0.96090008801653 0.74662099899912 0.16212853961782 1.008 > 4 *13 H 0.10257053883711 0.87950093464943 0.80852720392042 1.008 > 5 14 H 0.43590387217044 0.87950093464943 0.80852720392042 1.008 > 5 15 H 0.76923720550378 0.87950093464943 0.80852720392042 1.008 > 5 16 H 0.23076279449622 0.37950093464943 0.69147279607958 1.008 > 6 17 H 0.56409612782955 0.37950093464943 0.69147279607958 1.008 > 6 18 H 0.89742946116289 0.37950093464943 0.69147279607958 1.008 > 6 19 H 0.23076279449622 0.12049906535058 0.19147279607958 1.008 > 7 20 H 0.56409612782955 0.12049906535058 0.19147279607958 1.008 > 7 21 H 0.89742946116289 0.12049906535058 0.19147279607958 1.008 > 7 22 H 0.10257053883711 0.62049906535057 0.30852720392042 1.008 > 8 23 H 0.43590387217044 0.62049906535057 0.30852720392042 1.008 > 8 24 H 0.76923720550378 0.62049906535057 0.30852720392042 1.008 > 8 *25 B 0.07830046468169 0.83159515903184 0.36113048015482 10.811 > 9 26 B 0.41163379801503 0.83159515903184 0.36113048015482 10.811 > 9 27 B 0.74496713134836 0.83159515903184 0.36113048015482 10.811 > 9 28 B 0.25503286865164 0.33159515903184 0.13886951984518 10.811 > 10 29 B 0.58836620198497 0.33159515903184 0.13886951984518 10.811 > 10 30 B 0.92169953531831 0.33159515903184 0.13886951984518 10.811 > 10 31 B 0.25503286865164 0.16840484096816 0.63886951984518 10.811 > 11 32 B 0.58836620198497 0.16840484096816 0.63886951984518 10.811 > 11 33 B 0.92169953531831 0.16840484096816 0.63886951984518 10.811 > 11 34 B 0.07830046468169 0.66840484096816 0.86113048015482 10.811 > 12 35 B 0.41163379801503 0.66840484096816 0.86113048015482 10.811 > 12 36 B 0.74496713134836 0.66840484096816 0.86113048015482 10.811 > 12 *37 B 0.12409245055941 0.95287148908310 0.19293832180928 10.811 > 13 38 B 0.45742578389274 0.95287148908310 0.19293832180928 10.811 > 13 39 B 0.79075911722608 0.95287148908310 0.19293832180928 10.811 > 13 40 B 0.20924088277392 0.45287148908310 0.30706167819072 10.811 > 14 41 B 0.54257421610726 0.45287148908310 0.30706167819072 10.811 > 14 42 B 0.87590754944059 0.45287148908310 0.30706167819072 10.811 > 14 43 B 0.20924088277392 0.04712851091690 0.80706167819072 10.811 > 15 44 B 0.54257421610726 0.04712851091690 0.80706167819072 10.811 > 15 45 B 0.87590754944059 0.04712851091690 0.80706167819072 10.811 > 15 46 B 0.12409245055941 0.54712851091690 0.69293832180928 10.811 > 16 47 B 0.45742578389274 0.54712851091690 0.69293832180928 10.811 > 16 48 B 0.79075911722608 0.54712851091690 0.69293832180928 10.811 > 16 *49 O 0.07341887846045 0.93744095278599 0.42412126801838 15.999 > 17 50 O 0.40675221179379 0.93744095278599 0.42412126801838 15.999 > 17 51 O 0.74008554512712 0.93744095278599 0.42412126801838 15.999 > 17 52 O 0.25991445487288 0.43744095278599 0.07587873198162 15.999 > 18 53 O 0.59324778820621 0.43744095278599 0.07587873198162 15.999 > 18 54 O 0.92658112153955 0.43744095278599 0.07587873198162 15.999 > 18 55 O 0.25991445487288 0.06255904721401 0.57587873198162 15.999 > 19 56 O 0.59324778820621 0.06255904721401 0.57587873198162 15.999 > 19 57 O 0.92658112153955 0.06255904721401 0.57587873198162 15.999 > 19 58 O 0.07341887846045 0.56255904721401 0.92412126801838 15.999 > 20 59 O 0.40675221179379 0.56255904721401 0.92412126801838 15.999 > 20 60 O 0.74008554512712 0.56255904721401 0.92412126801838 15.999 > 20 *61 O 0.07459190985575 0.70653358449632 0.39724588766958 15.999 > 21 62 O 0.40792524318909 0.70653358449632 0.39724588766958 15.999 > 21 63 O 0.74125857652242 0.70653358449632 0.39724588766958 15.999 > 21 64 O 0.25874142347758 0.20653358449632 0.10275411233042 15.999 > 22 65 O 0.59207475681091 0.20653358449632 0.10275411233042 15.999 > 22 66 O 0.92540809014425 0.20653358449632 0.10275411233042 15.999 > 22 67 O 0.25874142347758 0.29346641550368 0.60275411233042 15.999 > 23 68 O 0.59207475681091 0.29346641550368 0.60275411233042 15.999 > 23 69 O 0.92540809014425 0.29346641550368 0.60275411233042 15.999 > 23 70 O 0.07459190985575 0.79346641550368 0.89724588766958 15.999 > 24 71 O 0.40792524318909 0.79346641550368 0.89724588766958 15.999 > 24 72 O 0.74125857652242 0.79346641550368 0.89724588766958 15.999 > 24 *73 O 0.08711145653934 0.84555162557869 0.25065629040593 15.999 > 25 74 O 0.42044478987268 0.84555162557869 0.25065629040593 15.999 > 25 75 O 0.75377812320601 0.84555162557869 0.25065629040593 15.999 > 25 76 O 0.24622187679399 0.34555162557869 0.24934370959407 15.999 > 26 77 O 0.57955521012732 0.34555162557869 0.24934370959407 15.999 > 26 78 O 0.91288854346066 0.34555162557869 0.24934370959407 15.999 > 26 79 O 0.24622187679399 0.15444837442131 0.74934370959407 15.999 > 27 80 O 0.57955521012732 0.15444837442131 0.74934370959407 15.999 > 27 81 O 0.91288854346066 0.15444837442131 0.74934370959407 15.999 > 27 82 O 0.08711145653934 0.65444837442131 0.75065629040593 15.999 > 28 83 O 0.42044478987268 0.65444837442131 0.75065629040593 15.999 > 28 84 O 0.75377812320601 0.65444837442131 0.75065629040593 15.999 > 28 *85 O 0.13127505650201 0.55079712798259 0.25355825668977 15.999 > 29 86 O 0.46460838983534 0.55079712798259 0.25355825668977 15.999 > 29 87 O 0.79794172316867 0.55079712798259 0.25355825668977 15.999 > 29 88 O 0.20205827683132 0.05079712798259 0.24644174331023 15.999 > 30 89 O 0.53539161016466 0.05079712798259 0.24644174331023 15.999 > 30 90 O 0.86872494349799 0.05079712798259 0.24644174331023 15.999 > 30 91 O 0.20205827683132 0.44920287201741 0.74644174331022 15.999 > 31 92 O 0.53539161016466 0.44920287201741 0.74644174331022 15.999 > 31 93 O 0.86872494349799 0.44920287201741 0.74644174331022 15.999 > 31 94 O 0.13127505650201 0.94920287201741 0.75355825668978 15.999 > 32 95 O 0.46460838983534 0.94920287201741 0.75355825668978 15.999 > 32 96 O 0.79794172316867 0.94920287201741 0.75355825668978 15.999 > 32 *97 O 0.09335970631083 0.95661667198820 0.08472308250908 15.999 > 33 98 O 0.42669303964416 0.95661667198820 0.08472308250908 15.999 > 33 99 O 0.76002637297749 0.95661667198820 0.08472308250908 15.999 > 33 100 O 0.23997362702251 0.45661667198820 0.41527691749092 15.999 > 34 101 O 0.57330696035584 0.45661667198820 0.41527691749092 15.999 > 34 102 O 0.90664029368917 0.45661667198820 0.41527691749092 15.999 > 34 103 O 0.23997362702251 0.04338332801180 0.91527691749092 15.999 > 35 104 O 0.57330696035584 0.04338332801180 0.91527691749092 15.999 > 35 105 O 0.90664029368917 0.04338332801180 0.91527691749092 15.999 > 35 106 O 0.09335970631083 0.54338332801180 0.58472308250908 15.999 > 36 107 O 0.42669303964416 0.54338332801180 0.58472308250908 15.999 > 36 108 O 0.76002637297749 0.54338332801180 0.58472308250908 15.999 > 36 *109 O 0.26622104288527 0.70664195043336 0.09198480018065 15.999 > 37 110 O 0.59955437621860 0.70664195043336 0.09198480018065 15.999 > 37 111 O 0.93288770955194 0.70664195043336 0.09198480018065 15.999 > 37 112 O 0.06711229044806 0.20664195043336 0.40801519981935 15.999 > 38 113 O 0.40044562378140 0.20664195043336 0.40801519981935 15.999 > 38 114 O 0.73377895711473 0.20664195043336 0.40801519981935 15.999 > 38 115 O 0.06711229044806 0.29335804956664 0.90801519981935 15.999 > 39 116 O 0.40044562378140 0.29335804956664 0.90801519981935 15.999 > 39 117 O 0.73377895711473 0.29335804956664 0.90801519981935 15.999 > 39 118 O 0.26622104288527 0.79335804956664 0.59198480018065 15.999 > 40 119 O 0.59955437621860 0.79335804956664 0.59198480018065 15.999 > 40 120 O 0.93288770955194 0.79335804956664 0.59198480018065 15.999 > 40 *121 Mg 0.09856633342494 0.92030284202953 0.58866095180894 24.305 > 41 122 Mg 0.43189966675828 0.92030284202953 0.58866095180894 24.305 > 41 123 Mg 0.76523300009161 0.92030284202953 0.58866095180894 24.305 > 41 124 Mg 0.23476699990839 0.42030284202953 0.91133904819106 24.305 > 42 125 Mg 0.56810033324172 0.42030284202953 0.91133904819106 24.305 > 42 126 Mg 0.90143366657506 0.42030284202953 0.91133904819106 24.305 > 42 127 Mg 0.23476699990839 0.07969715797047 0.41133904819106 24.305 > 43 128 Mg 0.56810033324172 0.07969715797047 0.41133904819106 24.305 > 43 129 Mg 0.90143366657506 0.07969715797047 0.41133904819106 24.305 > 43 130 Mg 0.09856633342494 0.57969715797047 0.08866095180894 24.305 > 44 131 Mg 0.43189966675828 0.57969715797047 0.08866095180894 24.305 > 44 132 Mg 0.76523300009161 0.57969715797047 0.08866095180894 24.305 > 44 *133 Mg 0.25408441989989 0.63656840031764 0.49564739191111 24.305 > 45 134 Mg 0.58741775323322 0.63656840031764 0.49564739191111 24.305 > 45 135 Mg 0.92075108656656 0.63656840031764 0.49564739191111 24.305 > 45 136 Mg 0.07924891343344 0.13656840031764 0.00435260808889 24.305 > 46 137 Mg 0.41258224676678 0.13656840031764 0.00435260808889 24.305 > 46 138 Mg 0.74591558010011 0.13656840031764 0.00435260808889 24.305 > 46 139 Mg 0.07924891343344 0.36343159968236 0.50435260808889 24.305 > 47 140 Mg 0.41258224676678 0.36343159968236 0.50435260808889 24.305 > 47 141 Mg 0.74591558010011 0.36343159968236 0.50435260808889 24.305 > 47 142 Mg 0.25408441989989 0.86343159968236 0.99564739191111 24.305 > 48 143 Mg 0.58741775323322 0.86343159968236 0.99564739191111 24.305 > 48 144 Mg 0.92075108656656 0.86343159968236 0.99564739191111 24.305 > 48 ---------------------------------------------------------------------------- NAC parameters were read from "phonopy_mlp_eval_fc2_dataset.yaml.xz". --------------------------- Dielectric constant ---------------------------- 2.6468747 0.0000000 -0.0182234 0.0000000 2.9120729 0.0000000 -0.0182235 0.0000000 2.9273533 -------------------------- Born effective charges -------------------------- 1 H 0.5038474 -0.1098862 0.1557856 -0.1296902 0.5368003 -0.2004756 0.1480381 -0.1842580 0.5216827 2 H 0.5038474 0.1098862 0.1557856 0.1296902 0.5368003 0.2004756 0.1480381 0.1842580 0.5216827 3 H 0.5038474 -0.1098862 0.1557856 -0.1296902 0.5368003 -0.2004756 0.1480381 -0.1842580 0.5216827 4 H 0.5038474 0.1098862 0.1557856 0.1296902 0.5368003 0.2004756 0.1480381 0.1842580 0.5216827 5 H 0.4793723 0.2971135 -0.3202590 0.3795671 1.2699394 -0.8873439 -0.2684765 -0.5687280 0.8866670 6 H 0.4793723 -0.2971135 -0.3202590 -0.3795671 1.2699394 0.8873439 -0.2684765 0.5687280 0.8866670 7 H 0.4793723 0.2971135 -0.3202590 0.3795671 1.2699394 -0.8873439 -0.2684765 -0.5687280 0.8866670 8 H 0.4793723 -0.2971135 -0.3202590 -0.3795671 1.2699394 0.8873439 -0.2684765 0.5687280 0.8866670 9 B 0.8537272 -0.0993839 -0.3180362 0.0196440 2.7672520 -0.3151407 -0.2857418 -0.0120427 2.6134215 10 B 0.8537272 0.0993839 -0.3180362 -0.0196440 2.7672520 0.3151407 -0.2857418 0.0120427 2.6134215 11 B 0.8537272 -0.0993839 -0.3180362 0.0196440 2.7672520 -0.3151407 -0.2857418 -0.0120427 2.6134215 12 B 0.8537272 0.0993839 -0.3180362 -0.0196440 2.7672520 0.3151407 -0.2857418 0.0120427 2.6134215 13 B 1.5025936 0.6130155 0.1363579 0.6291783 2.2103700 -0.0948055 0.0738277 -0.4090462 2.5606774 14 B 1.5025936 -0.6130155 0.1363579 -0.6291783 2.2103700 0.0948055 0.0738277 0.4090462 2.5606774 15 B 1.5025936 0.6130155 0.1363579 0.6291783 2.2103700 -0.0948055 0.0738277 -0.4090462 2.5606774 16 B 1.5025936 -0.6130155 0.1363579 -0.6291783 2.2103700 0.0948055 0.0738277 0.4090462 2.5606774 17 O -1.2609728 0.1553480 0.0940791 0.0653615 -2.0346946 -0.3746918 0.0832521 -0.5382207 -1.7899861 18 O -1.2609728 -0.1553480 0.0940791 -0.0653615 -2.0346946 0.3746918 0.0832521 0.5382207 -1.7899861 19 O -1.2609728 0.1553480 0.0940791 0.0653615 -2.0346946 -0.3746918 0.0832521 -0.5382207 -1.7899861 20 O -1.2609728 -0.1553480 0.0940791 -0.0653615 -2.0346946 0.3746918 0.0832521 0.5382207 -1.7899861 21 O -1.2362297 0.0966461 0.1872671 0.0969402 -2.4352364 0.0663048 0.1584629 0.1630597 -1.6190103 22 O -1.2362297 -0.0966461 0.1872671 -0.0969402 -2.4352364 -0.0663048 0.1584629 -0.1630597 -1.6190103 23 O -1.2362297 0.0966461 0.1872671 0.0969402 -2.4352364 0.0663048 0.1584629 0.1630597 -1.6190103 24 O -1.2362297 -0.0966461 0.1872671 -0.0969402 -2.4352364 -0.0663048 0.1584629 -0.1630597 -1.6190103 25 O -0.9554286 -0.2895648 0.2546102 -0.3445719 -1.6208493 0.5757608 0.1877409 0.5813047 -2.3522964 26 O -0.9554286 0.2895648 0.2546102 0.3445719 -1.6208493 -0.5757608 0.1877409 -0.5813047 -2.3522964 27 O -0.9554286 -0.2895648 0.2546102 -0.3445719 -1.6208493 0.5757608 0.1877409 0.5813047 -2.3522964 28 O -0.9554286 0.2895648 0.2546102 0.3445719 -1.6208493 -0.5757608 0.1877409 -0.5813047 -2.3522964 29 O -1.2554868 0.4968900 -0.0336395 0.5704681 -1.9183248 -0.1378652 -0.0154703 -0.0924399 -1.5209041 30 O -1.2554868 -0.4968900 -0.0336395 -0.5704681 -1.9183248 0.1378652 -0.0154703 0.0924399 -1.5209041 31 O -1.2554868 0.4968900 -0.0336395 0.5704681 -1.9183248 -0.1378652 -0.0154703 -0.0924399 -1.5209041 32 O -1.2554868 -0.4968900 -0.0336395 -0.5704681 -1.9183248 0.1378652 -0.0154703 0.0924399 -1.5209041 33 O -1.3441606 -0.0094854 -0.1006756 -0.0662345 -1.3961169 -0.0273671 -0.0536229 0.0390180 -2.3457016 34 O -1.3441606 0.0094854 -0.1006756 0.0662345 -1.3961169 0.0273671 -0.0536229 -0.0390180 -2.3457016 35 O -1.3441606 -0.0094854 -0.1006756 -0.0662345 -1.3961169 -0.0273671 -0.0536229 0.0390180 -2.3457016 36 O -1.3441606 0.0094854 -0.1006756 0.0662345 -1.3961169 0.0273671 -0.0536229 -0.0390180 -2.3457016 37 O -1.4067494 -0.0568835 -0.0781437 -0.0391841 -1.5491725 -0.0508208 -0.0347390 -0.0301741 -1.3821434 38 O -1.4067494 0.0568835 -0.0781437 0.0391841 -1.5491725 0.0508208 -0.0347390 0.0301741 -1.3821434 39 O -1.4067494 -0.0568835 -0.0781437 -0.0391841 -1.5491725 -0.0508208 -0.0347390 -0.0301741 -1.3821434 40 O -1.4067494 0.0568835 -0.0781437 0.0391841 -1.5491725 0.0508208 -0.0347390 0.0301741 -1.3821434 41 Mg 2.0436923 -0.0776940 0.0242216 -0.0096409 2.1236041 0.0967653 0.0163192 0.1202528 2.1595990 42 Mg 2.0436923 0.0776940 0.0242216 0.0096409 2.1236041 -0.0967653 0.0163192 -0.1202528 2.1595990 43 Mg 2.0436923 -0.0776940 0.0242216 -0.0096409 2.1236041 0.0967653 0.0163192 0.1202528 2.1595990 44 Mg 2.0436923 0.0776940 0.0242216 0.0096409 2.1236041 -0.0967653 0.0163192 -0.1202528 2.1595990 45 Mg 2.0757951 0.0733911 -0.0015675 0.0075197 2.0464288 -0.1517462 -0.0095904 -0.0586923 2.2679942 46 Mg 2.0757951 -0.0733911 -0.0015675 -0.0075197 2.0464288 0.1517462 -0.0095904 0.0586923 2.2679942 47 Mg 2.0757951 0.0733911 -0.0015675 0.0075197 2.0464288 -0.1517462 -0.0095904 -0.0586923 2.2679942 48 Mg 2.0757951 -0.0733911 -0.0015675 -0.0075197 2.0464288 0.1517462 -0.0095904 0.0586923 2.2679942 ---------------------------------------------------------------------------- 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: 31464/31464 Construct permutation basis matrix. Finding block diagonal structure in projector. Using scipy connected_components. Rank of projector: 7920 Number of blocks in projector: 7920 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: 1728 Use submatrix version of eigh solver. (1) Block: 500 / 1728 (2) Block: 250 / 500 (2) 226 eigenvectors found. (2) Block: 500 / 500 (2) 226 eigenvectors found. (2) Complementary block size: 48 (2) Compute compressed projector. (2) Use standard solver. (2) 24 eigenvectors found. (1) 476 eigenvectors found. (1) Block: 1000 / 1728 (2) Block: 250 / 500 (2) 228 eigenvectors found. (2) Block: 500 / 500 (2) 232 eigenvectors found. (2) Complementary block size: 40 (2) Compute compressed projector. (2) Use standard solver. (2) 18 eigenvectors found. (1) 478 eigenvectors found. (1) Block: 1500 / 1728 (2) Block: 250 / 500 (2) 234 eigenvectors found. (2) Block: 500 / 500 (2) 236 eigenvectors found. (2) Complementary block size: 30 (2) Compute compressed projector. (2) Use standard solver. (2) 14 eigenvectors found. (1) 484 eigenvectors found. (1) Block: 1728 / 1728 (1) 204 eigenvectors found. (1) Complementary block size: 86 (1) Compute compressed projector. (1) Use standard solver. (1) 62 eigenvectors found. --- Eigsh_solver_block: 2 / 6 --- Block_size: 1728 Use submatrix version of eigh solver. (1) Block: 500 / 1728 (2) Block: 250 / 500 (2) 226 eigenvectors found. (2) Block: 500 / 500 (2) 226 eigenvectors found. (2) Complementary block size: 48 (2) Compute compressed projector. (2) Use standard solver. (2) 24 eigenvectors found. (1) 476 eigenvectors found. (1) Block: 1000 / 1728 (2) Block: 250 / 500 (2) 228 eigenvectors found. (2) Block: 500 / 500 (2) 232 eigenvectors found. (2) Complementary block size: 40 (2) Compute compressed projector. (2) Use standard solver. (2) 18 eigenvectors found. (1) 478 eigenvectors found. (1) Block: 1500 / 1728 (2) Block: 250 / 500 (2) 234 eigenvectors found. (2) Block: 500 / 500 (2) 236 eigenvectors found. (2) Complementary block size: 30 (2) Compute compressed projector. (2) Use standard solver. (2) 14 eigenvectors found. (1) 484 eigenvectors found. (1) Block: 1728 / 1728 (1) 204 eigenvectors found. (1) Complementary block size: 86 (1) Compute compressed projector. (1) Use standard solver. (1) 62 eigenvectors found. --- Eigsh_solver_block: 3 / 6 --- Block_size: 1728 Use submatrix version of eigh solver. (1) Block: 500 / 1728 (2) Block: 250 / 500 (2) 229 eigenvectors found. (2) Block: 500 / 500 (2) 227 eigenvectors found. (2) Complementary block size: 44 (2) Compute compressed projector. (2) Use standard solver. (2) 21 eigenvectors found. (1) 477 eigenvectors found. (1) Block: 1000 / 1728 (2) Block: 250 / 500 (2) 229 eigenvectors found. (2) Block: 500 / 500 (2) 231 eigenvectors found. (2) Complementary block size: 40 (2) Compute compressed projector. (2) Use standard solver. (2) 19 eigenvectors found. (1) 479 eigenvectors found. (1) Block: 1500 / 1728 (2) Block: 250 / 500 (2) 235 eigenvectors found. (2) Block: 500 / 500 (2) 237 eigenvectors found. (2) Complementary block size: 28 (2) Compute compressed projector. (2) Use standard solver. (2) 13 eigenvectors found. (1) 485 eigenvectors found. (1) Block: 1728 / 1728 (1) 219 eigenvectors found. (1) Complementary block size: 68 (1) Compute compressed projector. (1) Use standard solver. (1) 45 eigenvectors found. --- Eigsh_solver_block: 4 / 6 --- Block_size: 912 Use submatrix version of eigh solver. (1) Block: 500 / 912 (2) Block: 250 / 500 (2) 238 eigenvectors found. (2) Block: 500 / 500 (2) 239 eigenvectors found. (2) Complementary block size: 23 (2) Compute compressed projector. (2) Use standard solver. (2) 11 eigenvectors found. (1) 488 eigenvectors found. (1) Block: 912 / 912 (1) 400 eigenvectors found. (1) Complementary block size: 24 (1) Compute compressed projector. (1) Use standard solver. (1) 12 eigenvectors found. --- Eigsh_solver_block: 5 / 6 --- Block_size: 912 Use submatrix version of eigh solver. (1) Block: 500 / 912 (2) Block: 250 / 500 (2) 238 eigenvectors found. (2) Block: 500 / 500 (2) 239 eigenvectors found. (2) Complementary block size: 23 (2) Compute compressed projector. (2) Use standard solver. (2) 11 eigenvectors found. (1) 488 eigenvectors found. (1) Block: 912 / 912 (1) 400 eigenvectors found. (1) Complementary block size: 24 (1) Compute compressed projector. (1) Use standard solver. (1) 12 eigenvectors found. --- Eigsh_solver_block: 6 / 6 --- Block_size: 912 Use submatrix version of eigh solver. (1) Block: 500 / 912 (2) Block: 250 / 500 (2) 238 eigenvectors found. (2) Block: 500 / 500 (2) 239 eigenvectors found. (2) Complementary block size: 23 (2) Compute compressed projector. (2) Use standard solver. (2) 11 eigenvectors found. (1) 488 eigenvectors found. (1) Block: 912 / 912 (1) 400 eigenvectors found. (1) Complementary block size: 24 (1) Compute compressed projector. (1) Use standard solver. (1) 12 eigenvectors found. Tree of FC basis block matrices: - (7920, 7813), data: False |-- (912, 900), data: False |-- (912, 12), data: (912, 24) @ (24, 12) |-- (412, 400), data: True |-- (500, 488), data: False |-- (500, 11), data: (500, 23) @ (23, 11) |-- (250, 239), data: True |-- (250, 238), data: True |-- (912, 900), data: False |-- (912, 12), data: (912, 24) @ (24, 12) |-- (412, 400), data: True |-- (500, 488), data: False |-- (500, 11), data: (500, 23) @ (23, 11) |-- (250, 239), data: True |-- (250, 238), data: True |-- (912, 900), data: False |-- (912, 12), data: (912, 24) @ (24, 12) |-- (412, 400), data: True |-- (500, 488), data: False |-- (500, 11), data: (500, 23) @ (23, 11) |-- (250, 239), data: True |-- (250, 238), data: True |-- (1728, 1705), data: False |-- (1728, 45), data: (1728, 68) @ (68, 45) |-- (228, 219), data: True |-- (500, 485), data: False |-- (500, 13), data: (500, 28) @ (28, 13) |-- (250, 237), data: True |-- (250, 235), data: True |-- (500, 479), data: False |-- (500, 19), data: (500, 40) @ (40, 19) |-- (250, 231), data: True |-- (250, 229), data: True |-- (500, 477), data: False |-- (500, 21), data: (500, 44) @ (44, 21) |-- (250, 227), data: True |-- (250, 229), data: True |-- (1728, 1704), data: False |-- (1728, 62), data: (1728, 86) @ (86, 62) |-- (228, 204), data: True |-- (500, 484), data: False |-- (500, 14), data: (500, 30) @ (30, 14) |-- (250, 236), data: True |-- (250, 234), data: True |-- (500, 478), data: False |-- (500, 18), data: (500, 40) @ (40, 18) |-- (250, 232), data: True |-- (250, 228), data: True |-- (500, 476), data: False |-- (500, 24), data: (500, 48) @ (48, 24) |-- (250, 226), data: True |-- (250, 226), data: True |-- (1728, 1704), data: False |-- (1728, 62), data: (1728, 86) @ (86, 62) |-- (228, 204), data: True |-- (500, 484), data: False |-- (500, 14), data: (500, 30) @ (30, 14) |-- (250, 236), data: True |-- (250, 234), data: True |-- (500, 478), data: False |-- (500, 18), data: (500, 40) @ (40, 18) |-- (250, 232), data: True |-- (250, 228), data: True |-- (500, 476), data: False |-- (500, 24), data: (500, 48) @ (48, 24) |-- (250, 226), data: True |-- (250, 226), data: True ----- Solver_atoms: 1 -- 144 / 144 Time (Solver_compr_matrix_reshape): 0.004 Solver_block: 100 / 1440 - Time: 2.818 Solver_block: 200 / 1440 - Time: 2.528 Solver_block: 300 / 1440 - Time: 2.550 Solver_block: 400 / 1440 - Time: 2.517 Solver_block: 500 / 1440 - Time: 2.524 Solver_block: 600 / 1440 - Time: 2.498 Solver_block: 700 / 1440 - Time: 2.504 Solver_block: 800 / 1440 - Time: 2.489 Solver_block: 900 / 1440 - Time: 2.494 Solver_block: 1000 / 1440 - Time: 2.520 Solver_block: 1100 / 1440 - Time: 2.517 Solver_block: 1200 / 1440 - Time: 2.510 Solver_block: 1300 / 1440 - Time: 2.508 Solver_block: 1400 / 1440 - Time: 2.509 Solver_block: 1440 / 1440 - Time: 1.162 Solver: Calculate X.T @ X and X.T @ y (disp @ compr @ eigvecs).T @ (disp @ compr @ eigvecs): 37.690 --------------------------------- Symfc end -------------------------------- Max drift of force constants: -0.00000000 (yy) -0.00000000 (yy) Permutation basis: 432/432 Permutation basis: 31464/31464 Construct permutation basis matrix. Finding block diagonal structure in projector. Using scipy connected_components. Rank of projector: 7920 Number of blocks in projector: 7920 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: 1728 Use submatrix version of eigh solver. (1) Block: 500 / 1728 (2) Block: 250 / 500 (2) 226 eigenvectors found. (2) Block: 500 / 500 (2) 226 eigenvectors found. (2) Complementary block size: 48 (2) Compute compressed projector. (2) Use standard solver. (2) 24 eigenvectors found. (1) 476 eigenvectors found. (1) Block: 1000 / 1728 (2) Block: 250 / 500 (2) 228 eigenvectors found. (2) Block: 500 / 500 (2) 232 eigenvectors found. (2) Complementary block size: 40 (2) Compute compressed projector. (2) Use standard solver. (2) 18 eigenvectors found. (1) 478 eigenvectors found. (1) Block: 1500 / 1728 (2) Block: 250 / 500 (2) 234 eigenvectors found. (2) Block: 500 / 500 (2) 236 eigenvectors found. (2) Complementary block size: 30 (2) Compute compressed projector. (2) Use standard solver. (2) 14 eigenvectors found. (1) 484 eigenvectors found. (1) Block: 1728 / 1728 (1) 204 eigenvectors found. (1) Complementary block size: 86 (1) Compute compressed projector. (1) Use standard solver. (1) 62 eigenvectors found. --- Eigsh_solver_block: 2 / 6 --- Block_size: 1728 Use submatrix version of eigh solver. (1) Block: 500 / 1728 (2) Block: 250 / 500 (2) 226 eigenvectors found. (2) Block: 500 / 500 (2) 226 eigenvectors found. (2) Complementary block size: 48 (2) Compute compressed projector. (2) Use standard solver. (2) 24 eigenvectors found. (1) 476 eigenvectors found. (1) Block: 1000 / 1728 (2) Block: 250 / 500 (2) 228 eigenvectors found. (2) Block: 500 / 500 (2) 232 eigenvectors found. (2) Complementary block size: 40 (2) Compute compressed projector. (2) Use standard solver. (2) 18 eigenvectors found. (1) 478 eigenvectors found. (1) Block: 1500 / 1728 (2) Block: 250 / 500 (2) 234 eigenvectors found. (2) Block: 500 / 500 (2) 236 eigenvectors found. (2) Complementary block size: 30 (2) Compute compressed projector. (2) Use standard solver. (2) 14 eigenvectors found. (1) 484 eigenvectors found. (1) Block: 1728 / 1728 (1) 204 eigenvectors found. (1) Complementary block size: 86 (1) Compute compressed projector. (1) Use standard solver. (1) 62 eigenvectors found. --- Eigsh_solver_block: 3 / 6 --- Block_size: 1728 Use submatrix version of eigh solver. (1) Block: 500 / 1728 (2) Block: 250 / 500 (2) 229 eigenvectors found. (2) Block: 500 / 500 (2) 227 eigenvectors found. (2) Complementary block size: 44 (2) Compute compressed projector. (2) Use standard solver. (2) 21 eigenvectors found. (1) 477 eigenvectors found. (1) Block: 1000 / 1728 (2) Block: 250 / 500 (2) 229 eigenvectors found. (2) Block: 500 / 500 (2) 231 eigenvectors found. (2) Complementary block size: 40 (2) Compute compressed projector. (2) Use standard solver. (2) 19 eigenvectors found. (1) 479 eigenvectors found. (1) Block: 1500 / 1728 (2) Block: 250 / 500 (2) 235 eigenvectors found. (2) Block: 500 / 500 (2) 237 eigenvectors found. (2) Complementary block size: 28 (2) Compute compressed projector. (2) Use standard solver. (2) 13 eigenvectors found. (1) 485 eigenvectors found. (1) Block: 1728 / 1728 (1) 219 eigenvectors found. (1) Complementary block size: 68 (1) Compute compressed projector. (1) Use standard solver. (1) 45 eigenvectors found. --- Eigsh_solver_block: 4 / 6 --- Block_size: 912 Use submatrix version of eigh solver. (1) Block: 500 / 912 (2) Block: 250 / 500 (2) 238 eigenvectors found. (2) Block: 500 / 500 (2) 239 eigenvectors found. (2) Complementary block size: 23 (2) Compute compressed projector. (2) Use standard solver. (2) 11 eigenvectors found. (1) 488 eigenvectors found. (1) Block: 912 / 912 (1) 400 eigenvectors found. (1) Complementary block size: 24 (1) Compute compressed projector. (1) Use standard solver. (1) 12 eigenvectors found. --- Eigsh_solver_block: 5 / 6 --- Block_size: 912 Use submatrix version of eigh solver. (1) Block: 500 / 912 (2) Block: 250 / 500 (2) 238 eigenvectors found. (2) Block: 500 / 500 (2) 239 eigenvectors found. (2) Complementary block size: 23 (2) Compute compressed projector. (2) Use standard solver. (2) 11 eigenvectors found. (1) 488 eigenvectors found. (1) Block: 912 / 912 (1) 400 eigenvectors found. (1) Complementary block size: 24 (1) Compute compressed projector. (1) Use standard solver. (1) 12 eigenvectors found. --- Eigsh_solver_block: 6 / 6 --- Block_size: 912 Use submatrix version of eigh solver. (1) Block: 500 / 912 (2) Block: 250 / 500 (2) 238 eigenvectors found. (2) Block: 500 / 500 (2) 239 eigenvectors found. (2) Complementary block size: 23 (2) Compute compressed projector. (2) Use standard solver. (2) 11 eigenvectors found. (1) 488 eigenvectors found. (1) Block: 912 / 912 (1) 400 eigenvectors found. (1) Complementary block size: 24 (1) Compute compressed projector. (1) Use standard solver. (1) 12 eigenvectors found. Tree of FC basis block matrices: - (7920, 7813), data: False |-- (912, 900), data: False |-- (912, 12), data: (912, 24) @ (24, 12) |-- (412, 400), data: True |-- (500, 488), data: False |-- (500, 11), data: (500, 23) @ (23, 11) |-- (250, 239), data: True |-- (250, 238), data: True |-- (912, 900), data: False |-- (912, 12), data: (912, 24) @ (24, 12) |-- (412, 400), data: True |-- (500, 488), data: False |-- (500, 11), data: (500, 23) @ (23, 11) |-- (250, 239), data: True |-- (250, 238), data: True |-- (912, 900), data: False |-- (912, 12), data: (912, 24) @ (24, 12) |-- (412, 400), data: True |-- (500, 488), data: False |-- (500, 11), data: (500, 23) @ (23, 11) |-- (250, 239), data: True |-- (250, 238), data: True |-- (1728, 1705), data: False |-- (1728, 45), data: (1728, 68) @ (68, 45) |-- (228, 219), data: True |-- (500, 485), data: False |-- (500, 13), data: (500, 28) @ (28, 13) |-- (250, 237), data: True |-- (250, 235), data: True |-- (500, 479), data: False |-- (500, 19), data: (500, 40) @ (40, 19) |-- (250, 231), data: True |-- (250, 229), data: True |-- (500, 477), data: False |-- (500, 21), data: (500, 44) @ (44, 21) |-- (250, 227), data: True |-- (250, 229), data: True |-- (1728, 1704), data: False |-- (1728, 62), data: (1728, 86) @ (86, 62) |-- (228, 204), data: True |-- (500, 484), data: False |-- (500, 14), data: (500, 30) @ (30, 14) |-- (250, 236), data: True |-- (250, 234), data: True |-- (500, 478), data: False |-- (500, 18), data: (500, 40) @ (40, 18) |-- (250, 232), data: True |-- (250, 228), data: True |-- (500, 476), data: False |-- (500, 24), data: (500, 48) @ (48, 24) |-- (250, 226), data: True |-- (250, 226), data: True |-- (1728, 1704), data: False |-- (1728, 62), data: (1728, 86) @ (86, 62) |-- (228, 204), data: True |-- (500, 484), data: False |-- (500, 14), data: (500, 30) @ (30, 14) |-- (250, 236), data: True |-- (250, 234), data: True |-- (500, 478), data: False |-- (500, 18), data: (500, 40) @ (40, 18) |-- (250, 232), data: True |-- (250, 228), data: True |-- (500, 476), data: False |-- (500, 24), data: (500, 48) @ (48, 24) |-- (250, 226), data: True |-- (250, 226), data: True Max drift after symmetrization by symfc projector: -0.00000000 (yy) -0.00000000 (yy) Force constants are written into "force_constants.hdf5". ---------------------------------------------------------------------------- One of the following run modes may be specified for phonon calculations. - Mesh sampling (MESH, --mesh) - Q-points (QPOINTS, --qpoints) - Band structure (BAND, --band) - Animation (ANIME, --anime) - Modulation (MODULATION, --modulation) - Characters of Irreps (IRREPS, --irreps) - Create displacements (CREATE_DISPLACEMENTS, -d) ---------------------------------------------------------------------------- Summary of calculation was written in "phonopy.yaml". -------------------------[time 2026-01-08 05:37:42]------------------------- _ ___ _ __ __| | / _ \ '_ \ / _` | | __/ | | | (_| | \___|_| |_|\__,_| ---------------------------- ------ calculate fc3 ------- ---------------------------- _ _____ _ __ | |__ ___ _ __ ___|___ / _ __ _ _ | '_ \| '_ \ / _ \| '_ \ / _ \ |_ \| '_ \| | | | | |_) | | | | (_) | | | | (_) |__) | |_) | |_| | | .__/|_| |_|\___/|_| |_|\___/____/| .__/ \__, | |_| |_| |___/ 3.23.0 -------------------------[time 2026-01-08 05:37:43]------------------------- 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): [3 1 1] Primitive matrix: [ 1. 0. -0.] [0. 1. 0.] [0. 0. 1.] Spacegroup: P2_1/c (14) ------------------------------ primitive cell ------------------------------ Lattice vectors: a 3.120968040022496 0.000000000000000 0.000000000000000 b 0.000000000000000 10.376370840000000 0.000000000000000 c -1.317559086450700 0.000000000000000 12.532975707451744 Atomic positions (fractional): 1 H 0.88270026404960 0.75337900100088 0.66212853961782 1.008 2 H 0.11729973595040 0.25337900100088 0.83787146038218 1.008 3 H 0.11729973595040 0.24662099899912 0.33787146038218 1.008 4 H 0.88270026404960 0.74662099899912 0.16212853961782 1.008 5 H 0.30771161651133 0.87950093464943 0.80852720392042 1.008 6 H 0.69228838348866 0.37950093464943 0.69147279607958 1.008 7 H 0.69228838348866 0.12049906535058 0.19147279607958 1.008 8 H 0.30771161651133 0.62049906535057 0.30852720392042 1.008 9 B 0.23490139404508 0.83159515903184 0.36113048015482 10.811 10 B 0.76509860595492 0.33159515903184 0.13886951984518 10.811 11 B 0.76509860595492 0.16840484096816 0.63886951984518 10.811 12 B 0.23490139404508 0.66840484096816 0.86113048015482 10.811 13 B 0.37227735167823 0.95287148908310 0.19293832180928 10.811 14 B 0.62772264832177 0.45287148908310 0.30706167819072 10.811 15 B 0.62772264832177 0.04712851091690 0.80706167819072 10.811 16 B 0.37227735167823 0.54712851091690 0.69293832180928 10.811 17 O 0.22025663538136 0.93744095278599 0.42412126801838 15.999 18 O 0.77974336461864 0.43744095278599 0.07587873198162 15.999 19 O 0.77974336461864 0.06255904721401 0.57587873198162 15.999 20 O 0.22025663538136 0.56255904721401 0.92412126801838 15.999 21 O 0.22377572956726 0.70653358449632 0.39724588766958 15.999 22 O 0.77622427043274 0.20653358449632 0.10275411233042 15.999 23 O 0.77622427043274 0.29346641550368 0.60275411233042 15.999 24 O 0.22377572956726 0.79346641550368 0.89724588766958 15.999 25 O 0.26133436961803 0.84555162557869 0.25065629040593 15.999 26 O 0.73866563038197 0.34555162557869 0.24934370959407 15.999 27 O 0.73866563038197 0.15444837442131 0.74934370959407 15.999 28 O 0.26133436961803 0.65444837442131 0.75065629040593 15.999 29 O 0.39382516950602 0.55079712798259 0.25355825668977 15.999 30 O 0.60617483049397 0.05079712798259 0.24644174331023 15.999 31 O 0.60617483049397 0.44920287201741 0.74644174331022 15.999 32 O 0.39382516950602 0.94920287201741 0.75355825668978 15.999 33 O 0.28007911893248 0.95661667198820 0.08472308250908 15.999 34 O 0.71992088106752 0.45661667198820 0.41527691749092 15.999 35 O 0.71992088106752 0.04338332801180 0.91527691749092 15.999 36 O 0.28007911893248 0.54338332801180 0.58472308250908 15.999 37 O 0.79866312865581 0.70664195043336 0.09198480018065 15.999 38 O 0.20133687134419 0.20664195043336 0.40801519981935 15.999 39 O 0.20133687134419 0.29335804956664 0.90801519981935 15.999 40 O 0.79866312865581 0.79335804956664 0.59198480018065 15.999 41 Mg 0.29569900027483 0.92030284202953 0.58866095180894 24.305 42 Mg 0.70430099972517 0.42030284202953 0.91133904819106 24.305 43 Mg 0.70430099972517 0.07969715797047 0.41133904819106 24.305 44 Mg 0.29569900027483 0.57969715797047 0.08866095180894 24.305 45 Mg 0.76225325969967 0.63656840031764 0.49564739191111 24.305 46 Mg 0.23774674030033 0.13656840031764 0.00435260808889 24.305 47 Mg 0.23774674030033 0.36343159968236 0.50435260808889 24.305 48 Mg 0.76225325969967 0.86343159968236 0.99564739191111 24.305 -------------------------------- supercell --------------------------------- Lattice vectors: a 9.362904120067487 0.000000000000000 0.000000000000000 b 0.000000000000000 10.376370840000000 0.000000000000000 c -1.317559086450700 0.000000000000000 12.532975707451744 Atomic positions (fractional): 1 H 0.29423342134987 0.75337900100088 0.66212853961782 1.008 > 1 2 H 0.62756675468320 0.75337900100088 0.66212853961782 1.008 > 1 3 H 0.96090008801653 0.75337900100088 0.66212853961782 1.008 > 1 4 H 0.03909991198347 0.25337900100088 0.83787146038218 1.008 > 4 5 H 0.37243324531680 0.25337900100088 0.83787146038218 1.008 > 4 6 H 0.70576657865013 0.25337900100088 0.83787146038218 1.008 > 4 7 H 0.03909991198347 0.24662099899912 0.33787146038218 1.008 > 7 8 H 0.37243324531680 0.24662099899912 0.33787146038218 1.008 > 7 9 H 0.70576657865013 0.24662099899912 0.33787146038218 1.008 > 7 10 H 0.29423342134987 0.74662099899912 0.16212853961782 1.008 > 10 11 H 0.62756675468320 0.74662099899912 0.16212853961782 1.008 > 10 12 H 0.96090008801653 0.74662099899912 0.16212853961782 1.008 > 10 13 H 0.10257053883711 0.87950093464943 0.80852720392042 1.008 > 13 14 H 0.43590387217044 0.87950093464943 0.80852720392042 1.008 > 13 15 H 0.76923720550378 0.87950093464943 0.80852720392042 1.008 > 13 16 H 0.23076279449622 0.37950093464943 0.69147279607958 1.008 > 16 17 H 0.56409612782955 0.37950093464943 0.69147279607958 1.008 > 16 18 H 0.89742946116289 0.37950093464943 0.69147279607958 1.008 > 16 19 H 0.23076279449622 0.12049906535058 0.19147279607958 1.008 > 19 20 H 0.56409612782955 0.12049906535058 0.19147279607958 1.008 > 19 21 H 0.89742946116289 0.12049906535058 0.19147279607958 1.008 > 19 22 H 0.10257053883711 0.62049906535057 0.30852720392042 1.008 > 22 23 H 0.43590387217044 0.62049906535057 0.30852720392042 1.008 > 22 24 H 0.76923720550378 0.62049906535057 0.30852720392042 1.008 > 22 25 B 0.07830046468169 0.83159515903184 0.36113048015482 10.811 > 25 26 B 0.41163379801503 0.83159515903184 0.36113048015482 10.811 > 25 27 B 0.74496713134836 0.83159515903184 0.36113048015482 10.811 > 25 28 B 0.25503286865164 0.33159515903184 0.13886951984518 10.811 > 28 29 B 0.58836620198497 0.33159515903184 0.13886951984518 10.811 > 28 30 B 0.92169953531831 0.33159515903184 0.13886951984518 10.811 > 28 31 B 0.25503286865164 0.16840484096816 0.63886951984518 10.811 > 31 32 B 0.58836620198497 0.16840484096816 0.63886951984518 10.811 > 31 33 B 0.92169953531831 0.16840484096816 0.63886951984518 10.811 > 31 34 B 0.07830046468169 0.66840484096816 0.86113048015482 10.811 > 34 35 B 0.41163379801503 0.66840484096816 0.86113048015482 10.811 > 34 36 B 0.74496713134836 0.66840484096816 0.86113048015482 10.811 > 34 37 B 0.12409245055941 0.95287148908310 0.19293832180928 10.811 > 37 38 B 0.45742578389274 0.95287148908310 0.19293832180928 10.811 > 37 39 B 0.79075911722608 0.95287148908310 0.19293832180928 10.811 > 37 40 B 0.20924088277392 0.45287148908310 0.30706167819072 10.811 > 40 41 B 0.54257421610726 0.45287148908310 0.30706167819072 10.811 > 40 42 B 0.87590754944059 0.45287148908310 0.30706167819072 10.811 > 40 43 B 0.20924088277392 0.04712851091690 0.80706167819072 10.811 > 43 44 B 0.54257421610726 0.04712851091690 0.80706167819072 10.811 > 43 45 B 0.87590754944059 0.04712851091690 0.80706167819072 10.811 > 43 46 B 0.12409245055941 0.54712851091690 0.69293832180928 10.811 > 46 47 B 0.45742578389274 0.54712851091690 0.69293832180928 10.811 > 46 48 B 0.79075911722608 0.54712851091690 0.69293832180928 10.811 > 46 49 O 0.07341887846045 0.93744095278599 0.42412126801838 15.999 > 49 50 O 0.40675221179379 0.93744095278599 0.42412126801838 15.999 > 49 51 O 0.74008554512712 0.93744095278599 0.42412126801838 15.999 > 49 52 O 0.25991445487288 0.43744095278599 0.07587873198162 15.999 > 52 53 O 0.59324778820621 0.43744095278599 0.07587873198162 15.999 > 52 54 O 0.92658112153955 0.43744095278599 0.07587873198162 15.999 > 52 55 O 0.25991445487288 0.06255904721401 0.57587873198162 15.999 > 55 56 O 0.59324778820621 0.06255904721401 0.57587873198162 15.999 > 55 57 O 0.92658112153955 0.06255904721401 0.57587873198162 15.999 > 55 58 O 0.07341887846045 0.56255904721401 0.92412126801838 15.999 > 58 59 O 0.40675221179379 0.56255904721401 0.92412126801838 15.999 > 58 60 O 0.74008554512712 0.56255904721401 0.92412126801838 15.999 > 58 61 O 0.07459190985575 0.70653358449632 0.39724588766958 15.999 > 61 62 O 0.40792524318909 0.70653358449632 0.39724588766958 15.999 > 61 63 O 0.74125857652242 0.70653358449632 0.39724588766958 15.999 > 61 64 O 0.25874142347758 0.20653358449632 0.10275411233042 15.999 > 64 65 O 0.59207475681091 0.20653358449632 0.10275411233042 15.999 > 64 66 O 0.92540809014425 0.20653358449632 0.10275411233042 15.999 > 64 67 O 0.25874142347758 0.29346641550368 0.60275411233042 15.999 > 67 68 O 0.59207475681091 0.29346641550368 0.60275411233042 15.999 > 67 69 O 0.92540809014425 0.29346641550368 0.60275411233042 15.999 > 67 70 O 0.07459190985575 0.79346641550368 0.89724588766958 15.999 > 70 71 O 0.40792524318909 0.79346641550368 0.89724588766958 15.999 > 70 72 O 0.74125857652242 0.79346641550368 0.89724588766958 15.999 > 70 73 O 0.08711145653934 0.84555162557869 0.25065629040593 15.999 > 73 74 O 0.42044478987268 0.84555162557869 0.25065629040593 15.999 > 73 75 O 0.75377812320601 0.84555162557869 0.25065629040593 15.999 > 73 76 O 0.24622187679399 0.34555162557869 0.24934370959407 15.999 > 76 77 O 0.57955521012732 0.34555162557869 0.24934370959407 15.999 > 76 78 O 0.91288854346066 0.34555162557869 0.24934370959407 15.999 > 76 79 O 0.24622187679399 0.15444837442131 0.74934370959407 15.999 > 79 80 O 0.57955521012732 0.15444837442131 0.74934370959407 15.999 > 79 81 O 0.91288854346066 0.15444837442131 0.74934370959407 15.999 > 79 82 O 0.08711145653934 0.65444837442131 0.75065629040593 15.999 > 82 83 O 0.42044478987268 0.65444837442131 0.75065629040593 15.999 > 82 84 O 0.75377812320601 0.65444837442131 0.75065629040593 15.999 > 82 85 O 0.13127505650201 0.55079712798259 0.25355825668977 15.999 > 85 86 O 0.46460838983534 0.55079712798259 0.25355825668977 15.999 > 85 87 O 0.79794172316867 0.55079712798259 0.25355825668977 15.999 > 85 88 O 0.20205827683132 0.05079712798259 0.24644174331023 15.999 > 88 89 O 0.53539161016466 0.05079712798259 0.24644174331023 15.999 > 88 90 O 0.86872494349799 0.05079712798259 0.24644174331023 15.999 > 88 91 O 0.20205827683132 0.44920287201741 0.74644174331022 15.999 > 91 92 O 0.53539161016466 0.44920287201741 0.74644174331022 15.999 > 91 93 O 0.86872494349799 0.44920287201741 0.74644174331022 15.999 > 91 94 O 0.13127505650201 0.94920287201741 0.75355825668978 15.999 > 94 95 O 0.46460838983534 0.94920287201741 0.75355825668978 15.999 > 94 96 O 0.79794172316867 0.94920287201741 0.75355825668978 15.999 > 94 97 O 0.09335970631083 0.95661667198820 0.08472308250908 15.999 > 97 98 O 0.42669303964416 0.95661667198820 0.08472308250908 15.999 > 97 99 O 0.76002637297749 0.95661667198820 0.08472308250908 15.999 > 97 100 O 0.23997362702251 0.45661667198820 0.41527691749092 15.999 > 100 101 O 0.57330696035584 0.45661667198820 0.41527691749092 15.999 > 100 102 O 0.90664029368917 0.45661667198820 0.41527691749092 15.999 > 100 103 O 0.23997362702251 0.04338332801180 0.91527691749092 15.999 > 103 104 O 0.57330696035584 0.04338332801180 0.91527691749092 15.999 > 103 105 O 0.90664029368917 0.04338332801180 0.91527691749092 15.999 > 103 106 O 0.09335970631083 0.54338332801180 0.58472308250908 15.999 > 106 107 O 0.42669303964416 0.54338332801180 0.58472308250908 15.999 > 106 108 O 0.76002637297749 0.54338332801180 0.58472308250908 15.999 > 106 109 O 0.26622104288527 0.70664195043336 0.09198480018065 15.999 > 109 110 O 0.59955437621860 0.70664195043336 0.09198480018065 15.999 > 109 111 O 0.93288770955194 0.70664195043336 0.09198480018065 15.999 > 109 112 O 0.06711229044806 0.20664195043336 0.40801519981935 15.999 > 112 113 O 0.40044562378140 0.20664195043336 0.40801519981935 15.999 > 112 114 O 0.73377895711473 0.20664195043336 0.40801519981935 15.999 > 112 115 O 0.06711229044806 0.29335804956664 0.90801519981935 15.999 > 115 116 O 0.40044562378140 0.29335804956664 0.90801519981935 15.999 > 115 117 O 0.73377895711473 0.29335804956664 0.90801519981935 15.999 > 115 118 O 0.26622104288527 0.79335804956664 0.59198480018065 15.999 > 118 119 O 0.59955437621860 0.79335804956664 0.59198480018065 15.999 > 118 120 O 0.93288770955194 0.79335804956664 0.59198480018065 15.999 > 118 121 Mg 0.09856633342494 0.92030284202953 0.58866095180894 24.305 > 121 122 Mg 0.43189966675828 0.92030284202953 0.58866095180894 24.305 > 121 123 Mg 0.76523300009161 0.92030284202953 0.58866095180894 24.305 > 121 124 Mg 0.23476699990839 0.42030284202953 0.91133904819106 24.305 > 124 125 Mg 0.56810033324172 0.42030284202953 0.91133904819106 24.305 > 124 126 Mg 0.90143366657506 0.42030284202953 0.91133904819106 24.305 > 124 127 Mg 0.23476699990839 0.07969715797047 0.41133904819106 24.305 > 127 128 Mg 0.56810033324172 0.07969715797047 0.41133904819106 24.305 > 127 129 Mg 0.90143366657506 0.07969715797047 0.41133904819106 24.305 > 127 130 Mg 0.09856633342494 0.57969715797047 0.08866095180894 24.305 > 130 131 Mg 0.43189966675828 0.57969715797047 0.08866095180894 24.305 > 130 132 Mg 0.76523300009161 0.57969715797047 0.08866095180894 24.305 > 130 133 Mg 0.25408441989989 0.63656840031764 0.49564739191111 24.305 > 133 134 Mg 0.58741775323322 0.63656840031764 0.49564739191111 24.305 > 133 135 Mg 0.92075108656656 0.63656840031764 0.49564739191111 24.305 > 133 136 Mg 0.07924891343344 0.13656840031764 0.00435260808889 24.305 > 136 137 Mg 0.41258224676678 0.13656840031764 0.00435260808889 24.305 > 136 138 Mg 0.74591558010011 0.13656840031764 0.00435260808889 24.305 > 136 139 Mg 0.07924891343344 0.36343159968236 0.50435260808889 24.305 > 139 140 Mg 0.41258224676678 0.36343159968236 0.50435260808889 24.305 > 139 141 Mg 0.74591558010011 0.36343159968236 0.50435260808889 24.305 > 139 142 Mg 0.25408441989989 0.86343159968236 0.99564739191111 24.305 > 142 143 Mg 0.58741775323322 0.86343159968236 0.99564739191111 24.305 > 142 144 Mg 0.92075108656656 0.86343159968236 0.99564739191111 24.305 > 142 ---------------------------------------------------------------------------- NAC parameters were read from "phono3py_mlp_eval_fc3_disp.yaml.xz". --------------------------- Dielectric constant ---------------------------- 2.6468747 0.0000000 -0.0182234 0.0000000 2.9120729 0.0000000 -0.0182235 0.0000000 2.9273533 -------------------------- Born effective charges -------------------------- 1 H 0.5038474 -0.1098862 0.1557856 -0.1296902 0.5368003 -0.2004756 0.1480381 -0.1842580 0.5216827 2 H 0.5038474 0.1098862 0.1557856 0.1296902 0.5368003 0.2004756 0.1480381 0.1842580 0.5216827 3 H 0.5038474 -0.1098862 0.1557856 -0.1296902 0.5368003 -0.2004756 0.1480381 -0.1842580 0.5216827 4 H 0.5038474 0.1098862 0.1557856 0.1296902 0.5368003 0.2004756 0.1480381 0.1842580 0.5216827 5 H 0.4793723 0.2971135 -0.3202590 0.3795671 1.2699394 -0.8873439 -0.2684765 -0.5687280 0.8866670 6 H 0.4793723 -0.2971135 -0.3202590 -0.3795671 1.2699394 0.8873439 -0.2684765 0.5687280 0.8866670 7 H 0.4793723 0.2971135 -0.3202590 0.3795671 1.2699394 -0.8873439 -0.2684765 -0.5687280 0.8866670 8 H 0.4793723 -0.2971135 -0.3202590 -0.3795671 1.2699394 0.8873439 -0.2684765 0.5687280 0.8866670 9 B 0.8537272 -0.0993839 -0.3180362 0.0196440 2.7672520 -0.3151407 -0.2857418 -0.0120427 2.6134215 10 B 0.8537272 0.0993839 -0.3180362 -0.0196440 2.7672520 0.3151407 -0.2857418 0.0120427 2.6134215 11 B 0.8537272 -0.0993839 -0.3180362 0.0196440 2.7672520 -0.3151407 -0.2857418 -0.0120427 2.6134215 12 B 0.8537272 0.0993839 -0.3180362 -0.0196440 2.7672520 0.3151407 -0.2857418 0.0120427 2.6134215 13 B 1.5025936 0.6130155 0.1363579 0.6291783 2.2103700 -0.0948055 0.0738277 -0.4090462 2.5606774 14 B 1.5025936 -0.6130155 0.1363579 -0.6291783 2.2103700 0.0948055 0.0738277 0.4090462 2.5606774 15 B 1.5025936 0.6130155 0.1363579 0.6291783 2.2103700 -0.0948055 0.0738277 -0.4090462 2.5606774 16 B 1.5025936 -0.6130155 0.1363579 -0.6291783 2.2103700 0.0948055 0.0738277 0.4090462 2.5606774 17 O -1.2609728 0.1553480 0.0940791 0.0653615 -2.0346946 -0.3746918 0.0832521 -0.5382207 -1.7899861 18 O -1.2609728 -0.1553480 0.0940791 -0.0653615 -2.0346946 0.3746918 0.0832521 0.5382207 -1.7899861 19 O -1.2609728 0.1553480 0.0940791 0.0653615 -2.0346946 -0.3746918 0.0832521 -0.5382207 -1.7899861 20 O -1.2609728 -0.1553480 0.0940791 -0.0653615 -2.0346946 0.3746918 0.0832521 0.5382207 -1.7899861 21 O -1.2362297 0.0966461 0.1872671 0.0969402 -2.4352364 0.0663048 0.1584629 0.1630597 -1.6190103 22 O -1.2362297 -0.0966461 0.1872671 -0.0969402 -2.4352364 -0.0663048 0.1584629 -0.1630597 -1.6190103 23 O -1.2362297 0.0966461 0.1872671 0.0969402 -2.4352364 0.0663048 0.1584629 0.1630597 -1.6190103 24 O -1.2362297 -0.0966461 0.1872671 -0.0969402 -2.4352364 -0.0663048 0.1584629 -0.1630597 -1.6190103 25 O -0.9554286 -0.2895648 0.2546102 -0.3445719 -1.6208493 0.5757608 0.1877409 0.5813047 -2.3522964 26 O -0.9554286 0.2895648 0.2546102 0.3445719 -1.6208493 -0.5757608 0.1877409 -0.5813047 -2.3522964 27 O -0.9554286 -0.2895648 0.2546102 -0.3445719 -1.6208493 0.5757608 0.1877409 0.5813047 -2.3522964 28 O -0.9554286 0.2895648 0.2546102 0.3445719 -1.6208493 -0.5757608 0.1877409 -0.5813047 -2.3522964 29 O -1.2554868 0.4968900 -0.0336395 0.5704681 -1.9183248 -0.1378652 -0.0154703 -0.0924399 -1.5209041 30 O -1.2554868 -0.4968900 -0.0336395 -0.5704681 -1.9183248 0.1378652 -0.0154703 0.0924399 -1.5209041 31 O -1.2554868 0.4968900 -0.0336395 0.5704681 -1.9183248 -0.1378652 -0.0154703 -0.0924399 -1.5209041 32 O -1.2554868 -0.4968900 -0.0336395 -0.5704681 -1.9183248 0.1378652 -0.0154703 0.0924399 -1.5209041 33 O -1.3441606 -0.0094854 -0.1006756 -0.0662345 -1.3961169 -0.0273671 -0.0536229 0.0390180 -2.3457016 34 O -1.3441606 0.0094854 -0.1006756 0.0662345 -1.3961169 0.0273671 -0.0536229 -0.0390180 -2.3457016 35 O -1.3441606 -0.0094854 -0.1006756 -0.0662345 -1.3961169 -0.0273671 -0.0536229 0.0390180 -2.3457016 36 O -1.3441606 0.0094854 -0.1006756 0.0662345 -1.3961169 0.0273671 -0.0536229 -0.0390180 -2.3457016 37 O -1.4067494 -0.0568835 -0.0781437 -0.0391841 -1.5491725 -0.0508208 -0.0347390 -0.0301741 -1.3821434 38 O -1.4067494 0.0568835 -0.0781437 0.0391841 -1.5491725 0.0508208 -0.0347390 0.0301741 -1.3821434 39 O -1.4067494 -0.0568835 -0.0781437 -0.0391841 -1.5491725 -0.0508208 -0.0347390 -0.0301741 -1.3821434 40 O -1.4067494 0.0568835 -0.0781437 0.0391841 -1.5491725 0.0508208 -0.0347390 0.0301741 -1.3821434 41 Mg 2.0436923 -0.0776940 0.0242216 -0.0096409 2.1236041 0.0967653 0.0163192 0.1202528 2.1595990 42 Mg 2.0436923 0.0776940 0.0242216 0.0096409 2.1236041 -0.0967653 0.0163192 -0.1202528 2.1595990 43 Mg 2.0436923 -0.0776940 0.0242216 -0.0096409 2.1236041 0.0967653 0.0163192 0.1202528 2.1595990 44 Mg 2.0436923 0.0776940 0.0242216 0.0096409 2.1236041 -0.0967653 0.0163192 -0.1202528 2.1595990 45 Mg 2.0757951 0.0733911 -0.0015675 0.0075197 2.0464288 -0.1517462 -0.0095904 -0.0586923 2.2679942 46 Mg 2.0757951 -0.0733911 -0.0015675 -0.0075197 2.0464288 0.1517462 -0.0095904 0.0586923 2.2679942 47 Mg 2.0757951 0.0733911 -0.0015675 0.0075197 2.0464288 -0.1517462 -0.0095904 -0.0586923 2.2679942 48 Mg 2.0757951 -0.0733911 -0.0015675 -0.0075197 2.0464288 0.1517462 -0.0095904 0.0586923 2.2679942 ---------------------------------------------------------------------------- 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] [-0.0010 0.0000 0.0099] [ 0.0010 0.0000 -0.0099] Computing fc3[ 13, 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] [-0.0010 0.0000 0.0099] [ 0.0010 0.0000 -0.0099] Computing fc3[ 25, x, x ] using numpy.linalg.pinv. Displacements (in Angstrom): [ 0.0100 0.0000 0.0000] [-0.0100 0.0000 0.0000] [ 0.0000 0.0100 0.0000] [ 0.0000 -0.0100 0.0000] [-0.0010 0.0000 0.0099] [ 0.0010 0.0000 -0.0099] 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] [-0.0010 0.0000 0.0099] [ 0.0010 0.0000 -0.0099] Computing fc3[ 49, x, x ] using numpy.linalg.pinv. Displacements (in Angstrom): [ 0.0100 0.0000 0.0000] [-0.0100 0.0000 0.0000] [ 0.0000 0.0100 0.0000] [ 0.0000 -0.0100 0.0000] [-0.0010 0.0000 0.0099] [ 0.0010 0.0000 -0.0099] Computing fc3[ 61, 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] [-0.0010 0.0000 0.0099] [ 0.0010 0.0000 -0.0099] 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] [-0.0010 0.0000 0.0099] [ 0.0010 0.0000 -0.0099] Computing fc3[ 85, 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] [-0.0010 0.0000 0.0099] [ 0.0010 0.0000 -0.0099] Computing fc3[ 97, 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] [-0.0010 0.0000 0.0099] [ 0.0010 0.0000 -0.0099] 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] [-0.0010 0.0000 0.0099] [ 0.0010 0.0000 -0.0099] Computing fc3[ 121, 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] [-0.0010 0.0000 0.0099] [ 0.0010 0.0000 -0.0099] Computing fc3[ 133, 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] [-0.0010 0.0000 0.0099] [ 0.0010 0.0000 -0.0099] Expanding fc3. Symmetrizing fc3 by traditional approach (N=3). Symmetrizing fc2 by traditional approach (N=3). Max drift of fc3: 0.00000000 (zyz) 0.00000000 (zyz) 0.00000000 (zzy) 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 05:39:05]------------------------- _ ___ _ __ __| | / _ \ '_ \ / _` | | __/ | | | (_| | \___|_| |_|\__,_| ---------------------------- ------ calculate LTC ------- ---------------------------- _ _____ _ __ | |__ ___ _ __ ___|___ / _ __ _ _ | '_ \| '_ \ / _ \| '_ \ / _ \ |_ \| '_ \| | | | | |_) | | | | (_) | | | | (_) |__) | |_) | |_| | | .__/|_| |_|\___/|_| |_|\___/____/| .__/ \__, | |_| |_| |___/ 3.23.0 -------------------------[time 2026-01-08 05:39:06]------------------------- 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): [3 1 1] Primitive matrix: [ 1. 0. -0.] [0. 1. 0.] [0. 0. 1.] Spacegroup: P2_1/c (14) ------------------------------ primitive cell ------------------------------ Lattice vectors: a 3.120968040022496 0.000000000000000 0.000000000000000 b 0.000000000000000 10.376370840000000 0.000000000000000 c -1.317559086450700 0.000000000000000 12.532975707451744 Atomic positions (fractional): 1 H 0.88270026404960 0.75337900100088 0.66212853961782 1.008 2 H 0.11729973595040 0.25337900100088 0.83787146038218 1.008 3 H 0.11729973595040 0.24662099899912 0.33787146038218 1.008 4 H 0.88270026404960 0.74662099899912 0.16212853961782 1.008 5 H 0.30771161651133 0.87950093464943 0.80852720392042 1.008 6 H 0.69228838348866 0.37950093464943 0.69147279607958 1.008 7 H 0.69228838348866 0.12049906535058 0.19147279607958 1.008 8 H 0.30771161651133 0.62049906535057 0.30852720392042 1.008 9 B 0.23490139404508 0.83159515903184 0.36113048015482 10.811 10 B 0.76509860595492 0.33159515903184 0.13886951984518 10.811 11 B 0.76509860595492 0.16840484096816 0.63886951984518 10.811 12 B 0.23490139404508 0.66840484096816 0.86113048015482 10.811 13 B 0.37227735167823 0.95287148908310 0.19293832180928 10.811 14 B 0.62772264832177 0.45287148908310 0.30706167819072 10.811 15 B 0.62772264832177 0.04712851091690 0.80706167819072 10.811 16 B 0.37227735167823 0.54712851091690 0.69293832180928 10.811 17 O 0.22025663538136 0.93744095278599 0.42412126801838 15.999 18 O 0.77974336461864 0.43744095278599 0.07587873198162 15.999 19 O 0.77974336461864 0.06255904721401 0.57587873198162 15.999 20 O 0.22025663538136 0.56255904721401 0.92412126801838 15.999 21 O 0.22377572956726 0.70653358449632 0.39724588766958 15.999 22 O 0.77622427043274 0.20653358449632 0.10275411233042 15.999 23 O 0.77622427043274 0.29346641550368 0.60275411233042 15.999 24 O 0.22377572956726 0.79346641550368 0.89724588766958 15.999 25 O 0.26133436961803 0.84555162557869 0.25065629040593 15.999 26 O 0.73866563038197 0.34555162557869 0.24934370959407 15.999 27 O 0.73866563038197 0.15444837442131 0.74934370959407 15.999 28 O 0.26133436961803 0.65444837442131 0.75065629040593 15.999 29 O 0.39382516950602 0.55079712798259 0.25355825668977 15.999 30 O 0.60617483049397 0.05079712798259 0.24644174331023 15.999 31 O 0.60617483049397 0.44920287201741 0.74644174331022 15.999 32 O 0.39382516950602 0.94920287201741 0.75355825668978 15.999 33 O 0.28007911893248 0.95661667198820 0.08472308250908 15.999 34 O 0.71992088106752 0.45661667198820 0.41527691749092 15.999 35 O 0.71992088106752 0.04338332801180 0.91527691749092 15.999 36 O 0.28007911893248 0.54338332801180 0.58472308250908 15.999 37 O 0.79866312865581 0.70664195043336 0.09198480018065 15.999 38 O 0.20133687134419 0.20664195043336 0.40801519981935 15.999 39 O 0.20133687134419 0.29335804956664 0.90801519981935 15.999 40 O 0.79866312865581 0.79335804956664 0.59198480018065 15.999 41 Mg 0.29569900027483 0.92030284202953 0.58866095180894 24.305 42 Mg 0.70430099972517 0.42030284202953 0.91133904819106 24.305 43 Mg 0.70430099972517 0.07969715797047 0.41133904819106 24.305 44 Mg 0.29569900027483 0.57969715797047 0.08866095180894 24.305 45 Mg 0.76225325969967 0.63656840031764 0.49564739191111 24.305 46 Mg 0.23774674030033 0.13656840031764 0.00435260808889 24.305 47 Mg 0.23774674030033 0.36343159968236 0.50435260808889 24.305 48 Mg 0.76225325969967 0.86343159968236 0.99564739191111 24.305 -------------------------------- supercell --------------------------------- Lattice vectors: a 9.362904120067487 0.000000000000000 0.000000000000000 b 0.000000000000000 10.376370840000000 0.000000000000000 c -1.317559086450700 0.000000000000000 12.532975707451744 Atomic positions (fractional): 1 H 0.29423342134987 0.75337900100088 0.66212853961782 1.008 > 1 2 H 0.62756675468320 0.75337900100088 0.66212853961782 1.008 > 1 3 H 0.96090008801653 0.75337900100088 0.66212853961782 1.008 > 1 4 H 0.03909991198347 0.25337900100088 0.83787146038218 1.008 > 4 5 H 0.37243324531680 0.25337900100088 0.83787146038218 1.008 > 4 6 H 0.70576657865013 0.25337900100088 0.83787146038218 1.008 > 4 7 H 0.03909991198347 0.24662099899912 0.33787146038218 1.008 > 7 8 H 0.37243324531680 0.24662099899912 0.33787146038218 1.008 > 7 9 H 0.70576657865013 0.24662099899912 0.33787146038218 1.008 > 7 10 H 0.29423342134987 0.74662099899912 0.16212853961782 1.008 > 10 11 H 0.62756675468320 0.74662099899912 0.16212853961782 1.008 > 10 12 H 0.96090008801653 0.74662099899912 0.16212853961782 1.008 > 10 13 H 0.10257053883711 0.87950093464943 0.80852720392042 1.008 > 13 14 H 0.43590387217044 0.87950093464943 0.80852720392042 1.008 > 13 15 H 0.76923720550378 0.87950093464943 0.80852720392042 1.008 > 13 16 H 0.23076279449622 0.37950093464943 0.69147279607958 1.008 > 16 17 H 0.56409612782955 0.37950093464943 0.69147279607958 1.008 > 16 18 H 0.89742946116289 0.37950093464943 0.69147279607958 1.008 > 16 19 H 0.23076279449622 0.12049906535058 0.19147279607958 1.008 > 19 20 H 0.56409612782955 0.12049906535058 0.19147279607958 1.008 > 19 21 H 0.89742946116289 0.12049906535058 0.19147279607958 1.008 > 19 22 H 0.10257053883711 0.62049906535057 0.30852720392042 1.008 > 22 23 H 0.43590387217044 0.62049906535057 0.30852720392042 1.008 > 22 24 H 0.76923720550378 0.62049906535057 0.30852720392042 1.008 > 22 25 B 0.07830046468169 0.83159515903184 0.36113048015482 10.811 > 25 26 B 0.41163379801503 0.83159515903184 0.36113048015482 10.811 > 25 27 B 0.74496713134836 0.83159515903184 0.36113048015482 10.811 > 25 28 B 0.25503286865164 0.33159515903184 0.13886951984518 10.811 > 28 29 B 0.58836620198497 0.33159515903184 0.13886951984518 10.811 > 28 30 B 0.92169953531831 0.33159515903184 0.13886951984518 10.811 > 28 31 B 0.25503286865164 0.16840484096816 0.63886951984518 10.811 > 31 32 B 0.58836620198497 0.16840484096816 0.63886951984518 10.811 > 31 33 B 0.92169953531831 0.16840484096816 0.63886951984518 10.811 > 31 34 B 0.07830046468169 0.66840484096816 0.86113048015482 10.811 > 34 35 B 0.41163379801503 0.66840484096816 0.86113048015482 10.811 > 34 36 B 0.74496713134836 0.66840484096816 0.86113048015482 10.811 > 34 37 B 0.12409245055941 0.95287148908310 0.19293832180928 10.811 > 37 38 B 0.45742578389274 0.95287148908310 0.19293832180928 10.811 > 37 39 B 0.79075911722608 0.95287148908310 0.19293832180928 10.811 > 37 40 B 0.20924088277392 0.45287148908310 0.30706167819072 10.811 > 40 41 B 0.54257421610726 0.45287148908310 0.30706167819072 10.811 > 40 42 B 0.87590754944059 0.45287148908310 0.30706167819072 10.811 > 40 43 B 0.20924088277392 0.04712851091690 0.80706167819072 10.811 > 43 44 B 0.54257421610726 0.04712851091690 0.80706167819072 10.811 > 43 45 B 0.87590754944059 0.04712851091690 0.80706167819072 10.811 > 43 46 B 0.12409245055941 0.54712851091690 0.69293832180928 10.811 > 46 47 B 0.45742578389274 0.54712851091690 0.69293832180928 10.811 > 46 48 B 0.79075911722608 0.54712851091690 0.69293832180928 10.811 > 46 49 O 0.07341887846045 0.93744095278599 0.42412126801838 15.999 > 49 50 O 0.40675221179379 0.93744095278599 0.42412126801838 15.999 > 49 51 O 0.74008554512712 0.93744095278599 0.42412126801838 15.999 > 49 52 O 0.25991445487288 0.43744095278599 0.07587873198162 15.999 > 52 53 O 0.59324778820621 0.43744095278599 0.07587873198162 15.999 > 52 54 O 0.92658112153955 0.43744095278599 0.07587873198162 15.999 > 52 55 O 0.25991445487288 0.06255904721401 0.57587873198162 15.999 > 55 56 O 0.59324778820621 0.06255904721401 0.57587873198162 15.999 > 55 57 O 0.92658112153955 0.06255904721401 0.57587873198162 15.999 > 55 58 O 0.07341887846045 0.56255904721401 0.92412126801838 15.999 > 58 59 O 0.40675221179379 0.56255904721401 0.92412126801838 15.999 > 58 60 O 0.74008554512712 0.56255904721401 0.92412126801838 15.999 > 58 61 O 0.07459190985575 0.70653358449632 0.39724588766958 15.999 > 61 62 O 0.40792524318909 0.70653358449632 0.39724588766958 15.999 > 61 63 O 0.74125857652242 0.70653358449632 0.39724588766958 15.999 > 61 64 O 0.25874142347758 0.20653358449632 0.10275411233042 15.999 > 64 65 O 0.59207475681091 0.20653358449632 0.10275411233042 15.999 > 64 66 O 0.92540809014425 0.20653358449632 0.10275411233042 15.999 > 64 67 O 0.25874142347758 0.29346641550368 0.60275411233042 15.999 > 67 68 O 0.59207475681091 0.29346641550368 0.60275411233042 15.999 > 67 69 O 0.92540809014425 0.29346641550368 0.60275411233042 15.999 > 67 70 O 0.07459190985575 0.79346641550368 0.89724588766958 15.999 > 70 71 O 0.40792524318909 0.79346641550368 0.89724588766958 15.999 > 70 72 O 0.74125857652242 0.79346641550368 0.89724588766958 15.999 > 70 73 O 0.08711145653934 0.84555162557869 0.25065629040593 15.999 > 73 74 O 0.42044478987268 0.84555162557869 0.25065629040593 15.999 > 73 75 O 0.75377812320601 0.84555162557869 0.25065629040593 15.999 > 73 76 O 0.24622187679399 0.34555162557869 0.24934370959407 15.999 > 76 77 O 0.57955521012732 0.34555162557869 0.24934370959407 15.999 > 76 78 O 0.91288854346066 0.34555162557869 0.24934370959407 15.999 > 76 79 O 0.24622187679399 0.15444837442131 0.74934370959407 15.999 > 79 80 O 0.57955521012732 0.15444837442131 0.74934370959407 15.999 > 79 81 O 0.91288854346066 0.15444837442131 0.74934370959407 15.999 > 79 82 O 0.08711145653934 0.65444837442131 0.75065629040593 15.999 > 82 83 O 0.42044478987268 0.65444837442131 0.75065629040593 15.999 > 82 84 O 0.75377812320601 0.65444837442131 0.75065629040593 15.999 > 82 85 O 0.13127505650201 0.55079712798259 0.25355825668977 15.999 > 85 86 O 0.46460838983534 0.55079712798259 0.25355825668977 15.999 > 85 87 O 0.79794172316867 0.55079712798259 0.25355825668977 15.999 > 85 88 O 0.20205827683132 0.05079712798259 0.24644174331023 15.999 > 88 89 O 0.53539161016466 0.05079712798259 0.24644174331023 15.999 > 88 90 O 0.86872494349799 0.05079712798259 0.24644174331023 15.999 > 88 91 O 0.20205827683132 0.44920287201741 0.74644174331022 15.999 > 91 92 O 0.53539161016466 0.44920287201741 0.74644174331022 15.999 > 91 93 O 0.86872494349799 0.44920287201741 0.74644174331022 15.999 > 91 94 O 0.13127505650201 0.94920287201741 0.75355825668978 15.999 > 94 95 O 0.46460838983534 0.94920287201741 0.75355825668978 15.999 > 94 96 O 0.79794172316867 0.94920287201741 0.75355825668978 15.999 > 94 97 O 0.09335970631083 0.95661667198820 0.08472308250908 15.999 > 97 98 O 0.42669303964416 0.95661667198820 0.08472308250908 15.999 > 97 99 O 0.76002637297749 0.95661667198820 0.08472308250908 15.999 > 97 100 O 0.23997362702251 0.45661667198820 0.41527691749092 15.999 > 100 101 O 0.57330696035584 0.45661667198820 0.41527691749092 15.999 > 100 102 O 0.90664029368917 0.45661667198820 0.41527691749092 15.999 > 100 103 O 0.23997362702251 0.04338332801180 0.91527691749092 15.999 > 103 104 O 0.57330696035584 0.04338332801180 0.91527691749092 15.999 > 103 105 O 0.90664029368917 0.04338332801180 0.91527691749092 15.999 > 103 106 O 0.09335970631083 0.54338332801180 0.58472308250908 15.999 > 106 107 O 0.42669303964416 0.54338332801180 0.58472308250908 15.999 > 106 108 O 0.76002637297749 0.54338332801180 0.58472308250908 15.999 > 106 109 O 0.26622104288527 0.70664195043336 0.09198480018065 15.999 > 109 110 O 0.59955437621860 0.70664195043336 0.09198480018065 15.999 > 109 111 O 0.93288770955194 0.70664195043336 0.09198480018065 15.999 > 109 112 O 0.06711229044806 0.20664195043336 0.40801519981935 15.999 > 112 113 O 0.40044562378140 0.20664195043336 0.40801519981935 15.999 > 112 114 O 0.73377895711473 0.20664195043336 0.40801519981935 15.999 > 112 115 O 0.06711229044806 0.29335804956664 0.90801519981935 15.999 > 115 116 O 0.40044562378140 0.29335804956664 0.90801519981935 15.999 > 115 117 O 0.73377895711473 0.29335804956664 0.90801519981935 15.999 > 115 118 O 0.26622104288527 0.79335804956664 0.59198480018065 15.999 > 118 119 O 0.59955437621860 0.79335804956664 0.59198480018065 15.999 > 118 120 O 0.93288770955194 0.79335804956664 0.59198480018065 15.999 > 118 121 Mg 0.09856633342494 0.92030284202953 0.58866095180894 24.305 > 121 122 Mg 0.43189966675828 0.92030284202953 0.58866095180894 24.305 > 121 123 Mg 0.76523300009161 0.92030284202953 0.58866095180894 24.305 > 121 124 Mg 0.23476699990839 0.42030284202953 0.91133904819106 24.305 > 124 125 Mg 0.56810033324172 0.42030284202953 0.91133904819106 24.305 > 124 126 Mg 0.90143366657506 0.42030284202953 0.91133904819106 24.305 > 124 127 Mg 0.23476699990839 0.07969715797047 0.41133904819106 24.305 > 127 128 Mg 0.56810033324172 0.07969715797047 0.41133904819106 24.305 > 127 129 Mg 0.90143366657506 0.07969715797047 0.41133904819106 24.305 > 127 130 Mg 0.09856633342494 0.57969715797047 0.08866095180894 24.305 > 130 131 Mg 0.43189966675828 0.57969715797047 0.08866095180894 24.305 > 130 132 Mg 0.76523300009161 0.57969715797047 0.08866095180894 24.305 > 130 133 Mg 0.25408441989989 0.63656840031764 0.49564739191111 24.305 > 133 134 Mg 0.58741775323322 0.63656840031764 0.49564739191111 24.305 > 133 135 Mg 0.92075108656656 0.63656840031764 0.49564739191111 24.305 > 133 136 Mg 0.07924891343344 0.13656840031764 0.00435260808889 24.305 > 136 137 Mg 0.41258224676678 0.13656840031764 0.00435260808889 24.305 > 136 138 Mg 0.74591558010011 0.13656840031764 0.00435260808889 24.305 > 136 139 Mg 0.07924891343344 0.36343159968236 0.50435260808889 24.305 > 139 140 Mg 0.41258224676678 0.36343159968236 0.50435260808889 24.305 > 139 141 Mg 0.74591558010011 0.36343159968236 0.50435260808889 24.305 > 139 142 Mg 0.25408441989989 0.86343159968236 0.99564739191111 24.305 > 142 143 Mg 0.58741775323322 0.86343159968236 0.99564739191111 24.305 > 142 144 Mg 0.92075108656656 0.86343159968236 0.99564739191111 24.305 > 142 ---------------------------------------------------------------------------- NAC parameters were read from "phono3py.yaml". --------------------------- Dielectric constant ---------------------------- 2.6468747 0.0000000 -0.0182234 0.0000000 2.9120729 0.0000000 -0.0182235 0.0000000 2.9273533 -------------------------- Born effective charges -------------------------- 1 H 0.5038474 -0.1098862 0.1557856 -0.1296902 0.5368003 -0.2004756 0.1480381 -0.1842580 0.5216827 2 H 0.5038474 0.1098862 0.1557856 0.1296902 0.5368003 0.2004756 0.1480381 0.1842580 0.5216827 3 H 0.5038474 -0.1098862 0.1557856 -0.1296902 0.5368003 -0.2004756 0.1480381 -0.1842580 0.5216827 4 H 0.5038474 0.1098862 0.1557856 0.1296902 0.5368003 0.2004756 0.1480381 0.1842580 0.5216827 5 H 0.4793723 0.2971135 -0.3202590 0.3795671 1.2699394 -0.8873439 -0.2684765 -0.5687280 0.8866670 6 H 0.4793723 -0.2971135 -0.3202590 -0.3795671 1.2699394 0.8873439 -0.2684765 0.5687280 0.8866670 7 H 0.4793723 0.2971135 -0.3202590 0.3795671 1.2699394 -0.8873439 -0.2684765 -0.5687280 0.8866670 8 H 0.4793723 -0.2971135 -0.3202590 -0.3795671 1.2699394 0.8873439 -0.2684765 0.5687280 0.8866670 9 B 0.8537272 -0.0993839 -0.3180362 0.0196440 2.7672520 -0.3151407 -0.2857418 -0.0120427 2.6134215 10 B 0.8537272 0.0993839 -0.3180362 -0.0196440 2.7672520 0.3151407 -0.2857418 0.0120427 2.6134215 11 B 0.8537272 -0.0993839 -0.3180362 0.0196440 2.7672520 -0.3151407 -0.2857418 -0.0120427 2.6134215 12 B 0.8537272 0.0993839 -0.3180362 -0.0196440 2.7672520 0.3151407 -0.2857418 0.0120427 2.6134215 13 B 1.5025936 0.6130155 0.1363579 0.6291783 2.2103700 -0.0948055 0.0738277 -0.4090462 2.5606774 14 B 1.5025936 -0.6130155 0.1363579 -0.6291783 2.2103700 0.0948055 0.0738277 0.4090462 2.5606774 15 B 1.5025936 0.6130155 0.1363579 0.6291783 2.2103700 -0.0948055 0.0738277 -0.4090462 2.5606774 16 B 1.5025936 -0.6130155 0.1363579 -0.6291783 2.2103700 0.0948055 0.0738277 0.4090462 2.5606774 17 O -1.2609728 0.1553480 0.0940791 0.0653615 -2.0346946 -0.3746918 0.0832521 -0.5382207 -1.7899861 18 O -1.2609728 -0.1553480 0.0940791 -0.0653615 -2.0346946 0.3746918 0.0832521 0.5382207 -1.7899861 19 O -1.2609728 0.1553480 0.0940791 0.0653615 -2.0346946 -0.3746918 0.0832521 -0.5382207 -1.7899861 20 O -1.2609728 -0.1553480 0.0940791 -0.0653615 -2.0346946 0.3746918 0.0832521 0.5382207 -1.7899861 21 O -1.2362297 0.0966461 0.1872671 0.0969402 -2.4352364 0.0663048 0.1584629 0.1630597 -1.6190103 22 O -1.2362297 -0.0966461 0.1872671 -0.0969402 -2.4352364 -0.0663048 0.1584629 -0.1630597 -1.6190103 23 O -1.2362297 0.0966461 0.1872671 0.0969402 -2.4352364 0.0663048 0.1584629 0.1630597 -1.6190103 24 O -1.2362297 -0.0966461 0.1872671 -0.0969402 -2.4352364 -0.0663048 0.1584629 -0.1630597 -1.6190103 25 O -0.9554286 -0.2895648 0.2546102 -0.3445719 -1.6208493 0.5757608 0.1877409 0.5813047 -2.3522964 26 O -0.9554286 0.2895648 0.2546102 0.3445719 -1.6208493 -0.5757608 0.1877409 -0.5813047 -2.3522964 27 O -0.9554286 -0.2895648 0.2546102 -0.3445719 -1.6208493 0.5757608 0.1877409 0.5813047 -2.3522964 28 O -0.9554286 0.2895648 0.2546102 0.3445719 -1.6208493 -0.5757608 0.1877409 -0.5813047 -2.3522964 29 O -1.2554868 0.4968900 -0.0336395 0.5704681 -1.9183248 -0.1378652 -0.0154703 -0.0924399 -1.5209041 30 O -1.2554868 -0.4968900 -0.0336395 -0.5704681 -1.9183248 0.1378652 -0.0154703 0.0924399 -1.5209041 31 O -1.2554868 0.4968900 -0.0336395 0.5704681 -1.9183248 -0.1378652 -0.0154703 -0.0924399 -1.5209041 32 O -1.2554868 -0.4968900 -0.0336395 -0.5704681 -1.9183248 0.1378652 -0.0154703 0.0924399 -1.5209041 33 O -1.3441606 -0.0094854 -0.1006756 -0.0662345 -1.3961169 -0.0273671 -0.0536229 0.0390180 -2.3457016 34 O -1.3441606 0.0094854 -0.1006756 0.0662345 -1.3961169 0.0273671 -0.0536229 -0.0390180 -2.3457016 35 O -1.3441606 -0.0094854 -0.1006756 -0.0662345 -1.3961169 -0.0273671 -0.0536229 0.0390180 -2.3457016 36 O -1.3441606 0.0094854 -0.1006756 0.0662345 -1.3961169 0.0273671 -0.0536229 -0.0390180 -2.3457016 37 O -1.4067494 -0.0568835 -0.0781437 -0.0391841 -1.5491725 -0.0508208 -0.0347390 -0.0301741 -1.3821434 38 O -1.4067494 0.0568835 -0.0781437 0.0391841 -1.5491725 0.0508208 -0.0347390 0.0301741 -1.3821434 39 O -1.4067494 -0.0568835 -0.0781437 -0.0391841 -1.5491725 -0.0508208 -0.0347390 -0.0301741 -1.3821434 40 O -1.4067494 0.0568835 -0.0781437 0.0391841 -1.5491725 0.0508208 -0.0347390 0.0301741 -1.3821434 41 Mg 2.0436923 -0.0776940 0.0242216 -0.0096409 2.1236041 0.0967653 0.0163192 0.1202528 2.1595990 42 Mg 2.0436923 0.0776940 0.0242216 0.0096409 2.1236041 -0.0967653 0.0163192 -0.1202528 2.1595990 43 Mg 2.0436923 -0.0776940 0.0242216 -0.0096409 2.1236041 0.0967653 0.0163192 0.1202528 2.1595990 44 Mg 2.0436923 0.0776940 0.0242216 0.0096409 2.1236041 -0.0967653 0.0163192 -0.1202528 2.1595990 45 Mg 2.0757951 0.0733911 -0.0015675 0.0075197 2.0464288 -0.1517462 -0.0095904 -0.0586923 2.2679942 46 Mg 2.0757951 -0.0733911 -0.0015675 -0.0075197 2.0464288 0.1517462 -0.0095904 0.0586923 2.2679942 47 Mg 2.0757951 0.0733911 -0.0015675 0.0075197 2.0464288 -0.1517462 -0.0095904 -0.0586923 2.2679942 48 Mg 2.0757951 -0.0733911 -0.0015675 -0.0075197 2.0464288 0.1517462 -0.0095904 0.0586923 2.2679942 ---------------------------------------------------------------------------- fc3 was read from "fc3.hdf5". fc2 was read from "fc2.hdf5". ----------------------------- Force constants ------------------------------ Max drift of fc3: 0.00000000 (zyz) 0.00000000 (zyz) 0.00000000 (zzy) Max drift of fc2: -0.00000000 (yy) -0.00000000 (yy) --------------------------- Calculation settings --------------------------- Non-analytical term correction (NAC): True NAC unit conversion factor: 14.39965 BZ integration: Tetrahedron-method Temperature: 0.0 10.0 20.0 30.0 40.0 ... 1000.0 Cutoff frequency: 0.01 Frequency conversion factor to THz: 15.63330 Length for sampling mesh generation: 50.00 Generating grid system ... [ 16 5 4 ] 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: 0.56, Number of G-points: 301, Lambda: 0.10 Running harmonic phonon calculations... -------------------- Lattice thermal conductivity (RTA) -------------------- ======================= Grid point 0 (1/102) ======================= q-point: ( 0.00 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 Number of triplets: 102 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| -0.000 ( 0.000 0.000 0.000) 0.000 -0.000 ( 0.000 0.000 0.000) 0.000 0.000 ( 0.000 0.000 0.000) 0.000 2.227 ( 0.000 0.000 0.000) 0.000 2.806 ( 0.000 0.000 0.000) 0.000 3.370 ( 0.000 0.000 0.000) 0.000 3.544 ( 0.000 0.000 0.000) 0.000 3.627 ( 0.000 0.000 0.000) 0.000 3.856 ( 0.000 0.000 0.000) 0.000 4.052 ( 0.000 0.000 0.000) 0.000 4.241 ( 0.000 0.000 0.000) 0.000 4.500 ( 0.000 0.000 0.000) 0.000 4.658 ( 0.000 0.000 0.000) 0.000 4.837 ( 0.000 0.000 0.000) 0.000 4.881 ( 0.000 0.000 0.000) 0.000 4.886 ( 0.000 0.000 0.000) 0.000 5.336 ( 0.000 0.000 0.000) 0.000 5.370 ( 0.000 0.000 0.000) 0.000 5.757 ( 0.000 0.000 0.000) 0.000 6.162 ( 0.000 0.000 0.000) 0.000 6.171 ( 0.000 0.000 0.000) 0.000 6.466 ( 0.000 0.000 0.000) 0.000 6.470 ( 0.000 0.000 0.000) 0.000 6.633 ( 0.000 0.000 0.000) 0.000 6.635 ( 0.000 0.000 0.000) 0.000 6.805 ( 0.000 0.000 0.000) 0.000 6.812 ( 0.000 0.000 0.000) 0.000 6.812 ( 0.000 0.000 0.000) 0.000 6.962 ( 0.000 0.000 0.000) 0.000 7.179 ( 0.000 0.000 0.000) 0.000 7.184 ( 0.000 0.000 0.000) 0.000 7.399 ( 0.000 0.000 0.000) 0.000 7.420 ( 0.000 0.000 0.000) 0.000 7.467 ( 0.000 0.000 0.000) 0.000 7.594 ( 0.000 0.000 0.000) 0.000 7.700 ( 0.000 0.000 0.000) 0.000 7.702 ( 0.000 0.000 0.000) 0.000 7.926 ( 0.000 0.000 0.000) 0.000 7.969 ( 0.000 0.000 0.000) 0.000 8.000 ( 0.000 0.000 0.000) 0.000 8.402 ( 0.000 0.000 0.000) 0.000 8.668 ( 0.000 0.000 0.000) 0.000 8.731 ( 0.000 0.000 0.000) 0.000 8.753 ( 0.000 0.000 0.000) 0.000 8.906 ( 0.000 0.000 0.000) 0.000 9.108 ( 0.000 0.000 0.000) 0.000 9.192 ( 0.000 0.000 0.000) 0.000 9.413 ( 0.000 0.000 0.000) 0.000 9.507 ( 0.000 0.000 0.000) 0.000 9.667 ( 0.000 0.000 0.000) 0.000 9.969 ( 0.000 0.000 0.000) 0.000 10.328 ( 0.000 0.000 0.000) 0.000 10.573 ( 0.000 0.000 0.000) 0.000 10.606 ( 0.000 0.000 0.000) 0.000 11.007 ( 0.000 0.000 0.000) 0.000 11.582 ( 0.000 0.000 0.000) 0.000 11.722 ( 0.000 0.000 0.000) 0.000 11.887 ( 0.000 0.000 0.000) 0.000 11.893 ( 0.000 0.000 0.000) 0.000 11.988 ( 0.000 0.000 0.000) 0.000 12.128 ( 0.000 0.000 0.000) 0.000 12.128 ( 0.000 0.000 0.000) 0.000 12.248 ( 0.000 0.000 0.000) 0.000 12.333 ( 0.000 0.000 0.000) 0.000 12.621 ( 0.000 0.000 0.000) 0.000 12.968 ( 0.000 0.000 0.000) 0.000 13.186 ( 0.000 0.000 0.000) 0.000 13.490 ( 0.000 0.000 0.000) 0.000 14.400 ( 0.000 0.000 0.000) 0.000 14.442 ( 0.000 0.000 0.000) 0.000 14.442 ( 0.000 0.000 0.000) 0.000 14.567 ( 0.000 0.000 0.000) 0.000 14.634 ( 0.000 0.000 0.000) 0.000 14.891 ( 0.000 0.000 0.000) 0.000 14.974 ( 0.000 0.000 0.000) 0.000 15.144 ( 0.000 0.000 0.000) 0.000 15.539 ( 0.000 0.000 0.000) 0.000 15.688 ( 0.000 0.000 0.000) 0.000 15.882 ( 0.000 0.000 0.000) 0.000 16.528 ( 0.000 0.000 0.000) 0.000 17.709 ( 0.000 0.000 0.000) 0.000 18.048 ( 0.000 0.000 0.000) 0.000 18.193 ( 0.000 0.000 0.000) 0.000 18.229 ( 0.000 0.000 0.000) 0.000 18.728 ( 0.000 0.000 0.000) 0.000 18.776 ( 0.000 0.000 0.000) 0.000 19.204 ( 0.000 0.000 0.000) 0.000 19.333 ( 0.000 0.000 0.000) 0.000 19.570 ( 0.000 0.000 0.000) 0.000 19.625 ( 0.000 0.000 0.000) 0.000 19.640 ( 0.000 0.000 0.000) 0.000 19.914 ( 0.000 0.000 0.000) 0.000 20.113 ( 0.000 0.000 0.000) 0.000 20.305 ( 0.000 0.000 0.000) 0.000 20.312 ( 0.000 0.000 0.000) 0.000 20.326 ( 0.000 0.000 0.000) 0.000 20.415 ( 0.000 0.000 0.000) 0.000 20.416 ( 0.000 0.000 0.000) 0.000 20.419 ( 0.000 0.000 0.000) 0.000 20.539 ( 0.000 0.000 0.000) 0.000 24.434 ( 0.000 0.000 0.000) 0.000 24.549 ( 0.000 0.000 0.000) 0.000 24.553 ( 0.000 0.000 0.000) 0.000 24.649 ( 0.000 0.000 0.000) 0.000 28.503 ( 0.000 0.000 0.000) 0.000 28.516 ( 0.000 0.000 0.000) 0.000 29.014 ( 0.000 0.000 0.000) 0.000 29.385 ( 0.000 0.000 0.000) 0.000 29.411 ( 0.000 0.000 0.000) 0.000 29.557 ( 0.000 0.000 0.000) 0.000 29.602 ( 0.000 0.000 0.000) 0.000 29.653 ( 0.000 0.000 0.000) 0.000 32.914 ( 0.000 0.000 0.000) 0.000 32.986 ( 0.000 0.000 0.000) 0.000 32.999 ( 0.000 0.000 0.000) 0.000 33.092 ( 0.000 0.000 0.000) 0.000 35.846 ( 0.000 0.000 0.000) 0.000 36.122 ( 0.000 0.000 0.000) 0.000 36.942 ( 0.000 0.000 0.000) 0.000 38.025 ( 0.000 0.000 0.000) 0.000 38.160 ( 0.000 0.000 0.000) 0.000 38.578 ( 0.000 0.000 0.000) 0.000 38.743 ( 0.000 0.000 0.000) 0.000 39.179 ( 0.000 0.000 0.000) 0.000 39.392 ( 0.000 0.000 0.000) 0.000 39.590 ( 0.000 0.000 0.000) 0.000 39.936 ( 0.000 0.000 0.000) 0.000 39.949 ( 0.000 0.000 0.000) 0.000 40.662 ( 0.000 0.000 0.000) 0.000 42.165 ( 0.000 0.000 0.000) 0.000 42.223 ( 0.000 0.000 0.000) 0.000 43.489 ( 0.000 0.000 0.000) 0.000 43.519 ( 0.000 0.000 0.000) 0.000 44.687 ( 0.000 0.000 0.000) 0.000 45.326 ( 0.000 0.000 0.000) 0.000 45.669 ( 0.000 0.000 0.000) 0.000 70.087 ( 0.000 0.000 0.000) 0.000 70.811 ( 0.000 0.000 0.000) 0.000 72.027 ( 0.000 0.000 0.000) 0.000 72.539 ( 0.000 0.000 0.000) 0.000 105.218 ( 0.000 0.000 0.000) 0.000 105.307 ( 0.000 0.000 0.000) 0.000 105.415 ( 0.000 0.000 0.000) 0.000 105.673 ( 0.000 0.000 0.000) 0.000 ======================= Grid point 1 (2/102) ======================= q-point: ( 0.06 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 Number of triplets: 96 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.658 ( 31.478 0.000 19.645) 37.105 0.726 ( 36.844 0.000 3.719) 37.031 1.423 ( 68.878 0.000 6.259) 69.162 2.640 ( 37.963 0.000 -7.144) 38.630 3.038 ( 21.069 0.000 -0.685) 21.080 3.520 ( 13.850 0.000 6.370) 15.245 3.659 ( 11.826 0.000 -5.954) 13.240 3.841 ( 17.031 0.000 0.362) 17.034 4.055 ( 15.355 0.000 -2.385) 15.540 4.135 ( 7.781 0.000 -2.425) 8.150 4.362 ( 10.222 0.000 6.282) 11.998 4.653 ( 13.725 0.000 0.443) 13.732 4.894 ( 8.062 0.000 -1.740) 8.247 4.910 ( 6.906 0.000 7.950) 10.531 4.929 ( 5.398 0.000 -2.803) 6.082 5.042 ( 15.439 0.000 7.571) 17.195 5.554 ( 20.465 0.000 0.883) 20.484 5.580 ( 19.491 0.000 2.247) 19.620 5.778 ( 3.635 0.000 -8.895) 9.609 6.184 ( 2.602 0.000 -3.263) 4.174 6.190 ( 1.715 0.000 1.905) 2.563 6.460 ( -0.450 0.000 4.961) 4.981 6.462 ( -0.086 0.000 2.846) 2.847 6.728 ( 0.630 0.000 4.326) 4.371 6.809 ( 6.730 0.000 -7.281) 9.915 6.832 ( 6.692 0.000 1.316) 6.821 6.848 ( 6.730 0.000 -9.340) 11.512 6.988 ( 2.942 0.000 5.541) 6.274 7.060 ( 9.558 0.000 -10.015) 13.844 7.209 ( 3.374 0.000 -0.735) 3.453 7.215 ( 2.690 0.000 7.055) 7.550 7.451 ( 4.930 0.000 0.415) 4.948 7.533 ( 10.811 0.000 -9.641) 14.486 7.540 ( 8.124 0.000 -4.560) 9.316 7.668 ( 6.031 0.000 3.016) 6.743 7.787 ( 7.476 0.000 5.703) 9.403 7.920 ( 3.434 0.000 -15.131) 15.516 7.933 ( 10.395 0.000 1.378) 10.486 8.019 ( 3.480 0.000 11.498) 12.013 8.026 ( 3.059 0.000 4.978) 5.843 8.367 ( -3.381 0.000 -2.344) 4.114 8.677 ( -0.311 0.000 0.051) 0.315 8.754 ( -0.245 0.000 2.095) 2.109 9.014 ( 1.084 0.000 11.527) 11.578 9.032 ( -1.381 0.000 -2.892) 3.205 9.183 ( -0.245 0.000 0.670) 0.714 9.191 ( 11.402 0.000 -12.298) 16.771 9.583 ( 8.160 0.000 6.202) 10.249 9.626 ( -4.032 0.000 7.734) 8.722 9.819 ( 6.802 0.000 -17.367) 18.652 10.025 ( 1.470 0.000 -47.180) 47.203 10.370 ( 3.626 0.000 -0.213) 3.632 10.543 ( -3.367 0.000 -0.263) 3.377 10.641 ( -1.608 0.000 10.681) 10.801 10.949 ( -5.303 0.000 1.658) 5.556 11.564 ( -4.010 0.000 7.146) 8.194 11.618 ( -5.596 0.000 -11.892) 13.143 11.778 ( -5.631 0.000 -12.273) 13.503 11.923 ( -5.047 0.000 11.489) 12.549 12.006 ( 2.242 0.000 17.355) 17.499 12.234 ( 7.292 0.000 -4.456) 8.545 12.353 ( 1.835 0.000 0.418) 1.882 12.403 ( 12.161 0.000 -4.006) 12.804 12.651 ( 4.101 0.000 7.009) 8.121 12.872 ( -1.512 0.000 23.911) 23.959 13.099 ( -0.817 0.000 -11.279) 11.308 13.229 ( 7.499 0.000 -16.154) 17.810 13.423 ( -6.353 0.000 -0.624) 6.383 14.385 ( -2.136 0.000 3.315) 3.943 14.417 ( -2.288 0.000 0.955) 2.479 14.435 ( -0.473 0.000 -2.251) 2.300 14.617 ( -0.776 0.000 8.185) 8.222 14.642 ( -0.158 0.000 4.954) 4.956 14.872 ( -1.669 0.000 0.566) 1.762 14.958 ( -1.506 0.000 -0.212) 1.521 15.116 ( -1.711 0.000 -9.739) 9.889 15.505 ( -3.558 0.000 2.723) 4.480 15.649 ( -3.919 0.000 1.562) 4.219 15.922 ( -5.942 0.000 12.104) 13.484 16.330 ( -16.669 0.000 -2.996) 16.936 17.764 ( 3.596 0.000 4.395) 5.679 18.259 ( 2.234 0.000 -1.741) 2.832 18.261 ( 5.593 0.000 1.650) 5.831 18.611 ( -4.302 0.000 -7.382) 8.544 18.708 ( -1.495 0.000 -1.063) 1.834 18.929 ( 0.539 0.000 -14.293) 14.304 19.253 ( 4.417 0.000 2.327) 4.992 19.373 ( 4.014 0.000 -2.183) 4.570 19.537 ( -5.662 0.000 7.566) 9.450 19.558 ( -1.367 0.000 -3.390) 3.655 19.731 ( 5.832 0.000 -5.814) 8.235 19.980 ( -2.787 0.000 4.348) 5.165 20.211 ( 6.398 0.000 0.129) 6.399 20.311 ( 4.185 0.000 2.878) 5.079 20.361 ( 6.694 0.000 -2.639) 7.195 20.423 ( 4.332 0.000 1.715) 4.660 20.525 ( 15.447 0.000 -4.435) 16.071 20.624 ( 16.350 0.000 4.799) 17.040 20.772 ( 19.283 0.000 -6.731) 20.424 22.778 ( -1.350 0.000 9.351) 9.448 24.423 ( -0.962 0.000 -0.496) 1.083 24.541 ( -1.140 0.000 -0.331) 1.187 24.553 ( 0.277 0.000 0.539) 0.606 24.619 ( -2.799 0.000 -0.469) 2.838 28.516 ( 1.201 0.000 0.554) 1.322 28.525 ( 0.991 0.000 -0.625) 1.171 29.028 ( -0.580 0.000 6.497) 6.523 29.392 ( -1.773 0.000 -0.682) 1.900 29.395 ( -0.659 0.000 -6.222) 6.257 29.543 ( -1.139 0.000 -0.117) 1.145 29.602 ( -0.244 0.000 0.516) 0.571 29.643 ( -0.990 0.000 -0.165) 1.004 32.947 ( 3.193 0.000 0.013) 3.193 33.014 ( 2.776 0.000 -0.170) 2.781 33.142 ( 4.846 0.000 -0.111) 4.847 33.371 ( 2.235 0.000 0.684) 2.337 35.835 ( -0.976 0.000 -0.767) 1.241 36.085 ( -3.548 0.000 0.168) 3.552 36.898 ( -4.083 0.000 -2.377) 4.725 37.972 ( -5.130 0.000 0.755) 5.186 38.149 ( -1.429 0.000 2.656) 3.016 38.578 ( -14.714 0.000 -2.486) 14.923 38.990 ( 2.379 0.000 -35.994) 36.073 39.181 ( -0.602 0.000 6.195) 6.224 39.432 ( 2.390 0.000 1.978) 3.102 39.520 ( -6.689 0.000 -5.490) 8.654 39.916 ( -3.173 0.000 -0.470) 3.208 39.948 ( 0.223 0.000 1.979) 1.992 40.627 ( -3.288 0.000 -2.141) 3.923 42.076 ( -10.487 0.000 14.805) 18.143 42.237 ( -10.036 0.000 -0.663) 10.058 43.334 ( -14.923 0.000 -0.610) 14.935 43.549 ( -6.329 0.000 31.264) 31.898 44.631 ( -5.642 0.000 2.538) 6.187 45.250 ( -7.301 0.000 -1.077) 7.380 45.484 ( -17.334 0.000 -2.302) 17.486 70.050 ( -3.823 0.000 1.036) 3.961 70.730 ( -7.698 0.000 -2.581) 8.119 72.097 ( -10.358 0.000 -55.375) 56.336 72.359 ( -18.559 0.000 10.342) 21.246 105.209 ( -1.039 0.000 1.138) 1.541 105.373 ( -3.308 0.000 15.035) 15.395 105.391 ( -2.164 0.000 -1.239) 2.494 105.621 ( -4.770 0.000 -1.692) 5.061 ======================= Grid point 2 (3/102) ======================= q-point: ( 0.12 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 Number of triplets: 102 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.349 ( 33.350 0.000 18.999) 38.382 1.500 ( 39.607 0.000 3.659) 39.776 2.749 ( 61.243 0.000 5.644) 61.503 3.505 ( 37.447 0.000 -18.270) 41.666 3.554 ( 37.303 0.000 1.920) 37.352 3.922 ( 23.223 0.000 14.629) 27.446 3.960 ( 18.783 0.000 -8.671) 20.688 4.164 ( 16.811 0.000 -3.423) 17.156 4.326 ( 11.684 0.000 -2.779) 12.010 4.565 ( 29.796 0.000 0.976) 29.812 4.621 ( 14.256 0.000 11.229) 18.147 4.905 ( 8.217 0.000 6.904) 10.732 5.076 ( 10.850 0.000 -4.793) 11.862 5.200 ( 24.055 0.000 -9.661) 25.923 5.206 ( 21.125 0.000 4.055) 21.511 5.489 ( 24.619 0.000 11.882) 27.337 5.834 ( 7.963 0.000 -10.865) 13.471 6.057 ( 22.261 0.000 6.784) 23.272 6.126 ( 28.933 0.000 -0.310) 28.935 6.259 ( 5.160 0.000 0.253) 5.166 6.269 ( 7.717 0.000 -4.736) 9.054 6.494 ( 4.328 0.000 5.165) 6.739 6.521 ( 8.164 0.000 -1.044) 8.231 6.707 ( -1.223 0.000 4.577) 4.737 6.886 ( 4.317 0.000 -4.672) 6.361 6.886 ( 5.503 0.000 -18.584) 19.381 7.052 ( -0.423 0.000 5.601) 5.617 7.120 ( 12.051 0.000 -6.452) 13.670 7.261 ( 13.960 0.000 -5.926) 15.166 7.367 ( 10.508 0.000 8.043) 13.233 7.421 ( 15.618 0.000 1.076) 15.655 7.568 ( 7.253 0.000 4.276) 8.419 7.726 ( 8.524 0.000 -12.955) 15.508 7.792 ( 18.170 0.000 -5.239) 18.910 7.831 ( 12.243 0.000 -0.548) 12.255 7.993 ( 11.688 0.000 3.249) 12.131 8.065 ( 9.349 0.000 0.374) 9.357 8.132 ( 9.273 0.000 8.940) 12.881 8.172 ( 10.292 0.000 -3.320) 10.814 8.249 ( 16.560 0.000 5.830) 17.556 8.305 ( 2.642 0.000 -0.283) 2.657 8.745 ( -1.078 0.000 2.680) 2.888 8.764 ( 8.753 0.000 -0.909) 8.800 8.962 ( -4.783 0.000 0.022) 4.783 9.025 ( -0.099 0.000 8.467) 8.468 9.201 ( 1.243 0.000 4.200) 4.380 9.362 ( 6.416 0.000 -10.540) 12.339 9.556 ( -3.464 0.000 1.464) 3.760 9.895 ( 19.543 0.000 11.440) 22.645 9.926 ( 0.326 0.000 -3.864) 3.877 9.954 ( 4.898 0.000 -28.204) 28.626 10.412 ( -9.653 0.000 -2.892) 10.077 10.439 ( 2.231 0.000 2.248) 3.167 10.658 ( 2.755 0.000 2.461) 3.694 10.837 ( -5.766 0.000 3.139) 6.565 11.391 ( -9.837 0.000 -1.488) 9.949 11.564 ( -1.037 0.000 -3.886) 4.022 11.628 ( -6.081 0.000 -15.969) 17.088 11.862 ( -3.744 0.000 13.847) 14.344 12.070 ( 0.994 0.000 14.202) 14.237 12.337 ( 2.745 0.000 -2.358) 3.619 12.377 ( -0.904 0.000 2.824) 2.965 12.553 ( 4.436 0.000 0.660) 4.485 12.915 ( 18.899 0.000 1.096) 18.930 12.924 ( 4.970 0.000 -0.320) 4.980 13.013 ( -6.518 0.000 3.428) 7.364 13.252 ( -9.896 0.000 0.123) 9.896 13.411 ( 12.079 0.000 -8.093) 14.540 14.342 ( -2.490 0.000 0.807) 2.618 14.366 ( -2.844 0.000 1.351) 3.148 14.418 ( -0.499 0.000 -2.822) 2.866 14.622 ( -0.057 0.000 4.843) 4.843 14.630 ( -2.894 0.000 10.178) 10.582 14.842 ( -0.698 0.000 -3.005) 3.085 14.914 ( -2.830 0.000 -0.400) 2.859 15.041 ( -3.002 0.000 -13.929) 14.249 15.411 ( -6.510 0.000 5.117) 8.281 15.542 ( -7.100 0.000 2.947) 7.688 15.797 ( -8.225 0.000 8.062) 11.517 15.966 ( -16.577 0.000 -6.632) 17.854 17.821 ( 0.405 0.000 6.207) 6.220 18.237 ( -5.014 0.000 -4.711) 6.880 18.388 ( 6.094 0.000 1.606) 6.302 18.562 ( 1.856 0.000 -2.456) 3.079 18.680 ( -0.978 0.000 -0.629) 1.163 18.906 ( -0.715 0.000 -5.492) 5.539 19.377 ( 5.740 0.000 3.470) 6.708 19.447 ( -3.184 0.000 6.251) 7.015 19.467 ( 3.029 0.000 -3.109) 4.341 19.505 ( 0.173 0.000 -5.055) 5.058 19.841 ( 6.238 0.000 -4.554) 7.723 19.994 ( 2.760 0.000 4.042) 4.895 20.380 ( 10.915 0.000 -1.732) 11.052 20.486 ( 12.110 0.000 3.923) 12.729 20.551 ( 12.258 0.000 -3.285) 12.690 20.597 ( 11.746 0.000 3.272) 12.193 20.893 ( 21.442 0.000 -4.763) 21.964 21.012 ( 20.333 0.000 5.420) 21.043 21.214 ( 25.499 0.000 -8.619) 26.917 22.770 ( -0.869 0.000 4.931) 5.007 24.401 ( -0.941 0.000 -0.719) 1.185 24.507 ( -2.199 0.000 -0.991) 2.412 24.547 ( -3.789 0.000 -0.198) 3.794 24.561 ( 0.425 0.000 0.229) 0.483 28.552 ( 1.888 0.000 -1.045) 2.158 28.553 ( 2.324 0.000 0.983) 2.523 29.032 ( -0.245 0.000 4.321) 4.328 29.341 ( -3.076 0.000 -1.084) 3.261 29.358 ( -2.054 0.000 -2.810) 3.480 29.517 ( -1.413 0.000 0.029) 1.414 29.590 ( -1.046 0.000 0.437) 1.134 29.614 ( -1.858 0.000 -0.293) 1.881 33.038 ( 5.816 0.000 0.068) 5.816 33.093 ( 5.061 0.000 -0.281) 5.069 33.273 ( 7.828 0.000 -0.118) 7.829 33.437 ( 4.145 0.000 0.558) 4.182 35.805 ( -1.708 0.000 -1.428) 2.226 35.993 ( -5.259 0.000 0.580) 5.291 36.777 ( -7.319 0.000 -2.044) 7.599 37.832 ( -9.619 0.000 4.474) 10.609 38.111 ( -3.156 0.000 3.939) 5.047 38.214 ( -18.840 0.000 -6.242) 19.847 38.950 ( -0.723 0.000 -16.665) 16.681 39.169 ( -2.531 0.000 9.794) 10.116 39.346 ( -9.046 0.000 -4.138) 9.947 39.455 ( -0.742 0.000 0.551) 0.924 39.825 ( -5.829 0.000 0.396) 5.843 39.930 ( -2.688 0.000 1.591) 3.123 40.527 ( -5.830 0.000 -3.983) 7.061 41.806 ( -20.434 0.000 26.224) 33.245 41.977 ( -13.017 0.000 -18.166) 22.348 42.921 ( -25.185 0.000 -0.208) 25.186 43.463 ( -6.840 0.000 13.986) 15.569 44.481 ( -9.638 0.000 2.152) 9.875 45.026 ( -26.080 0.000 -3.259) 26.283 45.042 ( -12.752 0.000 -1.748) 12.871 69.941 ( -7.223 0.000 1.904) 7.469 70.507 ( -13.284 0.000 -4.249) 13.946 71.657 ( -23.999 0.000 -23.938) 33.897 71.879 ( -30.650 0.000 13.785) 33.607 105.181 ( -2.016 0.000 1.934) 2.793 105.324 ( -3.814 0.000 6.888) 7.874 105.328 ( -3.610 0.000 -2.087) 4.170 105.491 ( -7.308 0.000 -2.539) 7.736 ======================= Grid point 3 (4/102) ======================= q-point: ( 0.19 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 Number of triplets: 96 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.067 ( 34.338 0.000 17.917) 38.731 2.319 ( 41.132 0.000 3.192) 41.255 3.850 ( 46.556 0.000 3.837) 46.714 4.016 ( 23.611 0.000 -6.007) 24.363 4.317 ( 28.069 0.000 -10.307) 29.902 4.341 ( 21.036 0.000 -12.617) 24.530 4.471 ( 20.580 0.000 11.280) 23.468 4.528 ( 19.267 0.000 -0.214) 19.268 4.672 ( 31.032 0.000 0.377) 31.034 4.891 ( 12.712 0.000 16.748) 21.026 5.086 ( 10.394 0.000 3.042) 10.830 5.188 ( 27.498 0.000 -8.936) 28.913 5.288 ( 12.370 0.000 1.932) 12.520 5.664 ( 18.019 0.000 0.167) 18.020 5.735 ( 27.677 0.000 3.206) 27.862 5.994 ( 24.215 0.000 4.114) 24.562 6.037 ( 15.113 0.000 -10.914) 18.642 6.291 ( 2.550 0.000 13.631) 13.867 6.371 ( 6.959 0.000 -2.945) 7.556 6.427 ( 3.217 0.000 7.528) 8.186 6.496 ( 11.802 0.000 -2.517) 12.068 6.740 ( 4.591 0.000 1.827) 4.941 6.769 ( 12.209 0.000 -8.478) 14.864 6.820 ( 16.605 0.000 -10.860) 19.841 7.016 ( 0.600 0.000 -18.925) 18.935 7.072 ( 17.487 0.000 -1.081) 17.521 7.154 ( 28.731 0.000 0.120) 28.731 7.321 ( 8.825 0.000 -1.526) 8.956 7.514 ( 6.380 0.000 10.515) 12.300 7.539 ( 12.376 0.000 3.239) 12.793 7.798 ( 22.139 0.000 1.889) 22.220 7.802 ( 13.483 0.000 -5.328) 14.498 7.871 ( 8.697 0.000 -7.810) 11.689 8.021 ( -3.319 0.000 4.167) 5.328 8.159 ( 14.183 0.000 -0.779) 14.204 8.246 ( 23.346 0.000 0.365) 23.349 8.282 ( 18.217 0.000 -4.025) 18.656 8.357 ( 7.981 0.000 11.681) 14.147 8.443 ( 16.766 0.000 -7.434) 18.341 8.585 ( 12.246 0.000 3.611) 12.768 8.618 ( 22.363 0.000 2.724) 22.529 8.769 ( 5.892 0.000 4.047) 7.148 8.897 ( 1.573 0.000 2.896) 3.296 8.966 ( 8.696 0.000 -3.564) 9.398 9.122 ( 11.379 0.000 6.557) 13.133 9.246 ( 2.656 0.000 6.042) 6.600 9.423 ( 2.129 0.000 -8.144) 8.417 9.520 ( 0.863 0.000 -2.613) 2.752 9.816 ( -6.160 0.000 -8.293) 10.330 10.072 ( 5.954 0.000 -10.529) 12.096 10.100 ( -13.573 0.000 2.423) 13.788 10.379 ( 18.242 0.000 7.168) 19.600 10.484 ( 3.328 0.000 2.149) 3.962 10.726 ( -6.095 0.000 0.676) 6.132 10.761 ( 6.247 0.000 2.284) 6.651 11.237 ( -3.908 0.000 -4.500) 5.960 11.484 ( -4.106 0.000 -18.289) 18.744 11.538 ( -0.845 0.000 -0.296) 0.895 11.829 ( -2.741 0.000 15.341) 15.584 12.112 ( 0.706 0.000 10.238) 10.262 12.319 ( -4.709 0.000 2.918) 5.540 12.341 ( -1.136 0.000 0.258) 1.165 12.614 ( 0.050 0.000 -0.959) 0.961 12.854 ( -8.898 0.000 3.202) 9.457 13.065 ( -6.408 0.000 1.445) 6.568 13.080 ( 9.389 0.000 -4.072) 10.234 13.305 ( 17.900 0.000 -2.026) 18.014 13.638 ( 10.884 0.000 -3.107) 11.318 14.290 ( -2.693 0.000 -0.340) 2.714 14.311 ( -2.894 0.000 1.355) 3.196 14.414 ( 0.903 0.000 -2.470) 2.630 14.576 ( -4.087 0.000 9.682) 10.510 14.638 ( 0.894 0.000 3.299) 3.418 14.832 ( 0.151 0.000 -4.108) 4.111 14.846 ( -3.717 0.000 -0.341) 3.733 14.948 ( -3.364 0.000 -12.495) 12.940 15.275 ( -8.051 0.000 6.824) 10.554 15.389 ( -8.158 0.000 1.941) 8.386 15.643 ( -8.258 0.000 6.535) 10.531 15.679 ( -10.457 0.000 -7.787) 13.038 17.810 ( -2.290 0.000 5.548) 6.002 18.086 ( -7.503 0.000 -4.906) 8.964 18.490 ( 3.421 0.000 1.405) 3.699 18.627 ( 3.591 0.000 -1.393) 3.851 18.667 ( -0.175 0.000 0.020) 0.176 18.878 ( -1.213 0.000 -2.474) 2.755 19.334 ( -5.154 0.000 4.899) 7.111 19.395 ( -4.334 0.000 -4.500) 6.248 19.591 ( 10.448 0.000 3.506) 11.021 19.642 ( 9.366 0.000 -3.499) 9.998 19.962 ( 6.697 0.000 -3.559) 7.584 20.079 ( 4.409 0.000 3.242) 5.473 20.636 ( 14.775 0.000 -2.862) 15.050 20.783 ( 16.053 0.000 3.940) 16.529 20.818 ( 14.795 0.000 -3.721) 15.256 20.879 ( 14.954 0.000 4.745) 15.689 21.333 ( 22.788 0.000 -4.286) 23.187 21.431 ( 19.845 0.000 5.120) 20.495 21.721 ( 26.055 0.000 -6.950) 26.966 22.767 ( -0.222 0.000 3.631) 3.638 24.389 ( 0.018 0.000 -0.510) 0.510 24.440 ( -3.903 0.000 -1.680) 4.249 24.491 ( -1.840 0.000 0.662) 1.955 24.571 ( 0.662 0.000 -0.481) 0.818 28.596 ( 2.687 0.000 -1.142) 2.920 28.612 ( 3.267 0.000 1.193) 3.478 29.036 ( -0.246 0.000 3.747) 3.755 29.269 ( -3.751 0.000 -1.268) 3.960 29.305 ( -2.670 0.000 -1.761) 3.198 29.489 ( -1.322 0.000 0.188) 1.335 29.562 ( -1.763 0.000 0.201) 1.774 29.569 ( -2.513 0.000 -0.390) 2.543 33.173 ( 7.354 0.000 0.127) 7.355 33.210 ( 6.440 0.000 -0.302) 6.447 33.441 ( 8.678 0.000 -0.053) 8.678 33.534 ( 5.308 0.000 0.470) 5.329 35.764 ( -1.937 0.000 -1.892) 2.708 35.891 ( -4.856 0.000 1.110) 4.981 36.607 ( -8.925 0.000 -1.468) 9.045 37.558 ( -19.528 0.000 6.090) 20.456 37.894 ( -10.048 0.000 -7.019) 12.257 38.037 ( -5.053 0.000 3.332) 6.053 38.895 ( -1.901 0.000 -9.934) 10.114 39.118 ( -4.625 0.000 9.588) 10.645 39.162 ( -8.253 0.000 -1.991) 8.490 39.404 ( -3.909 0.000 -2.431) 4.603 39.688 ( -7.955 0.000 2.580) 8.363 39.844 ( -6.049 0.000 0.191) 6.052 40.388 ( -6.669 0.000 -5.264) 8.496 41.404 ( -23.829 0.000 23.087) 33.178 41.655 ( -15.227 0.000 -17.230) 22.994 42.365 ( -29.527 0.000 0.652) 29.535 43.340 ( -7.590 0.000 8.364) 11.294 44.261 ( -12.375 0.000 -3.901) 12.975 44.494 ( -25.065 0.000 1.503) 25.110 44.752 ( -15.337 0.000 -1.965) 15.463 69.775 ( -9.605 0.000 2.452) 9.913 70.201 ( -15.866 0.000 -4.865) 16.595 71.086 ( -28.073 0.000 -12.378) 30.680 71.245 ( -34.057 0.000 11.541) 35.959 105.137 ( -2.731 0.000 2.242) 3.533 105.244 ( -4.252 0.000 -2.438) 4.902 105.253 ( -4.285 0.000 3.988) 5.853 105.333 ( -7.601 0.000 -2.423) 7.978 ======================= Grid point 4 (5/102) ======================= q-point: ( 0.25 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 Number of triplets: 102 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.791 ( 34.094 0.000 16.490) 37.872 3.145 ( 40.409 0.000 2.230) 40.471 4.436 ( 19.428 0.000 -5.881) 20.298 4.615 ( 29.944 0.000 -0.856) 29.956 4.727 ( 18.536 0.000 -5.511) 19.338 4.745 ( 16.256 0.000 -0.232) 16.258 4.772 ( 13.343 0.000 2.330) 13.545 4.913 ( 19.962 0.000 -4.510) 20.466 5.194 ( 13.809 0.000 17.371) 22.191 5.208 ( 14.474 0.000 -3.648) 14.927 5.438 ( 9.563 0.000 -7.522) 12.167 5.481 ( 28.977 0.000 -0.361) 28.979 5.773 ( 24.421 0.000 3.737) 24.705 5.892 ( 6.222 0.000 7.729) 9.922 6.156 ( 12.035 0.000 -1.249) 12.100 6.298 ( 2.459 0.000 4.684) 5.290 6.315 ( 9.361 0.000 -2.007) 9.573 6.453 ( 5.679 0.000 -2.056) 6.040 6.467 ( 12.674 0.000 7.902) 14.935 6.627 ( 12.587 0.000 0.571) 12.600 6.701 ( 11.209 0.000 1.182) 11.272 6.875 ( 8.383 0.000 -3.456) 9.067 6.889 ( 5.478 0.000 -7.090) 8.959 7.056 ( 11.475 0.000 -10.970) 15.875 7.109 ( 18.279 0.000 -24.332) 30.433 7.387 ( 1.287 0.000 4.037) 4.237 7.467 ( 13.408 0.000 3.886) 13.960 7.731 ( 5.368 0.000 -2.034) 5.741 7.738 ( 9.209 0.000 5.146) 10.549 7.816 ( 29.775 0.000 3.704) 30.004 7.922 ( 2.441 0.000 1.526) 2.879 8.070 ( 10.493 0.000 1.456) 10.594 8.214 ( 26.321 0.000 -8.559) 27.677 8.231 ( 13.517 0.000 0.696) 13.535 8.331 ( 8.179 0.000 -2.672) 8.604 8.424 ( 1.664 0.000 12.409) 12.520 8.586 ( 4.947 0.000 4.824) 6.909 8.673 ( 14.497 0.000 1.288) 14.554 8.709 ( 7.321 0.000 1.454) 7.464 8.807 ( 18.080 0.000 -4.825) 18.712 9.001 ( 13.611 0.000 5.745) 14.774 9.055 ( 19.240 0.000 -5.190) 19.928 9.182 ( 21.587 0.000 4.744) 22.102 9.191 ( 19.362 0.000 7.100) 20.623 9.356 ( 1.324 0.000 -13.741) 13.805 9.367 ( 8.708 0.000 0.765) 8.741 9.496 ( 11.080 0.000 7.778) 13.537 9.602 ( 3.620 0.000 -1.413) 3.886 9.680 ( -0.048 0.000 -7.311) 7.312 9.822 ( -8.306 0.000 -2.419) 8.651 10.114 ( 0.882 0.000 -8.133) 8.180 10.608 ( -4.049 0.000 -3.823) 5.569 10.616 ( 8.518 0.000 4.163) 9.481 10.746 ( 14.002 0.000 11.384) 18.046 10.895 ( 6.701 0.000 3.773) 7.690 11.229 ( 3.785 0.000 -5.858) 6.975 11.407 ( 0.637 0.000 -18.345) 18.356 11.546 ( 2.048 0.000 2.418) 3.169 11.814 ( -1.883 0.000 14.494) 14.616 12.134 ( -0.191 0.000 4.505) 4.509 12.245 ( -2.279 0.000 2.209) 3.174 12.322 ( -0.626 0.000 1.588) 1.707 12.529 ( -6.113 0.000 -2.617) 6.649 12.695 ( -6.805 0.000 3.851) 7.819 13.015 ( -0.338 0.000 3.228) 3.246 13.247 ( 7.418 0.000 -4.402) 8.626 13.605 ( 12.246 0.000 -4.529) 13.057 13.803 ( 5.438 0.000 -0.886) 5.510 14.235 ( -2.613 0.000 -0.426) 2.647 14.254 ( -3.279 0.000 1.611) 3.653 14.445 ( 2.624 0.000 -2.432) 3.578 14.526 ( -2.148 0.000 5.641) 6.036 14.674 ( 2.033 0.000 2.626) 3.321 14.769 ( -3.853 0.000 0.114) 3.855 14.824 ( -0.312 0.000 -1.926) 1.951 14.856 ( -3.447 0.000 -9.620) 10.219 15.129 ( -7.748 0.000 7.335) 10.669 15.247 ( -5.625 0.000 -2.307) 6.080 15.503 ( -6.216 0.000 -4.494) 7.671 15.506 ( -6.428 0.000 4.773) 8.006 17.768 ( -2.623 0.000 4.451) 5.166 17.944 ( -5.537 0.000 -4.158) 6.925 18.528 ( 0.283 0.000 1.281) 1.312 18.674 ( 1.212 0.000 -1.434) 1.878 18.675 ( 0.904 0.000 -0.176) 0.921 18.850 ( -1.121 0.000 -0.659) 1.301 19.239 ( -5.266 0.000 4.166) 6.715 19.299 ( -4.298 0.000 -4.063) 5.914 19.811 ( 10.281 0.000 2.741) 10.640 19.832 ( 9.895 0.000 -2.860) 10.300 20.091 ( 6.591 0.000 -2.418) 7.020 20.169 ( 3.813 0.000 2.266) 4.435 20.944 ( 16.201 0.000 -3.304) 16.535 21.114 ( 15.218 0.000 -3.661) 15.652 21.121 ( 16.496 0.000 3.165) 16.797 21.196 ( 15.278 0.000 4.789) 16.011 21.764 ( 20.589 0.000 -3.435) 20.873 21.812 ( 16.883 0.000 4.325) 17.428 22.205 ( 22.954 0.000 -4.348) 23.362 22.778 ( 0.541 0.000 3.035) 3.083 24.363 ( -3.209 0.000 -1.365) 3.488 24.402 ( 1.427 0.000 -0.308) 1.460 24.468 ( -0.735 0.000 0.920) 1.178 24.586 ( 0.983 0.000 -1.051) 1.440 28.655 ( 3.374 0.000 -0.954) 3.506 28.687 ( 3.916 0.000 1.163) 4.085 29.034 ( -0.779 0.000 3.272) 3.363 29.189 ( -3.835 0.000 -1.304) 4.051 29.249 ( -2.370 0.000 -1.343) 2.724 29.466 ( -1.041 0.000 0.251) 1.070 29.513 ( -2.907 0.000 -0.483) 2.947 29.522 ( -2.269 0.000 0.118) 2.272 33.324 ( 7.536 0.000 0.146) 7.537 33.342 ( 6.649 0.000 -0.239) 6.653 33.610 ( 8.064 0.000 0.012) 8.064 33.646 ( 5.574 0.000 0.311) 5.583 35.724 ( -1.433 0.000 -2.113) 2.553 35.812 ( -3.099 0.000 1.510) 3.447 36.423 ( -9.045 0.000 -0.628) 9.067 37.140 ( -21.315 0.000 1.938) 21.402 37.748 ( -4.751 0.000 -1.908) 5.120 37.925 ( -6.501 0.000 1.425) 6.656 38.837 ( -2.002 0.000 -6.450) 6.754 39.018 ( -5.758 0.000 0.618) 5.791 39.030 ( -5.675 0.000 7.335) 9.274 39.298 ( -5.747 0.000 -5.340) 7.845 39.525 ( -8.766 0.000 4.981) 10.082 39.695 ( -8.424 0.000 -1.392) 8.538 40.250 ( -5.707 0.000 -5.834) 8.161 40.980 ( -22.339 0.000 17.889) 28.619 41.309 ( -15.727 0.000 -13.181) 20.520 41.773 ( -29.115 0.000 1.427) 29.150 43.202 ( -7.584 0.000 5.739) 9.511 43.923 ( -18.958 0.000 -11.920) 22.394 44.115 ( -14.025 0.000 9.319) 16.839 44.439 ( -15.114 0.000 -1.893) 15.232 69.577 ( -10.471 0.000 2.587) 10.786 69.872 ( -15.523 0.000 -4.734) 16.229 70.518 ( -25.920 0.000 -6.402) 26.699 70.605 ( -31.035 0.000 7.798) 32.000 105.084 ( -2.971 0.000 2.099) 3.638 105.152 ( -4.357 0.000 -2.525) 5.036 105.173 ( -4.278 0.000 2.522) 4.966 105.185 ( -6.580 0.000 -1.684) 6.792 ======================= Grid point 5 (6/102) ======================= q-point: ( 0.31 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 Number of triplets: 96 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.496 ( 32.874 0.000 14.892) 36.090 3.924 ( 36.334 0.000 0.672) 36.340 4.766 ( 14.909 0.000 -6.367) 16.212 4.960 ( 7.500 0.000 3.185) 8.148 4.997 ( 11.409 0.000 -1.273) 11.480 5.071 ( 13.956 0.000 -0.531) 13.966 5.110 ( 17.646 0.000 1.688) 17.727 5.310 ( 19.952 0.000 -9.531) 22.111 5.434 ( 10.239 0.000 -4.057) 11.013 5.508 ( 13.320 0.000 15.835) 20.692 5.644 ( 13.936 0.000 -6.517) 15.385 5.942 ( 15.038 0.000 -3.855) 15.525 6.007 ( 5.314 0.000 8.038) 9.636 6.170 ( 13.413 0.000 3.360) 13.827 6.254 ( 0.808 0.000 -3.424) 3.518 6.344 ( 1.955 0.000 5.016) 5.384 6.386 ( 1.912 0.000 4.347) 4.749 6.548 ( 1.199 0.000 2.616) 2.878 6.663 ( 6.647 0.000 8.745) 10.984 6.856 ( 12.996 0.000 -26.032) 29.096 6.874 ( 5.053 0.000 0.890) 5.131 7.036 ( 7.556 0.000 -7.578) 10.701 7.078 ( 13.287 0.000 -0.626) 13.301 7.274 ( 10.406 0.000 -7.104) 12.599 7.436 ( 3.503 0.000 3.570) 5.001 7.561 ( -1.466 0.000 9.076) 9.194 7.567 ( 22.050 0.000 -6.624) 23.024 7.708 ( -1.987 0.000 -16.834) 16.950 7.805 ( 0.096 0.000 -0.745) 0.751 8.122 ( 13.181 0.000 8.625) 15.752 8.169 ( 4.600 0.000 10.283) 11.265 8.298 ( -0.975 0.000 1.838) 2.081 8.390 ( 17.737 0.000 -1.768) 17.825 8.467 ( 2.656 0.000 9.527) 9.890 8.593 ( 6.818 0.000 2.025) 7.113 8.616 ( 6.968 0.000 0.200) 6.971 8.660 ( 5.683 0.000 6.095) 8.334 8.877 ( 6.889 0.000 4.163) 8.049 8.881 ( 4.060 0.000 -1.805) 4.443 9.030 ( 11.718 0.000 -7.473) 13.898 9.224 ( -0.492 0.000 -6.469) 6.488 9.254 ( 7.226 0.000 -1.739) 7.432 9.467 ( 4.548 0.000 4.901) 6.686 9.472 ( 13.003 0.000 3.698) 13.519 9.600 ( 10.714 0.000 -10.334) 14.886 9.623 ( 9.494 0.000 -7.666) 12.203 9.648 ( 18.024 0.000 0.133) 18.025 9.688 ( 22.037 0.000 4.613) 22.515 9.924 ( 16.011 0.000 -0.327) 16.015 9.955 ( 13.705 0.000 1.069) 13.747 10.146 ( 6.876 0.000 -7.530) 10.197 10.587 ( 3.501 0.000 -4.014) 5.326 10.778 ( 5.389 0.000 7.768) 9.454 10.984 ( 8.571 0.000 7.267) 11.237 11.073 ( 9.975 0.000 4.131) 10.796 11.318 ( 4.454 0.000 -0.080) 4.455 11.439 ( 6.165 0.000 -14.751) 15.987 11.656 ( 8.457 0.000 -1.149) 8.535 11.811 ( -1.135 0.000 12.328) 12.380 12.161 ( 3.840 0.000 0.308) 3.852 12.246 ( 2.384 0.000 -0.060) 2.385 12.329 ( 1.332 0.000 1.477) 1.989 12.461 ( 1.359 0.000 -0.091) 1.362 12.619 ( -1.644 0.000 3.953) 4.281 13.010 ( -1.216 0.000 2.039) 2.374 13.338 ( 2.201 0.000 -3.299) 3.966 13.764 ( 4.530 0.000 -5.331) 6.996 13.839 ( -1.846 0.000 -0.322) 1.874 14.185 ( -3.922 0.000 2.104) 4.451 14.188 ( -1.993 0.000 0.084) 1.995 14.500 ( 3.096 0.000 -2.609) 4.048 14.520 ( 0.508 0.000 2.572) 2.622 14.697 ( -3.345 0.000 3.329) 4.720 14.729 ( 2.886 0.000 0.559) 2.940 14.767 ( -3.581 0.000 -6.837) 7.718 14.820 ( 0.429 0.000 -1.155) 1.232 15.005 ( -5.960 0.000 6.229) 8.621 15.155 ( -3.040 0.000 -5.316) 6.124 15.397 ( -4.289 0.000 -0.376) 4.305 15.409 ( -4.163 0.000 2.685) 4.954 17.730 ( -1.913 0.000 3.472) 3.964 17.851 ( -3.005 0.000 -3.338) 4.491 18.519 ( -1.187 0.000 1.222) 1.704 18.673 ( -0.747 0.000 -1.383) 1.572 18.701 ( 1.907 0.000 -1.289) 2.301 18.834 ( -0.389 0.000 0.805) 0.894 19.142 ( -5.310 0.000 3.965) 6.626 19.206 ( -4.273 0.000 -3.781) 5.705 19.999 ( 7.859 0.000 1.843) 8.073 20.010 ( 8.047 0.000 -2.086) 8.313 20.209 ( 5.497 0.000 -1.392) 5.671 20.237 ( 2.564 0.000 1.418) 2.930 21.254 ( 15.086 0.000 -3.137) 15.409 21.400 ( 13.762 0.000 -3.050) 14.096 21.441 ( 14.483 0.000 2.676) 14.728 21.498 ( 13.743 0.000 3.498) 14.181 22.118 ( 12.745 0.000 3.217) 13.145 22.128 ( 16.063 0.000 -2.460) 16.250 22.608 ( 17.763 0.000 -2.480) 17.935 22.799 ( 0.918 0.000 2.570) 2.729 24.309 ( -1.968 0.000 -1.009) 2.211 24.443 ( 2.572 0.000 -0.201) 2.580 24.466 ( 0.311 0.000 1.192) 1.232 24.606 ( 1.155 0.000 -1.226) 1.684 28.725 ( 3.763 0.000 -0.640) 3.817 28.771 ( 4.158 0.000 0.967) 4.269 29.015 ( -1.770 0.000 2.473) 3.041 29.113 ( -3.390 0.000 -1.216) 3.602 29.210 ( -1.196 0.000 -0.900) 1.497 29.448 ( -0.916 0.000 0.069) 0.919 29.452 ( -3.016 0.000 -0.575) 3.070 29.475 ( -2.340 0.000 0.342) 2.365 33.466 ( 6.425 0.000 0.115) 6.426 33.467 ( 5.689 0.000 -0.143) 5.691 33.753 ( 4.988 0.000 0.124) 4.990 33.759 ( 6.624 0.000 0.060) 6.624 35.703 ( -0.141 0.000 -2.114) 2.119 35.777 ( -0.727 0.000 1.691) 1.841 36.249 ( -8.227 0.000 0.225) 8.230 36.748 ( -17.707 0.000 -0.016) 17.707 37.675 ( -2.647 0.000 0.772) 2.757 37.790 ( -6.759 0.000 -0.468) 6.776 38.792 ( -1.302 0.000 -4.129) 4.329 38.930 ( -5.375 0.000 4.665) 7.117 38.936 ( -2.866 0.000 2.599) 3.869 39.155 ( -7.112 0.000 -6.389) 9.560 39.377 ( -6.820 0.000 5.911) 9.025 39.512 ( -9.126 0.000 -2.656) 9.504 40.142 ( -3.691 0.000 -5.970) 7.019 40.599 ( -18.690 0.000 13.171) 22.864 40.985 ( -13.875 0.000 -9.239) 16.670 41.225 ( -25.665 0.000 2.125) 25.753 43.068 ( -6.657 0.000 4.133) 7.836 43.544 ( -15.940 0.000 -7.486) 17.611 43.896 ( -10.062 0.000 5.364) 11.402 44.153 ( -12.770 0.000 -1.652) 12.876 69.377 ( -9.722 0.000 2.314) 9.993 69.575 ( -12.870 0.000 -4.182) 13.532 70.041 ( -20.404 0.000 -3.100) 20.638 70.056 ( -24.758 0.000 4.812) 25.221 105.031 ( -2.661 0.000 1.636) 3.124 105.056 ( -4.706 0.000 -2.110) 5.157 105.072 ( -4.282 0.000 -1.113) 4.425 105.096 ( -3.795 0.000 1.700) 4.159 ======================= Grid point 6 (7/102) ======================= q-point: ( 0.38 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 Number of triplets: 102 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 4.163 ( 30.513 0.000 13.126) 33.216 4.553 ( 24.783 0.000 -1.985) 24.862 5.025 ( 11.748 0.000 -2.916) 12.104 5.078 ( 5.382 0.000 -1.583) 5.610 5.175 ( 6.728 0.000 2.487) 7.173 5.314 ( 9.838 0.000 1.782) 9.998 5.361 ( 7.734 0.000 -1.701) 7.919 5.619 ( 9.437 0.000 -0.829) 9.473 5.634 ( 13.336 0.000 1.838) 13.462 5.740 ( 7.819 0.000 2.448) 8.193 5.978 ( 16.349 0.000 -6.250) 17.503 6.081 ( 4.474 0.000 4.142) 6.097 6.179 ( 7.540 0.000 -3.658) 8.381 6.239 ( 0.898 0.000 0.376) 0.973 6.292 ( -1.026 0.000 -0.676) 1.229 6.396 ( 1.943 0.000 2.327) 3.032 6.464 ( 6.796 0.000 6.715) 9.554 6.669 ( 9.545 0.000 -1.181) 9.618 6.766 ( 0.801 0.000 13.865) 13.888 6.958 ( 4.991 0.000 -8.352) 9.730 6.982 ( 4.685 0.000 -29.521) 29.890 7.135 ( 4.670 0.000 -7.222) 8.601 7.242 ( 0.363 0.000 2.127) 2.158 7.369 ( -1.866 0.000 -0.084) 1.867 7.453 ( 1.067 0.000 3.125) 3.302 7.590 ( -1.129 0.000 5.840) 5.948 7.591 ( 3.319 0.000 -1.985) 3.867 7.872 ( 9.056 0.000 4.812) 10.255 7.928 ( 5.641 0.000 -5.192) 7.667 8.190 ( -5.161 0.000 8.723) 10.136 8.304 ( 5.360 0.000 -3.675) 6.499 8.367 ( 4.729 0.000 9.280) 10.415 8.452 ( -4.343 0.000 2.836) 5.187 8.536 ( -8.630 0.000 2.291) 8.929 8.620 ( -1.648 0.000 -4.291) 4.597 8.622 ( -3.899 0.000 2.630) 4.703 8.775 ( 1.419 0.000 -3.099) 3.408 8.815 ( 8.216 0.000 8.869) 12.090 8.927 ( -2.243 0.000 3.843) 4.450 9.183 ( 1.874 0.000 -12.774) 12.910 9.302 ( 2.308 0.000 -5.236) 5.722 9.458 ( 17.203 0.000 4.318) 17.737 9.678 ( 12.609 0.000 -3.097) 12.984 9.696 ( 9.541 0.000 -3.105) 10.034 9.804 ( 11.146 0.000 1.274) 11.219 9.824 ( 3.439 0.000 -2.546) 4.279 9.863 ( 13.073 0.000 -9.402) 16.103 10.076 ( 12.023 0.000 6.697) 13.762 10.204 ( 12.098 0.000 -1.002) 12.139 10.281 ( 17.090 0.000 -1.185) 17.131 10.399 ( 17.140 0.000 -1.747) 17.229 10.717 ( 8.814 0.000 -2.233) 9.093 10.874 ( 3.113 0.000 6.646) 7.339 11.147 ( 6.641 0.000 4.053) 7.780 11.230 ( 3.392 0.000 2.243) 4.067 11.400 ( 3.359 0.000 5.623) 6.549 11.601 ( 11.583 0.000 -5.535) 12.838 11.749 ( -0.363 0.000 -2.858) 2.881 11.889 ( 6.893 0.000 4.924) 8.471 12.295 ( 8.362 0.000 -2.221) 8.652 12.380 ( 11.944 0.000 -2.348) 12.173 12.416 ( 7.197 0.000 2.374) 7.579 12.597 ( 11.722 0.000 2.205) 11.927 12.635 ( 2.896 0.000 3.077) 4.226 12.976 ( -2.072 0.000 0.373) 2.106 13.316 ( -3.873 0.000 -1.624) 4.199 13.733 ( -8.420 0.000 -0.514) 8.436 13.762 ( -3.727 0.000 -4.855) 6.120 14.108 ( -4.127 0.000 2.345) 4.747 14.157 ( -1.145 0.000 0.603) 1.294 14.546 ( 1.433 0.000 0.899) 1.692 14.549 ( 2.109 0.000 -1.661) 2.684 14.647 ( -2.112 0.000 1.492) 2.586 14.690 ( -2.570 0.000 -5.413) 5.992 14.787 ( 2.000 0.000 3.088) 3.680 14.845 ( 2.267 0.000 -0.838) 2.417 14.923 ( -2.921 0.000 3.430) 4.505 15.095 ( -1.920 0.000 -5.281) 5.619 15.316 ( -4.218 0.000 2.077) 4.702 15.344 ( -2.802 0.000 0.928) 2.952 17.708 ( -0.971 0.000 2.466) 2.650 17.806 ( -1.029 0.000 -2.425) 2.635 18.493 ( -1.471 0.000 0.993) 1.775 18.646 ( -1.510 0.000 -1.032) 1.829 18.745 ( 2.854 0.000 -2.727) 3.948 18.841 ( 0.803 0.000 2.066) 2.216 19.045 ( -5.160 0.000 4.238) 6.677 19.112 ( -4.274 0.000 -3.792) 5.713 20.131 ( 4.983 0.000 1.103) 5.104 20.139 ( 5.107 0.000 -1.349) 5.282 20.279 ( 1.459 0.000 0.817) 1.672 20.300 ( 3.677 0.000 -0.726) 3.748 21.520 ( 11.775 0.000 -2.535) 12.044 21.640 ( 10.462 0.000 -1.994) 10.650 21.702 ( 10.817 0.000 2.333) 11.066 21.749 ( 10.440 0.000 1.773) 10.590 22.335 ( 8.435 0.000 1.930) 8.653 22.391 ( 10.546 0.000 -1.496) 10.651 22.820 ( 0.598 0.000 2.018) 2.105 22.899 ( 11.662 0.000 -1.405) 11.746 24.279 ( -0.907 0.000 -0.624) 1.101 24.482 ( 0.989 0.000 1.141) 1.510 24.499 ( 2.880 0.000 -0.125) 2.882 24.625 ( 0.921 0.000 -1.022) 1.376 28.798 ( 3.439 0.000 -0.383) 3.460 28.854 ( 3.845 0.000 0.763) 3.920 28.979 ( -1.967 0.000 1.544) 2.500 29.051 ( -2.561 0.000 -1.080) 2.779 29.196 ( -0.251 0.000 -0.377) 0.453 29.393 ( -2.744 0.000 -0.610) 2.810 29.415 ( -2.280 0.000 0.001) 2.280 29.446 ( -0.607 0.000 0.430) 0.744 33.564 ( 3.917 0.000 -0.064) 3.918 33.576 ( 4.454 0.000 0.065) 4.454 33.842 ( 3.735 0.000 -0.008) 3.735 33.873 ( 4.700 0.000 0.081) 4.701 35.713 ( 1.645 0.000 -1.973) 2.569 35.791 ( 1.691 0.000 1.675) 2.380 36.096 ( -7.088 0.000 0.905) 7.145 36.437 ( -13.217 0.000 -0.827) 13.243 37.640 ( -1.238 0.000 1.709) 2.110 37.663 ( -5.547 0.000 -1.348) 5.708 38.769 ( -0.314 0.000 -2.423) 2.443 38.842 ( -4.024 0.000 2.495) 4.734 38.911 ( -0.344 0.000 3.519) 3.536 38.999 ( -6.836 0.000 -4.759) 8.329 39.282 ( -3.785 0.000 4.454) 5.845 39.330 ( -8.129 0.000 -3.374) 8.801 40.082 ( -0.889 0.000 -5.986) 6.052 40.295 ( -13.768 0.000 8.712) 16.293 40.726 ( -10.233 0.000 -5.665) 11.697 40.766 ( -20.479 0.000 2.937) 20.689 42.958 ( -4.916 0.000 2.799) 5.657 43.263 ( -10.810 0.000 -4.418) 11.678 43.732 ( -7.084 0.000 2.977) 7.684 43.929 ( -9.090 0.000 -1.250) 9.176 69.206 ( -7.564 0.000 1.710) 7.755 69.349 ( -8.731 0.000 -3.417) 9.375 69.643 ( -17.231 0.000 3.007) 17.491 69.696 ( -13.545 0.000 -1.331) 13.610 104.970 ( -3.404 0.000 -1.057) 3.565 104.987 ( -1.876 0.000 1.012) 2.132 104.998 ( -2.969 0.000 -1.098) 3.165 105.031 ( -2.926 0.000 1.172) 3.152 ======================= Grid point 7 (8/102) ======================= q-point: ( 0.44 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 Number of triplets: 96 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 4.753 ( 25.076 0.000 10.630) 27.236 4.878 ( 9.593 0.000 -3.425) 10.186 5.096 ( -0.164 0.000 1.643) 1.651 5.285 ( 3.720 0.000 2.891) 4.711 5.289 ( 10.249 0.000 -6.151) 11.953 5.423 ( -0.926 0.000 -4.207) 4.307 5.457 ( 3.848 0.000 3.765) 5.384 5.789 ( 0.904 0.000 -3.894) 3.998 5.836 ( 11.585 0.000 3.285) 12.042 5.903 ( 9.172 0.000 10.313) 13.802 6.123 ( 0.783 0.000 -0.424) 0.890 6.169 ( 2.481 0.000 2.378) 3.436 6.245 ( -0.664 0.000 -1.209) 1.380 6.297 ( 1.724 0.000 -1.774) 2.474 6.302 ( 6.654 0.000 -5.693) 8.757 6.413 ( -0.366 0.000 0.463) 0.590 6.675 ( -5.471 0.000 -13.331) 14.410 6.764 ( 15.084 0.000 0.280) 15.087 6.775 ( -1.134 0.000 8.585) 8.659 7.021 ( 8.993 0.000 -8.822) 12.597 7.026 ( 2.491 0.000 -8.898) 9.240 7.213 ( 3.415 0.000 -4.197) 5.410 7.255 ( -6.420 0.000 6.278) 8.979 7.302 ( 5.713 0.000 1.544) 5.918 7.475 ( -1.042 0.000 -1.500) 1.827 7.631 ( 6.855 0.000 4.737) 8.333 7.678 ( 1.059 0.000 3.418) 3.578 7.880 ( -7.097 0.000 -2.751) 7.612 8.062 ( 2.382 0.000 9.975) 10.255 8.070 ( -6.303 0.000 7.705) 9.954 8.183 ( -12.705 0.000 0.051) 12.705 8.301 ( -4.883 0.000 1.938) 5.254 8.375 ( -3.636 0.000 -10.360) 10.979 8.399 ( -7.111 0.000 -5.591) 9.045 8.557 ( -1.390 0.000 4.593) 4.799 8.584 ( 1.945 0.000 4.671) 5.060 8.913 ( 0.899 0.000 4.958) 5.039 8.914 ( 6.287 0.000 0.556) 6.312 8.990 ( 5.937 0.000 -0.426) 5.952 9.148 ( -1.623 0.000 -11.768) 11.880 9.322 ( 1.565 0.000 -0.813) 1.764 9.720 ( -2.471 0.000 -3.997) 4.699 9.725 ( 8.385 0.000 6.616) 10.681 9.918 ( 9.042 0.000 -6.139) 10.929 9.923 ( 5.249 0.000 -2.080) 5.646 10.041 ( 9.187 0.000 2.684) 9.571 10.055 ( 8.374 0.000 -3.738) 9.171 10.224 ( 3.134 0.000 5.689) 6.495 10.413 ( 8.124 0.000 -4.107) 9.103 10.559 ( 11.487 0.000 -4.566) 12.362 10.695 ( 9.010 0.000 6.682) 11.217 10.876 ( 6.301 0.000 -0.364) 6.312 10.954 ( 5.350 0.000 -0.987) 5.440 11.223 ( -3.874 0.000 1.993) 4.357 11.261 ( 3.882 0.000 3.164) 5.008 11.462 ( 1.045 0.000 5.391) 5.491 11.724 ( -0.386 0.000 -3.273) 3.296 11.815 ( 8.913 0.000 0.129) 8.913 11.997 ( 2.989 0.000 0.840) 3.104 12.417 ( 2.663 0.000 -2.759) 3.834 12.584 ( 7.416 0.000 2.800) 7.927 12.648 ( 14.194 0.000 -2.076) 14.345 12.824 ( 16.068 0.000 1.239) 16.116 12.893 ( 10.998 0.000 1.475) 11.096 12.961 ( 5.777 0.000 0.098) 5.778 13.178 ( -9.670 0.000 0.086) 9.670 13.507 ( -13.886 0.000 -0.518) 13.896 13.601 ( -11.100 0.000 -3.682) 11.694 14.038 ( -3.039 0.000 1.575) 3.423 14.144 ( -0.374 0.000 0.613) 0.718 14.570 ( 0.750 0.000 0.100) 0.756 14.572 ( 0.168 0.000 1.017) 1.031 14.623 ( -0.234 0.000 -1.326) 1.346 14.644 ( -1.116 0.000 -3.197) 3.386 14.805 ( -0.675 0.000 3.310) 3.378 14.899 ( 2.816 0.000 -0.574) 2.874 14.912 ( 0.923 0.000 0.680) 1.146 15.060 ( -0.353 0.000 -3.787) 3.803 15.233 ( -4.401 0.000 2.650) 5.137 15.297 ( -1.929 0.000 0.034) 1.929 17.700 ( -0.286 0.000 1.304) 1.335 17.792 ( -0.079 0.000 -1.313) 1.316 18.469 ( -0.992 0.000 0.544) 1.131 18.616 ( -1.142 0.000 -0.508) 1.250 18.803 ( 3.632 0.000 -3.950) 5.366 18.876 ( 2.143 0.000 3.053) 3.731 18.954 ( -4.768 0.000 4.613) 6.634 19.020 ( -4.016 0.000 -3.863) 5.572 20.206 ( 2.377 0.000 0.529) 2.435 20.210 ( 2.326 0.000 -0.657) 2.417 20.301 ( 0.650 0.000 0.377) 0.751 20.353 ( 1.739 0.000 -0.328) 1.769 21.703 ( 6.603 0.000 -1.521) 6.776 21.800 ( 5.579 0.000 -0.831) 5.640 21.879 ( 6.265 0.000 1.740) 6.502 21.910 ( 5.205 0.000 0.278) 5.213 22.465 ( 4.325 0.000 0.754) 4.391 22.545 ( 5.103 0.000 -0.660) 5.146 22.829 ( 0.021 0.000 1.209) 1.210 23.069 ( 5.620 0.000 -0.677) 5.661 24.267 ( -0.283 0.000 -0.274) 0.394 24.504 ( 0.855 0.000 0.686) 1.096 24.550 ( 2.080 0.000 -0.030) 2.080 24.636 ( 0.313 0.000 -0.594) 0.671 28.852 ( 1.820 0.000 -0.233) 1.835 28.923 ( 2.808 0.000 0.727) 2.901 28.952 ( -0.780 0.000 0.812) 1.125 29.007 ( -1.678 0.000 -0.977) 1.942 29.194 ( 0.005 0.000 -0.073) 0.073 29.345 ( -1.800 0.000 -0.456) 1.857 29.373 ( -1.705 0.000 0.143) 1.711 29.440 ( -0.182 0.000 0.171) 0.250 33.622 ( 1.910 0.000 -0.023) 1.910 33.643 ( 2.205 0.000 0.025) 2.206 33.900 ( 2.004 0.000 -0.041) 2.004 33.945 ( 2.448 0.000 0.059) 2.449 35.759 ( 3.204 0.000 -1.715) 3.634 35.847 ( 3.275 0.000 1.392) 3.558 35.969 ( -5.766 0.000 1.273) 5.905 36.215 ( -8.616 0.000 -1.024) 8.676 37.572 ( -3.112 0.000 -1.045) 3.282 37.627 ( -0.396 0.000 1.294) 1.353 38.766 ( 0.210 0.000 -1.159) 1.178 38.784 ( -2.111 0.000 1.018) 2.344 38.879 ( -4.110 0.000 -2.433) 4.776 38.931 ( 1.389 0.000 3.374) 3.648 39.182 ( -5.700 0.000 -3.261) 6.567 39.238 ( -1.529 0.000 2.350) 2.804 40.089 ( 2.882 0.000 -5.678) 6.367 40.094 ( -7.475 0.000 4.380) 8.664 40.424 ( -14.263 0.000 3.881) 14.782 40.559 ( -5.434 0.000 -2.637) 6.040 42.887 ( -2.602 0.000 1.439) 2.973 43.094 ( -5.431 0.000 -2.068) 5.812 43.628 ( -3.690 0.000 1.344) 3.927 43.789 ( -4.694 0.000 -0.681) 4.743 69.090 ( -4.199 0.000 0.896) 4.294 69.215 ( -3.964 0.000 -2.332) 4.599 69.382 ( -9.198 0.000 1.881) 9.389 69.493 ( -6.593 0.000 -0.451) 6.608 104.917 ( -1.700 0.000 -0.445) 1.757 104.950 ( -1.606 0.000 -0.633) 1.726 104.962 ( -0.801 0.000 0.382) 0.887 104.986 ( -1.751 0.000 0.703) 1.886 ======================= Grid point 8 (9/102) ======================= q-point: (-0.50 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 Number of triplets: 54 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 4.972 ( 0.000 0.000 0.000) 0.000 5.085 ( 0.000 0.000 -0.000) 0.000 5.101 ( 0.000 0.000 0.000) 0.000 5.333 ( -0.000 0.000 0.000) 0.000 5.340 ( 0.000 0.000 -0.000) 0.000 5.384 ( 0.000 0.000 -0.000) 0.000 5.497 ( 0.000 0.000 0.000) 0.000 5.777 ( 0.000 0.000 -0.000) 0.000 5.996 ( 0.000 0.000 0.000) 0.000 6.026 ( 0.000 0.000 -0.000) 0.000 6.141 ( 0.000 0.000 0.000) 0.000 6.172 ( 0.000 0.000 0.000) 0.000 6.221 ( 0.000 0.000 -0.000) 0.000 6.302 ( 0.000 0.000 0.000) 0.000 6.392 ( 0.000 0.000 0.000) 0.000 6.402 ( -0.000 0.000 -0.000) 0.000 6.547 ( 0.000 0.000 -0.000) 0.000 6.782 ( 0.000 0.000 0.000) 0.000 6.948 ( 0.000 0.000 0.000) 0.000 7.007 ( 0.000 0.000 0.000) 0.000 7.175 ( 0.000 0.000 -0.000) 0.000 7.209 ( 0.000 0.000 0.000) 0.000 7.275 ( 0.000 0.000 0.000) 0.000 7.361 ( 0.000 0.000 0.000) 0.000 7.463 ( 0.000 0.000 0.000) 0.000 7.644 ( 0.000 0.000 0.000) 0.000 7.756 ( 0.000 0.000 -0.000) 0.000 7.811 ( 0.000 0.000 0.000) 0.000 7.869 ( -0.000 0.000 0.000) 0.000 8.027 ( 0.000 0.000 0.000) 0.000 8.142 ( 0.000 0.000 0.000) 0.000 8.241 ( 0.000 0.000 0.000) 0.000 8.314 ( 0.000 0.000 -0.000) 0.000 8.340 ( 0.000 0.000 0.000) 0.000 8.549 ( 0.000 0.000 0.000) 0.000 8.608 ( 0.000 0.000 0.000) 0.000 8.939 ( 0.000 0.000 0.000) 0.000 8.981 ( 0.000 0.000 0.000) 0.000 9.036 ( 0.000 0.000 0.000) 0.000 9.110 ( 0.000 0.000 -0.000) 0.000 9.358 ( 0.000 0.000 0.000) 0.000 9.676 ( 0.000 0.000 -0.000) 0.000 9.820 ( 0.000 0.000 0.000) 0.000 9.977 ( 0.000 0.000 0.000) 0.000 9.989 ( 0.000 0.000 -0.000) 0.000 10.139 ( 0.000 0.000 0.000) 0.000 10.156 ( 0.000 0.000 0.000) 0.000 10.253 ( 0.000 0.000 0.000) 0.000 10.493 ( 0.000 0.000 0.000) 0.000 10.689 ( 0.000 0.000 0.000) 0.000 10.768 ( 0.000 0.000 -0.000) 0.000 10.942 ( 0.000 0.000 0.000) 0.000 11.075 ( 0.000 0.000 -0.000) 0.000 11.125 ( -0.000 0.000 0.000) 0.000 11.308 ( -0.000 0.000 0.000) 0.000 11.469 ( 0.000 0.000 -0.000) 0.000 11.722 ( 0.000 0.000 -0.000) 0.000 11.914 ( 0.000 0.000 -0.000) 0.000 12.025 ( 0.000 0.000 0.000) 0.000 12.426 ( 0.000 0.000 0.000) 0.000 12.670 ( 0.000 0.000 0.000) 0.000 12.916 ( 0.000 0.000 -0.000) 0.000 12.919 ( 0.000 0.000 -0.000) 0.000 12.957 ( -0.000 0.000 0.000) 0.000 13.173 ( 0.000 0.000 0.000) 0.000 13.195 ( -0.000 0.000 -0.000) 0.000 13.229 ( 0.000 0.000 0.000) 0.000 13.368 ( -0.000 0.000 -0.000) 0.000 14.006 ( 0.000 0.000 0.000) 0.000 14.141 ( 0.000 0.000 0.000) 0.000 14.571 ( 0.000 0.000 0.000) 0.000 14.577 ( 0.000 0.000 0.000) 0.000 14.622 ( 0.000 0.000 -0.000) 0.000 14.630 ( 0.000 0.000 0.000) 0.000 14.798 ( 0.000 0.000 0.000) 0.000 14.927 ( 0.000 0.000 0.000) 0.000 14.931 ( 0.000 0.000 -0.000) 0.000 15.061 ( 0.000 0.000 0.000) 0.000 15.179 ( 0.000 0.000 0.000) 0.000 15.276 ( 0.000 0.000 0.000) 0.000 17.699 ( 0.000 0.000 0.000) 0.000 17.791 ( 0.000 0.000 0.000) 0.000 18.459 ( 0.000 0.000 -0.000) 0.000 18.604 ( 0.000 0.000 0.000) 0.000 18.868 ( 0.000 0.000 -0.000) 0.000 18.879 ( -0.000 0.000 0.000) 0.000 18.936 ( 0.000 0.000 0.000) 0.000 18.940 ( -0.000 0.000 -0.000) 0.000 20.230 ( 0.000 0.000 -0.000) 0.000 20.232 ( 0.000 0.000 0.000) 0.000 20.308 ( 0.000 0.000 -0.000) 0.000 20.369 ( 0.000 0.000 0.000) 0.000 21.769 ( 0.000 0.000 0.000) 0.000 21.856 ( 0.000 0.000 0.000) 0.000 21.952 ( -0.000 0.000 -0.000) 0.000 21.955 ( 0.000 0.000 0.000) 0.000 22.510 ( 0.000 0.000 -0.000) 0.000 22.595 ( 0.000 0.000 0.000) 0.000 22.830 ( 0.000 0.000 -0.000) 0.000 23.125 ( 0.000 0.000 0.000) 0.000 24.264 ( 0.000 0.000 0.000) 0.000 24.514 ( 0.000 0.000 0.000) 0.000 24.573 ( 0.000 0.000 0.000) 0.000 24.637 ( 0.000 0.000 0.000) 0.000 28.868 ( 0.000 0.000 0.000) 0.000 28.948 ( 0.000 0.000 0.000) 0.000 28.961 ( 0.000 0.000 -0.000) 0.000 28.981 ( 0.000 0.000 0.000) 0.000 29.194 ( 0.000 0.000 0.000) 0.000 29.325 ( 0.000 0.000 0.000) 0.000 29.355 ( 0.000 0.000 0.000) 0.000 29.438 ( 0.000 0.000 0.000) 0.000 33.641 ( 0.000 0.000 -0.000) 0.000 33.665 ( 0.000 0.000 0.000) 0.000 33.920 ( 0.000 0.000 0.000) 0.000 33.970 ( 0.000 0.000 0.000) 0.000 35.810 ( 0.000 0.000 0.000) 0.000 35.893 ( 0.000 0.000 0.000) 0.000 35.896 ( 0.000 0.000 0.000) 0.000 36.114 ( 0.000 0.000 0.000) 0.000 37.539 ( 0.000 0.000 0.000) 0.000 37.625 ( 0.000 0.000 0.000) 0.000 38.763 ( 0.000 0.000 0.000) 0.000 38.768 ( 0.000 0.000 -0.000) 0.000 38.834 ( 0.000 0.000 0.000) 0.000 38.958 ( 0.000 0.000 0.000) 0.000 39.111 ( 0.000 0.000 0.000) 0.000 39.226 ( 0.000 0.000 0.000) 0.000 40.022 ( 0.000 0.000 0.000) 0.000 40.154 ( 0.000 0.000 0.000) 0.000 40.241 ( 0.000 0.000 -0.000) 0.000 40.501 ( 0.000 0.000 -0.000) 0.000 42.862 ( 0.000 0.000 0.000) 0.000 43.037 ( 0.000 0.000 0.000) 0.000 43.592 ( 0.000 0.000 0.000) 0.000 43.741 ( 0.000 0.000 0.000) 0.000 69.048 ( 0.000 0.000 0.000) 0.000 69.175 ( 0.000 0.000 0.000) 0.000 69.290 ( 0.000 0.000 0.000) 0.000 69.427 ( 0.000 0.000 0.000) 0.000 104.900 ( 0.000 0.000 0.000) 0.000 104.933 ( 0.000 0.000 0.000) 0.000 104.956 ( 0.000 0.000 0.000) 0.000 104.967 ( 0.000 0.000 -0.000) 0.000 ======================= Grid point 17 (10/102) ======================= q-point: ( 0.00 0.20 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 Number of triplets: 102 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.732 ( 0.000 37.527 0.000) 37.527 1.129 ( 0.000 57.386 0.000) 57.386 1.787 ( 0.000 89.798 0.000) 89.798 2.340 ( 0.000 11.348 0.000) 11.348 2.592 ( 0.000 -20.232 0.000) 20.232 3.359 ( 0.000 -4.681 0.000) 4.681 3.476 ( 0.000 -9.485 0.000) 9.485 3.498 ( 0.000 -6.214 0.000) 6.214 3.950 ( 0.000 7.692 0.000) 7.692 3.953 ( 0.000 -11.658 0.000) 11.658 4.401 ( 0.000 0.432 0.000) 0.432 4.564 ( 0.000 5.458 0.000) 5.458 4.591 ( 0.000 -9.533 0.000) 9.533 4.735 ( 0.000 7.144 0.000) 7.144 4.937 ( 0.000 8.055 0.000) 8.055 4.957 ( 0.000 6.967 0.000) 6.967 5.314 ( 0.000 -5.666 0.000) 5.666 5.320 ( 0.000 -1.979 0.000) 1.979 5.865 ( 0.000 -7.402 0.000) 7.402 6.098 ( 0.000 -0.594 0.000) 0.594 6.129 ( 0.000 -6.830 0.000) 6.830 6.357 ( 0.000 -15.083 0.000) 15.083 6.490 ( 0.000 1.898 0.000) 1.898 6.547 ( 0.000 -2.488 0.000) 2.488 6.621 ( 0.000 -1.342 0.000) 1.342 6.681 ( 0.000 -1.362 0.000) 1.362 6.697 ( 0.000 -1.315 0.000) 1.315 6.868 ( 0.000 -21.385 0.000) 21.385 7.003 ( 0.000 4.601 0.000) 4.601 7.174 ( 0.000 0.160 0.000) 0.160 7.312 ( 0.000 2.220 0.000) 2.220 7.379 ( 0.000 -9.832 0.000) 9.832 7.463 ( 0.000 6.592 0.000) 6.592 7.488 ( 0.000 2.672 0.000) 2.672 7.608 ( 0.000 12.799 0.000) 12.799 7.714 ( 0.000 -0.000 0.000) 0.000 7.822 ( 0.000 9.495 0.000) 9.495 7.854 ( 0.000 -4.414 0.000) 4.414 8.024 ( 0.000 1.925 0.000) 1.925 8.290 ( 0.000 8.532 0.000) 8.532 8.374 ( 0.000 2.767 0.000) 2.767 8.522 ( 0.000 -11.405 0.000) 11.405 8.761 ( 0.000 -6.866 0.000) 6.866 8.784 ( 0.000 0.916 0.000) 0.916 8.957 ( 0.000 5.960 0.000) 5.960 9.042 ( 0.000 -2.574 0.000) 2.574 9.213 ( 0.000 1.201 0.000) 1.201 9.443 ( 0.000 5.153 0.000) 5.153 9.607 ( 0.000 6.218 0.000) 6.218 9.674 ( 0.000 0.279 0.000) 0.279 9.868 ( 0.000 -10.644 0.000) 10.644 10.196 ( 0.000 -10.290 0.000) 10.290 10.422 ( 0.000 -10.528 0.000) 10.528 10.612 ( 0.000 -9.963 0.000) 9.963 11.313 ( 0.000 22.166 0.000) 22.166 11.620 ( 0.000 -7.775 0.000) 7.775 11.876 ( 0.000 -2.766 0.000) 2.766 11.879 ( 0.000 2.109 0.000) 2.109 11.978 ( 0.000 11.159 0.000) 11.159 12.056 ( 0.000 6.557 0.000) 6.557 12.169 ( 0.000 -0.976 0.000) 0.976 12.174 ( 0.000 4.758 0.000) 4.758 12.262 ( 0.000 1.934 0.000) 1.934 12.330 ( 0.000 -0.235 0.000) 0.235 12.999 ( 0.000 0.823 0.000) 0.823 13.214 ( 0.000 0.080 0.000) 0.080 13.396 ( 0.000 -7.502 0.000) 7.502 13.893 ( 0.000 -16.963 0.000) 16.963 14.343 ( 0.000 0.217 0.000) 0.217 14.435 ( 0.000 -2.064 0.000) 2.064 14.472 ( 0.000 1.045 0.000) 1.045 14.629 ( 0.000 6.035 0.000) 6.035 14.732 ( 0.000 2.214 0.000) 2.214 14.996 ( 0.000 1.986 0.000) 1.986 15.004 ( 0.000 8.151 0.000) 8.151 15.382 ( 0.000 -1.285 0.000) 1.285 15.457 ( 0.000 -6.706 0.000) 6.706 15.652 ( 0.000 -2.681 0.000) 2.681 16.039 ( 0.000 14.543 0.000) 14.543 16.983 ( 0.000 -9.245 0.000) 9.245 17.795 ( 0.000 8.555 0.000) 8.555 18.078 ( 0.000 2.883 0.000) 2.883 18.196 ( 0.000 -0.489 0.000) 0.489 18.231 ( 0.000 -0.253 0.000) 0.253 18.713 ( 0.000 -0.143 0.000) 0.143 18.831 ( 0.000 4.609 0.000) 4.609 19.260 ( 0.000 -8.116 0.000) 8.116 19.376 ( 0.000 -7.275 0.000) 7.275 19.428 ( 0.000 -7.510 0.000) 7.510 19.622 ( 0.000 -1.835 0.000) 1.835 19.682 ( 0.000 5.888 0.000) 5.888 19.907 ( 0.000 -0.897 0.000) 0.897 20.172 ( 0.000 3.958 0.000) 3.958 20.282 ( 0.000 -1.525 0.000) 1.525 20.328 ( 0.000 0.840 0.000) 0.840 20.377 ( 0.000 -2.215 0.000) 2.215 20.418 ( 0.000 0.217 0.000) 0.217 20.423 ( 0.000 0.100 0.000) 0.100 20.501 ( 0.000 0.147 0.000) 0.147 20.534 ( 0.000 -0.485 0.000) 0.485 24.448 ( 0.000 1.623 0.000) 1.623 24.567 ( 0.000 1.406 0.000) 1.406 24.568 ( 0.000 1.288 0.000) 1.288 24.692 ( 0.000 -3.479 0.000) 3.479 28.572 ( 0.000 5.303 0.000) 5.303 28.790 ( 0.000 4.407 0.000) 4.407 28.958 ( 0.000 -5.264 0.000) 5.264 29.262 ( 0.000 -8.243 0.000) 8.243 29.487 ( 0.000 3.912 0.000) 3.912 29.599 ( 0.000 3.360 0.000) 3.360 29.640 ( 0.000 -1.217 0.000) 1.217 29.684 ( 0.000 0.451 0.000) 0.451 32.964 ( 0.000 1.028 0.000) 1.028 32.987 ( 0.000 0.085 0.000) 0.085 32.997 ( 0.000 -0.184 0.000) 0.184 33.078 ( 0.000 -1.451 0.000) 1.451 36.008 ( 0.000 15.575 0.000) 15.575 36.886 ( 0.000 -5.928 0.000) 5.928 37.306 ( 0.000 2.810 0.000) 2.810 38.178 ( 0.000 -25.507 0.000) 25.507 38.255 ( 0.000 9.589 0.000) 9.589 38.414 ( 0.000 14.520 0.000) 14.520 38.923 ( 0.000 1.275 0.000) 1.275 39.176 ( 0.000 1.062 0.000) 1.062 39.576 ( 0.000 -2.663 0.000) 2.663 39.753 ( 0.000 -5.912 0.000) 5.912 39.937 ( 0.000 0.800 0.000) 0.800 39.992 ( 0.000 3.447 0.000) 3.447 42.165 ( 0.000 -0.132 0.000) 0.132 42.195 ( 0.000 -2.422 0.000) 2.422 43.477 ( 0.000 0.093 0.000) 0.093 43.539 ( 0.000 -1.546 0.000) 1.546 43.654 ( 0.000 12.075 0.000) 12.075 44.583 ( 0.000 -11.321 0.000) 11.321 45.375 ( 0.000 4.345 0.000) 4.345 45.641 ( 0.000 -2.838 0.000) 2.838 70.274 ( 0.000 18.376 0.000) 18.376 71.782 ( 0.000 -21.466 0.000) 21.466 72.664 ( 0.000 9.343 0.000) 9.343 73.048 ( 0.000 -2.891 0.000) 2.891 105.227 ( 0.000 0.965 0.000) 0.965 105.300 ( 0.000 -0.771 0.000) 0.771 105.579 ( 0.000 0.471 0.000) 0.471 105.658 ( 0.000 -1.468 0.000) 1.468 ======================= Grid point 18 (11/102) ======================= q-point: ( 0.06 0.20 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 Number of triplets: 160 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.288 ( 22.445 41.821 3.251) 47.575 1.319 ( 28.438 36.059 13.499) 47.867 2.113 ( 34.519 68.635 0.792) 76.830 2.723 ( 35.308 8.345 -7.875) 37.126 2.845 ( 23.026 -18.259 0.942) 29.402 3.527 ( 13.637 0.021 6.646) 15.170 3.608 ( 12.451 -6.995 -6.534) 15.705 3.702 ( 20.380 -12.708 -0.243) 24.019 4.011 ( 9.593 -9.963 -0.487) 13.839 4.101 ( 10.277 3.325 -2.894) 11.182 4.441 ( 6.513 -2.104 2.058) 7.147 4.661 ( 8.922 4.629 7.749) 12.692 4.759 ( 11.716 -6.961 3.569) 14.087 4.970 ( 14.500 5.716 7.620) 17.349 4.987 ( 8.921 5.482 -1.549) 10.584 5.025 ( 10.777 6.799 -9.683) 16.005 5.523 ( 19.486 -5.260 2.255) 20.309 5.547 ( 21.500 -1.561 0.304) 21.558 5.900 ( 4.770 -6.789 -5.662) 10.045 6.080 ( 0.324 -0.874 -5.803) 5.877 6.180 ( 4.059 -2.776 1.178) 5.057 6.383 ( 2.925 -11.987 1.780) 12.466 6.474 ( -0.459 1.818 5.136) 5.467 6.547 ( 0.101 -1.685 -1.737) 2.423 6.701 ( 2.567 -2.791 -0.915) 3.900 6.783 ( 8.025 -8.024 4.731) 12.295 6.868 ( 13.774 -5.523 -5.044) 15.673 6.934 ( 7.510 -14.040 0.976) 15.952 7.101 ( 10.194 5.798 -2.767) 12.049 7.188 ( 1.490 -1.238 7.171) 7.429 7.346 ( 3.984 7.544 -2.060) 8.776 7.452 ( 7.288 -7.929 -7.407) 13.071 7.500 ( 5.005 5.942 -5.009) 9.244 7.591 ( 9.893 2.052 -1.375) 10.197 7.727 ( 9.828 0.067 2.466) 10.133 7.734 ( -0.617 5.986 -4.713) 7.644 7.837 ( 8.686 0.933 -4.428) 9.794 7.934 ( 6.183 3.863 11.484) 13.603 8.044 ( 2.481 3.580 0.016) 4.356 8.188 ( -1.414 8.717 0.719) 8.860 8.349 ( -1.884 2.430 -5.541) 6.337 8.574 ( -0.347 -13.702 5.949) 14.941 8.786 ( 0.869 3.075 3.158) 4.493 9.013 ( 10.579 -1.043 -3.280) 11.125 9.036 ( 0.119 -2.846 4.725) 5.517 9.109 ( 8.958 -2.146 -1.692) 9.366 9.239 ( 5.590 1.252 -2.153) 6.120 9.504 ( 4.741 0.961 2.168) 5.301 9.649 ( 0.870 0.820 6.190) 6.305 9.697 ( 7.792 -3.522 -21.012) 22.685 9.856 ( -0.839 -11.717 -3.980) 12.403 10.230 ( 3.374 -9.410 2.777) 10.375 10.416 ( -0.175 -9.657 2.160) 9.898 10.538 ( -6.200 -9.400 -3.733) 11.863 11.286 ( -3.648 22.046 5.701) 23.061 11.560 ( -5.626 -2.080 2.024) 6.330 11.775 ( -3.478 6.889 -19.238) 20.729 11.848 ( -5.908 3.586 -12.644) 14.409 11.942 ( -3.494 7.893 16.316) 18.459 12.036 ( -0.707 2.535 13.116) 13.377 12.159 ( 4.867 -1.719 1.027) 5.263 12.307 ( 5.945 -1.983 1.086) 6.361 12.409 ( 8.654 0.567 -3.814) 9.474 12.504 ( 15.816 -2.458 2.495) 16.199 12.954 ( -4.317 0.968 4.328) 6.189 13.143 ( -6.423 -0.604 1.005) 6.529 13.346 ( -4.682 -5.850 -0.565) 7.514 13.611 ( -13.347 7.372 -8.376) 17.397 14.321 ( -1.758 0.175 -2.522) 3.079 14.380 ( -2.398 -3.494 0.803) 4.313 14.483 ( -0.739 3.125 2.988) 4.386 14.634 ( 0.610 -0.150 -3.755) 3.807 14.685 ( -3.172 5.341 4.771) 7.832 14.979 ( -2.095 6.168 -1.084) 6.604 14.980 ( -2.514 2.941 4.518) 5.948 15.238 ( -7.133 7.981 -5.427) 12.001 15.426 ( -3.136 -6.972 3.956) 8.608 15.615 ( -3.735 -2.528 0.815) 4.583 15.989 ( -6.504 7.971 4.515) 11.235 16.408 ( -27.094 4.052 -2.633) 27.522 17.856 ( 4.375 9.192 3.721) 10.838 18.257 ( 5.450 -0.878 0.587) 5.552 18.265 ( 4.329 0.905 -1.015) 4.537 18.502 ( 7.325 -7.221 -6.178) 11.998 18.777 ( -1.689 4.255 -2.407) 5.172 18.815 ( 5.135 -4.822 -3.719) 7.966 19.301 ( 3.398 -5.876 -0.703) 6.824 19.386 ( 2.128 -4.868 1.729) 5.587 19.411 ( -1.758 -5.440 1.890) 6.021 19.537 ( -4.334 3.468 -1.356) 5.714 19.659 ( 4.134 -4.378 -4.103) 7.286 19.915 ( -1.823 -5.058 2.828) 6.075 20.243 ( 5.204 2.177 -0.088) 5.642 20.325 ( 4.567 0.543 2.217) 5.106 20.353 ( 6.561 -0.096 -1.951) 6.846 20.414 ( 4.947 -0.783 1.634) 5.268 20.533 ( 15.048 0.896 -4.060) 15.612 20.633 ( 17.053 0.028 3.355) 17.379 20.754 ( 18.680 -0.476 -4.230) 19.159 21.490 ( 53.908 -53.107 11.922) 76.607 24.436 ( -1.112 1.538 0.009) 1.897 24.554 ( -1.108 1.221 -0.962) 1.909 24.562 ( -0.665 1.203 1.141) 1.786 24.649 ( -3.619 -1.773 -0.434) 4.053 28.579 ( 0.696 5.212 0.054) 5.259 28.722 ( -3.862 9.740 -1.755) 10.624 28.969 ( 0.194 -5.307 4.027) 6.665 29.258 ( -0.490 -8.386 -1.700) 8.571 29.469 ( -1.609 3.604 -1.403) 4.189 29.584 ( -1.856 2.873 1.172) 3.615 29.611 ( -1.561 -0.061 -1.834) 2.409 29.668 ( -1.303 1.177 0.577) 1.848 32.974 ( 2.671 2.198 0.032) 3.460 33.015 ( 2.930 0.206 -0.238) 2.947 33.114 ( 5.582 -3.809 0.419) 6.771 33.142 ( 7.824 -5.821 0.072) 9.752 35.989 ( -1.794 15.056 -0.078) 15.162 36.830 ( -5.390 -3.634 -20.615) 21.616 36.945 ( -27.340 25.148 22.931) 43.655 38.114 ( -6.085 -21.259 -1.938) 22.197 38.196 ( -6.735 14.030 -1.236) 15.612 38.353 ( -4.848 8.056 0.727) 9.430 38.921 ( 0.713 1.756 -8.641) 8.846 39.165 ( -1.951 -0.165 6.609) 6.893 39.432 ( -10.054 -6.348 -3.587) 12.420 39.757 ( -1.786 -3.078 -1.852) 4.012 39.923 ( -1.636 4.864 0.373) 5.145 39.976 ( -1.587 1.754 0.994) 2.566 41.637 ( -48.392 39.024 -19.330) 65.103 42.161 ( -4.959 -2.638 -20.248) 21.012 42.402 ( -38.795 35.798 16.842) 55.409 43.314 ( -15.913 -1.992 -1.173) 16.080 43.666 ( -6.192 11.146 26.869) 29.740 44.528 ( -5.356 -10.328 2.866) 11.982 45.277 ( -8.576 2.755 -0.726) 9.036 45.466 ( -16.368 -1.806 -1.976) 16.585 70.226 ( -4.842 17.382 1.043) 18.074 71.563 ( -31.281 16.254 31.270) 47.123 71.902 ( -36.868 11.129 -46.088) 60.060 72.548 ( -22.404 8.773 -11.377) 26.614 105.218 ( -1.033 0.993 1.269) 1.914 105.311 ( -0.363 -2.087 4.290) 4.784 105.487 ( -6.262 3.721 1.851) 7.515 105.607 ( -4.644 -1.352 -1.645) 5.109 ======================= Grid point 19 (12/102) ======================= q-point: ( 0.12 0.20 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 Number of triplets: 162 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.736 ( 24.731 35.195 17.388) 46.397 1.951 ( 30.418 34.320 1.817) 45.896 3.050 ( 51.431 32.070 3.804) 60.730 3.382 ( 29.046 -14.056 -3.005) 32.408 3.544 ( 42.817 0.968 -11.802) 44.424 3.854 ( 16.327 -9.832 5.803) 19.923 3.961 ( 22.385 -0.426 3.439) 22.651 4.111 ( 20.721 -7.412 -10.151) 24.235 4.282 ( 14.545 0.881 -0.221) 14.573 4.475 ( 28.724 -10.487 -4.013) 30.841 4.682 ( 16.123 2.229 10.077) 19.143 4.878 ( 10.680 2.730 7.561) 13.368 5.000 ( 9.622 -6.592 9.019) 14.744 5.202 ( 14.208 2.460 1.809) 14.532 5.227 ( 19.999 3.604 -8.776) 22.136 5.540 ( 29.684 6.208 -2.579) 30.436 5.981 ( 20.889 -3.026 2.154) 21.216 6.064 ( 12.948 5.497 -2.895) 14.362 6.087 ( 11.715 -7.871 -4.511) 14.816 6.138 ( 24.767 -3.010 -0.781) 24.962 6.302 ( 9.315 0.045 -5.565) 10.851 6.474 ( 1.712 0.143 6.456) 6.680 6.533 ( 10.169 -2.187 3.738) 11.053 6.573 ( 5.412 0.342 -4.448) 7.014 6.723 ( 0.390 -4.293 -0.421) 4.331 6.948 ( 9.684 -20.514 -0.776) 22.698 7.078 ( 6.408 -0.522 -4.030) 7.588 7.129 ( 8.203 0.949 3.613) 9.013 7.336 ( 11.752 -0.710 6.014) 13.220 7.366 ( 14.421 7.074 -4.300) 16.628 7.483 ( 11.695 12.850 -3.163) 17.661 7.592 ( 6.489 2.188 -3.138) 7.532 7.681 ( 12.176 -5.721 2.867) 13.756 7.761 ( 9.429 -3.344 -16.715) 19.480 7.837 ( 11.175 -1.460 3.196) 11.715 7.961 ( 11.598 7.085 2.732) 13.863 8.064 ( 14.913 -3.517 -1.689) 15.415 8.078 ( 7.751 -2.400 -1.011) 8.177 8.237 ( 14.390 2.193 -2.741) 14.812 8.262 ( 7.983 8.465 14.198) 18.357 8.324 ( 4.664 2.225 -9.212) 10.563 8.644 ( 6.188 -11.265 5.893) 14.140 8.786 ( -1.359 5.758 5.909) 8.362 9.023 ( -0.570 0.298 -0.089) 0.649 9.102 ( -0.038 6.196 3.951) 7.348 9.197 ( 2.891 -1.174 3.115) 4.409 9.393 ( 5.461 1.175 -7.918) 9.690 9.546 ( -1.742 1.169 2.347) 3.148 9.761 ( 4.830 -7.549 -3.088) 9.479 9.830 ( 7.121 -9.133 -20.326) 23.394 9.869 ( 8.649 -10.514 8.260) 15.924 10.324 ( 5.196 -4.564 -0.944) 6.980 10.367 ( -8.862 -9.901 -3.331) 13.699 10.483 ( 6.592 -7.586 6.467) 11.951 11.186 ( -7.342 22.466 4.066) 23.983 11.429 ( -7.208 4.034 0.752) 8.294 11.665 ( -4.056 7.374 -12.443) 15.021 11.701 ( -4.672 4.906 -19.844) 20.969 11.891 ( -4.373 5.238 17.970) 19.222 12.072 ( 0.319 -0.268 15.086) 15.092 12.248 ( 3.080 -3.253 0.585) 4.518 12.414 ( 2.519 -0.469 0.452) 2.602 12.540 ( 3.428 0.159 -0.523) 3.472 12.824 ( 13.477 -4.092 0.491) 14.093 12.948 ( 5.761 -0.947 2.954) 6.543 13.007 ( -6.337 -3.933 0.007) 7.458 13.231 ( -5.527 -0.449 1.045) 5.643 13.507 ( 2.833 3.458 -6.311) 7.734 14.275 ( -2.165 -1.341 -2.166) 3.344 14.343 ( -1.623 -3.883 -0.126) 4.210 14.455 ( -2.420 4.622 2.796) 5.919 14.621 ( -2.010 -1.727 2.282) 3.497 14.654 ( -0.182 0.922 0.396) 1.019 14.909 ( -4.195 6.554 3.511) 8.537 14.933 ( -2.972 1.214 -0.996) 3.361 15.105 ( -5.179 5.830 -9.226) 12.080 15.350 ( -5.305 -5.209 5.866) 9.470 15.508 ( -7.146 -2.388 2.539) 7.951 15.820 ( -10.215 1.666 4.054) 11.115 15.954 ( -18.162 -0.935 -6.105) 19.183 17.929 ( 1.088 10.595 5.478) 11.977 18.290 ( -1.699 4.840 -3.713) 6.332 18.395 ( 6.198 0.534 2.008) 6.537 18.559 ( 2.832 -0.318 -2.125) 3.555 18.705 ( -2.485 2.920 -1.508) 4.120 18.878 ( 1.299 -2.124 -4.050) 4.754 19.346 ( -3.529 -10.284 5.783) 12.315 19.371 ( 0.453 -6.912 -3.023) 7.558 19.470 ( 4.604 1.958 0.762) 5.060 19.520 ( 4.951 5.126 -2.018) 7.407 19.769 ( 7.191 -5.993 -4.187) 10.255 19.935 ( 3.183 -5.496 3.264) 7.141 20.396 ( 10.572 1.518 -1.980) 10.862 20.498 ( 11.745 0.539 2.869) 12.102 20.542 ( 11.999 -0.512 -2.200) 12.210 20.591 ( 11.618 -0.665 3.081) 12.038 20.902 ( 21.732 1.066 -4.925) 22.309 21.043 ( 21.942 1.382 3.765) 22.306 21.184 ( 24.294 -0.731 -5.866) 25.003 22.224 ( 21.024 -40.504 6.697) 46.124 24.409 ( -1.337 1.156 -0.118) 1.771 24.516 ( -2.618 0.742 -0.998) 2.898 24.548 ( -1.411 0.832 0.776) 1.813 24.575 ( -2.440 -0.585 -0.574) 2.574 28.601 ( 1.477 4.908 0.214) 5.130 28.677 ( -0.401 9.485 -1.088) 9.556 28.979 ( 0.056 -4.850 3.908) 6.229 29.231 ( -1.722 -7.690 -1.725) 8.067 29.420 ( -2.795 3.410 -1.694) 4.723 29.540 ( -2.302 1.104 0.636) 2.631 29.582 ( -1.361 0.494 -1.079) 1.806 29.636 ( -2.027 1.049 0.688) 2.384 33.061 ( 5.775 2.216 -0.021) 6.185 33.099 ( 5.294 0.602 -0.225) 5.333 33.240 ( 7.376 -3.183 0.118) 8.035 33.308 ( 7.825 -8.171 0.258) 11.317 35.940 ( -2.920 13.476 -0.283) 13.792 36.439 ( -18.258 28.832 -5.245) 34.527 36.728 ( -8.433 -3.834 5.995) 11.034 37.852 ( -18.555 -17.946 0.142) 25.814 38.071 ( -5.384 10.679 -1.963) 12.120 38.254 ( -5.084 11.359 1.166) 12.500 38.909 ( -0.221 0.522 -9.217) 9.235 39.113 ( -5.227 -3.513 7.818) 10.039 39.238 ( -8.123 -9.122 -1.387) 12.293 39.664 ( -6.402 -1.949 -3.746) 7.670 39.865 ( -4.373 8.490 2.317) 9.827 39.928 ( -3.728 0.010 0.923) 3.840 40.869 ( -23.835 32.008 -10.325) 41.222 41.873 ( -22.176 -2.554 11.176) 24.964 41.983 ( -14.140 10.766 -5.041) 18.473 42.882 ( -25.786 -4.519 -0.714) 26.189 43.571 ( -7.220 10.612 12.718) 18.069 44.386 ( -9.150 -9.387 2.622) 13.368 45.030 ( -23.217 0.464 -2.695) 23.377 45.047 ( -15.578 0.281 -1.907) 15.697 70.090 ( -8.848 14.748 1.786) 17.291 70.900 ( -28.875 32.900 -1.527) 43.800 71.393 ( -21.579 -20.486 -10.837) 31.667 71.961 ( -33.834 1.863 0.469) 33.889 105.191 ( -2.007 1.038 2.044) 3.047 105.289 ( -2.464 -1.775 3.336) 4.511 105.372 ( -5.507 2.483 0.050) 6.041 105.480 ( -7.115 -1.044 -2.452) 7.598 ======================= Grid point 20 (13/102) ======================= q-point: ( 0.19 0.20 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 Number of triplets: 160 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.323 ( 29.489 24.715 17.521) 42.278 2.598 ( 33.854 24.816 1.657) 42.009 3.909 ( 26.083 -8.729 -2.441) 27.613 4.018 ( 39.570 12.909 2.501) 41.698 4.172 ( 17.209 -20.576 4.368) 27.177 4.237 ( 26.128 -3.388 -14.287) 29.971 4.396 ( 20.544 0.164 -6.338) 21.500 4.559 ( 18.024 -2.573 2.769) 18.416 4.725 ( 32.728 4.574 -4.806) 33.394 4.902 ( 15.968 -2.793 12.290) 20.343 5.069 ( 13.401 0.496 1.420) 13.485 5.222 ( 13.071 -4.896 7.443) 15.818 5.267 ( 28.977 6.458 -2.380) 29.783 5.557 ( 18.671 -6.019 5.475) 20.367 5.670 ( 23.974 0.475 -2.555) 24.114 6.079 ( 21.856 1.603 -2.538) 22.062 6.151 ( 7.164 3.310 -6.712) 10.360 6.281 ( 10.332 -3.886 1.952) 11.210 6.330 ( 8.365 0.883 2.373) 8.740 6.485 ( 7.028 7.739 2.319) 10.709 6.535 ( 4.767 -0.442 -1.377) 4.981 6.647 ( 17.126 4.452 -2.057) 17.815 6.752 ( 10.357 -2.364 -6.034) 12.217 6.873 ( 16.584 1.383 -2.669) 16.855 6.968 ( 28.555 -2.820 2.822) 28.833 7.173 ( 13.953 0.391 -0.355) 13.963 7.183 ( 6.855 1.652 -14.606) 16.219 7.324 ( 13.577 -6.312 3.593) 15.398 7.533 ( 6.229 -3.611 5.573) 9.105 7.635 ( 4.264 14.933 9.382) 18.144 7.648 ( 17.444 -4.000 -4.109) 18.362 7.844 ( 16.062 4.610 -4.821) 17.392 7.870 ( 7.292 -4.696 -10.046) 13.272 7.938 ( 6.064 -4.089 8.324) 11.081 8.078 ( 16.233 -1.055 -2.334) 16.434 8.310 ( 18.768 -6.240 -3.263) 20.045 8.334 ( 9.007 -2.799 2.133) 9.670 8.341 ( 18.531 6.700 -4.368) 20.183 8.422 ( 13.225 4.331 3.103) 14.258 8.543 ( 16.722 1.473 -1.298) 16.836 8.631 ( 16.403 -2.580 3.171) 16.904 8.799 ( 5.705 0.241 9.703) 11.259 8.829 ( 10.185 0.455 -2.781) 10.568 9.031 ( 2.308 -0.401 1.256) 2.658 9.150 ( 6.132 3.645 4.749) 8.570 9.273 ( 4.472 0.246 6.430) 7.836 9.429 ( 1.098 0.196 -9.860) 9.923 9.515 ( -0.133 0.368 -2.110) 2.146 9.721 ( -3.281 -9.026 -2.886) 10.028 9.885 ( -1.989 -11.255 -4.290) 12.209 10.078 ( 2.128 -4.759 -4.347) 6.788 10.262 ( 5.150 -10.798 0.894) 11.997 10.499 ( 12.997 3.307 3.534) 13.869 10.683 ( 10.439 -3.326 5.839) 12.415 11.017 ( -9.356 18.901 0.540) 21.097 11.296 ( -5.071 5.449 -5.548) 9.284 11.557 ( -3.371 6.858 -13.939) 15.896 11.607 ( -1.563 4.349 -9.547) 10.607 11.849 ( -3.563 3.027 17.802) 18.406 12.106 ( 0.225 -1.061 11.729) 11.779 12.270 ( -0.897 -1.833 1.558) 2.568 12.378 ( -4.265 1.492 1.707) 4.830 12.566 ( -1.578 -4.379 -0.896) 4.740 12.801 ( -10.358 -4.857 2.027) 11.618 13.027 ( 4.580 -1.962 0.267) 4.990 13.118 ( 6.373 0.677 -1.276) 6.535 13.299 ( 13.827 0.512 -0.965) 13.870 13.627 ( 8.453 -2.525 -3.460) 9.476 14.227 ( -2.235 -2.465 -1.847) 3.805 14.307 ( -2.301 -2.408 1.049) 3.492 14.414 ( -1.407 2.610 0.295) 2.979 14.586 ( -1.930 -1.586 4.150) 4.844 14.657 ( 0.175 -2.203 -0.016) 2.210 14.836 ( -3.526 4.302 1.239) 5.698 14.858 ( -4.150 0.624 -1.531) 4.467 14.988 ( -4.421 3.442 -8.176) 9.911 15.245 ( -6.435 -2.468 6.067) 9.182 15.354 ( -8.131 -2.499 3.076) 9.045 15.629 ( -9.822 -1.652 2.911) 10.377 15.648 ( -10.680 -2.971 -7.023) 13.123 17.925 ( -1.977 11.261 4.847) 12.418 18.194 ( -5.803 9.960 -3.597) 12.075 18.498 ( 3.502 0.017 1.985) 4.025 18.599 ( 0.576 -2.414 -1.632) 2.970 18.699 ( 1.877 3.285 -0.910) 3.892 18.875 ( -0.624 0.190 -1.792) 1.907 19.272 ( -4.530 -6.615 5.076) 9.489 19.315 ( -3.699 -8.181 -4.717) 10.142 19.631 ( 9.865 3.452 2.436) 10.732 19.671 ( 9.334 3.558 -2.327) 10.256 19.913 ( 7.763 -4.637 -3.346) 9.642 20.032 ( 5.173 -4.644 2.897) 7.531 20.648 ( 14.680 1.318 -3.043) 15.050 20.783 ( 15.460 -1.031 0.605) 15.506 20.810 ( 14.948 0.092 -0.277) 14.951 20.870 ( 14.922 -0.886 4.380) 15.576 21.350 ( 23.278 1.811 -4.647) 23.806 21.487 ( 20.722 4.696 4.994) 21.826 21.674 ( 25.289 -3.379 -6.168) 26.249 22.509 ( 8.631 -22.645 4.372) 24.625 24.389 ( -0.607 0.316 -0.183) 0.709 24.443 ( -3.968 0.190 -1.086) 4.118 24.510 ( -1.551 1.437 0.216) 2.126 24.564 ( 0.383 -0.728 -0.367) 0.901 28.639 ( 2.283 4.323 0.181) 4.892 28.691 ( 1.689 7.025 -0.460) 7.240 28.988 ( -0.022 -4.435 3.487) 5.642 29.184 ( -2.531 -6.548 -1.529) 7.185 29.357 ( -3.054 3.387 -1.480) 4.795 29.497 ( -2.109 -0.100 0.244) 2.126 29.548 ( -1.841 0.280 -0.665) 1.977 29.591 ( -2.581 0.819 0.585) 2.771 33.195 ( 7.377 2.270 -0.028) 7.719 33.220 ( 6.686 1.103 -0.195) 6.779 33.401 ( 8.364 -3.802 0.195) 9.190 33.458 ( 7.252 -6.092 0.146) 9.472 35.876 ( -3.270 11.181 -0.610) 11.666 36.144 ( -11.120 20.853 -1.473) 23.678 36.557 ( -9.281 -4.672 2.048) 10.591 37.439 ( -21.707 -15.519 0.342) 26.686 37.959 ( -5.251 11.182 -1.621) 12.459 38.152 ( -5.552 11.454 1.610) 12.830 38.870 ( -1.813 -1.593 -7.647) 8.019 38.991 ( -7.232 -6.918 3.849) 10.723 39.106 ( -5.939 -7.978 3.784) 10.641 39.502 ( -8.562 -2.468 -4.382) 9.930 39.762 ( -6.543 9.061 4.480) 12.041 39.824 ( -6.654 -0.720 -0.634) 6.723 40.503 ( -13.161 13.907 -6.442) 20.202 41.431 ( -23.703 -1.880 14.715) 27.962 41.660 ( -16.501 4.798 -10.053) 19.909 42.323 ( -29.187 -4.815 0.563) 29.587 43.439 ( -7.905 9.750 7.500) 14.622 44.183 ( -11.132 -8.009 -1.294) 13.775 44.520 ( -24.768 2.701 -0.312) 24.917 44.731 ( -16.344 -2.153 -2.027) 16.609 69.889 ( -11.319 11.354 2.178) 16.179 70.391 ( -22.189 17.717 -5.546) 28.931 70.904 ( -25.283 -15.037 -2.458) 29.519 71.257 ( -35.453 -2.176 2.827) 35.632 105.147 ( -2.790 0.999 2.301) 3.752 105.233 ( -3.609 -1.054 1.874) 4.201 105.264 ( -5.208 1.007 -0.659) 5.345 105.327 ( -7.380 -0.626 -2.394) 7.784 ======================= Grid point 21 (14/102) ======================= q-point: ( 0.25 0.20 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 Number of triplets: 162 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.968 ( 30.994 17.582 16.123) 39.111 3.298 ( 35.162 14.341 1.416) 38.000 4.360 ( 20.170 -9.192 -2.411) 22.297 4.495 ( 15.408 -19.049 5.457) 25.101 4.652 ( 18.316 -5.525 -7.773) 20.650 4.682 ( 24.707 4.050 -1.517) 25.083 4.773 ( 18.096 0.409 -6.963) 19.394 4.904 ( 17.743 -2.109 -2.561) 18.050 5.138 ( 13.755 -4.937 2.883) 14.896 5.263 ( 12.216 -0.531 9.375) 15.408 5.409 ( 17.023 1.291 0.667) 17.085 5.590 ( 24.216 9.743 -5.371) 26.649 5.784 ( 21.666 3.586 1.724) 22.028 5.895 ( 10.899 -1.336 6.958) 12.999 6.077 ( 15.550 -8.065 1.666) 17.597 6.253 ( 3.156 3.507 -1.256) 4.882 6.374 ( 15.105 -3.253 -7.610) 17.224 6.424 ( 2.136 6.526 10.085) 12.200 6.554 ( 4.624 6.265 1.323) 7.899 6.727 ( 24.383 -4.595 -2.279) 24.916 6.759 ( 5.485 -4.792 -4.017) 8.318 6.792 ( 17.444 11.331 -3.707) 21.128 7.040 ( 9.981 12.071 -0.131) 15.663 7.064 ( 6.537 7.158 -6.640) 11.750 7.251 ( 5.245 8.484 -15.533) 18.460 7.390 ( 11.044 -2.802 2.649) 11.697 7.450 ( 7.323 -1.813 -3.411) 8.280 7.623 ( 10.164 -10.403 6.254) 15.831 7.713 ( 6.771 1.474 2.279) 7.295 7.872 ( 21.467 0.468 5.145) 22.079 7.942 ( 13.404 0.600 8.031) 15.637 8.127 ( 12.837 2.407 -6.259) 14.483 8.149 ( 22.401 -4.635 -3.532) 23.146 8.185 ( 15.914 -0.234 -4.968) 16.673 8.298 ( 4.020 -2.572 1.172) 4.914 8.422 ( 5.926 2.294 10.788) 12.520 8.482 ( 1.059 -1.599 -2.730) 3.336 8.679 ( 15.771 -2.426 -3.658) 16.371 8.776 ( 8.248 -0.583 3.417) 8.947 8.847 ( 15.344 1.664 -0.835) 15.457 8.927 ( 12.638 -3.116 0.583) 13.029 9.051 ( 17.614 -2.557 1.782) 17.888 9.117 ( 16.481 -0.548 1.507) 16.558 9.195 ( 13.700 -1.678 5.599) 14.895 9.353 ( 10.685 0.017 1.922) 10.857 9.422 ( 5.664 3.301 -10.401) 12.295 9.440 ( 8.023 -5.831 2.922) 10.340 9.553 ( 0.681 -5.566 0.488) 5.629 9.678 ( 4.016 -0.969 -2.701) 4.936 9.815 ( 2.517 0.597 -2.643) 3.698 10.086 ( 2.351 -1.121 -7.110) 7.572 10.439 ( 8.615 -9.458 0.397) 12.800 10.766 ( 6.685 6.515 3.029) 9.814 10.857 ( 3.965 8.123 8.616) 12.488 10.915 ( 5.335 4.206 2.228) 7.150 11.223 ( 0.184 0.426 -10.030) 10.041 11.492 ( 0.101 6.162 -16.328) 17.452 11.596 ( 1.697 3.458 -0.071) 3.852 11.825 ( -2.381 2.134 16.398) 16.707 12.124 ( -0.547 -1.438 6.160) 6.349 12.238 ( -1.660 0.043 1.146) 2.018 12.324 ( -0.879 0.434 2.520) 2.704 12.488 ( -4.071 -4.170 -1.551) 6.030 12.602 ( -8.600 -7.453 2.477) 11.646 13.091 ( 2.446 6.023 2.565) 6.988 13.271 ( 7.421 1.931 -3.145) 8.288 13.566 ( 11.503 -2.995 -3.109) 12.286 13.773 ( 5.645 -3.678 -1.668) 6.941 14.181 ( -1.866 -2.474 -1.766) 3.567 14.250 ( -3.534 -1.105 2.907) 4.708 14.412 ( 1.114 -1.759 -1.965) 2.863 14.566 ( -0.836 -0.937 3.142) 3.384 14.661 ( 0.183 -1.874 1.329) 2.305 14.761 ( -4.733 -3.985 1.745) 6.428 14.778 ( -2.693 3.113 -3.637) 5.493 14.904 ( -2.506 2.869 -5.504) 6.694 15.120 ( -6.769 -0.533 4.262) 8.016 15.226 ( -4.974 -2.029 2.032) 5.744 15.431 ( -8.250 -4.359 -3.022) 9.808 15.496 ( -5.691 -2.696 0.122) 6.298 17.888 ( -2.324 11.661 3.695) 12.451 18.075 ( -4.992 12.140 -2.900) 13.443 18.542 ( 0.486 0.533 1.818) 1.956 18.594 ( -0.008 -5.373 -1.432) 5.561 18.734 ( 1.234 3.475 -1.094) 3.847 18.853 ( -1.296 0.826 -0.280) 1.563 19.187 ( -4.935 -5.263 4.079) 8.288 19.229 ( -3.792 -7.062 -4.050) 8.981 19.840 ( 10.082 2.621 1.237) 10.490 19.861 ( 9.539 3.135 -1.317) 10.127 20.059 ( 7.317 -3.053 -2.272) 8.247 20.137 ( 4.543 -3.257 2.096) 5.970 20.954 ( 16.104 1.104 -3.376) 16.491 21.091 ( 15.395 -2.152 -3.186) 15.868 21.131 ( 16.220 0.808 2.847) 16.488 21.187 ( 15.424 -0.801 4.488) 16.084 21.791 ( 21.116 2.760 -3.801) 21.632 21.875 ( 16.747 6.033 4.579) 18.380 22.150 ( 22.832 -4.997 -4.325) 23.769 22.642 ( 4.600 -12.702 3.385) 13.927 24.366 ( -2.931 0.257 -1.116) 3.147 24.389 ( 0.316 -0.771 -0.085) 0.838 24.493 ( -0.255 1.906 0.517) 1.991 24.577 ( 0.977 -0.876 -0.756) 1.515 28.691 ( 2.890 3.590 -0.066) 4.609 28.737 ( 2.834 4.778 0.175) 5.558 28.991 ( -0.390 -3.928 2.923) 4.911 29.127 ( -2.786 -5.138 -1.381) 6.006 29.296 ( -2.654 3.414 -1.188) 4.485 29.457 ( -1.923 -1.260 -0.132) 2.303 29.507 ( -2.144 0.413 -0.288) 2.203 29.537 ( -2.756 0.630 0.460) 2.865 33.347 ( 7.591 2.307 -0.032) 7.934 33.357 ( 6.870 1.601 -0.104) 7.055 33.566 ( 7.842 -4.117 0.313) 8.862 33.600 ( 6.865 -4.173 -0.052) 8.033 35.812 ( -2.796 8.648 -0.977) 9.141 35.968 ( -6.581 14.080 -0.074) 15.542 36.374 ( -9.050 -4.633 1.139) 10.231 37.016 ( -20.069 -12.723 -0.203) 23.763 37.862 ( -4.131 11.863 -0.245) 12.564 38.034 ( -6.449 11.121 0.624) 12.870 38.807 ( -3.045 -6.419 -5.193) 8.800 38.873 ( -4.972 -4.678 3.227) 7.551 38.999 ( -5.435 -7.690 3.347) 9.994 39.314 ( -9.099 -3.414 -4.261) 10.611 39.626 ( -7.960 9.262 5.778) 13.510 39.667 ( -8.497 -1.648 -2.380) 8.976 40.274 ( -8.883 5.015 -5.479) 11.579 41.009 ( -20.965 -0.916 13.106) 24.742 41.295 ( -17.412 1.686 -9.524) 19.918 41.745 ( -28.132 -3.392 1.216) 28.362 43.293 ( -7.808 9.043 5.078) 12.982 43.925 ( -14.226 -2.180 -10.000) 17.525 44.089 ( -17.650 -0.365 8.045) 19.400 44.401 ( -15.786 -3.844 -1.940) 16.363 69.658 ( -11.919 8.104 2.254) 14.588 69.972 ( -18.537 9.585 -5.324) 21.536 70.400 ( -24.183 -10.019 0.081) 26.177 70.592 ( -30.855 -3.206 2.236) 31.102 105.092 ( -3.110 0.806 2.101) 3.839 105.155 ( -4.258 0.186 -1.638) 4.566 105.164 ( -4.735 -0.675 1.340) 4.967 105.185 ( -6.140 -0.152 -1.440) 6.308 ======================= Grid point 22 (15/102) ======================= q-point: ( 0.31 0.20 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 Number of triplets: 160 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.619 ( 30.563 12.330 14.298) 35.924 3.986 ( 32.636 5.997 0.602) 33.188 4.710 ( 15.204 -8.249 -0.697) 17.312 4.795 ( 13.101 -10.000 1.146) 16.521 4.904 ( 9.419 -10.966 1.052) 14.495 5.067 ( 12.814 -1.744 -0.477) 12.940 5.093 ( 17.030 1.397 -6.245) 18.193 5.284 ( 20.355 -2.828 -10.461) 23.060 5.414 ( 13.452 -4.824 5.194) 15.206 5.500 ( 10.309 -0.202 5.096) 11.502 5.717 ( 14.433 7.710 2.465) 16.548 5.937 ( 11.605 1.496 -6.741) 13.503 6.036 ( 5.387 1.815 5.981) 8.251 6.176 ( 12.522 0.268 -3.279) 12.946 6.277 ( 1.807 6.080 2.113) 6.686 6.303 ( 8.162 -3.977 -0.293) 9.084 6.483 ( 2.948 8.780 8.457) 12.541 6.594 ( 3.016 3.354 4.647) 6.476 6.711 ( 13.272 -3.362 -16.925) 21.769 6.885 ( 7.124 2.467 -0.103) 7.540 6.989 ( 3.808 11.816 1.152) 12.468 7.077 ( 6.043 7.865 6.948) 12.109 7.159 ( 6.358 4.761 -13.688) 15.826 7.281 ( 11.142 2.767 -2.980) 11.861 7.423 ( 6.468 0.905 2.056) 6.847 7.485 ( -3.235 -5.504 1.308) 6.517 7.543 ( 18.337 -1.830 -1.928) 18.529 7.767 ( 4.328 -1.718 -2.788) 5.427 7.803 ( -1.308 2.499 -8.561) 9.014 8.157 ( 10.167 2.595 10.272) 14.684 8.187 ( 4.401 1.163 6.609) 8.025 8.279 ( 2.168 -0.676 1.514) 2.729 8.364 ( 8.034 -6.014 -5.933) 11.658 8.450 ( 2.619 -0.583 4.822) 5.518 8.512 ( 14.539 -3.599 -2.289) 15.152 8.592 ( 6.258 2.710 11.355) 13.246 8.667 ( 14.350 -1.982 -0.369) 14.491 8.826 ( -0.553 -4.231 6.103) 7.447 8.930 ( 0.022 -1.350 -4.021) 4.242 9.007 ( 6.046 -11.889 -8.372) 15.748 9.076 ( 11.648 4.706 -1.311) 12.631 9.294 ( 4.816 -2.289 -1.948) 5.677 9.417 ( 14.040 0.067 6.709) 15.560 9.448 ( 8.165 -3.911 0.678) 9.079 9.573 ( 13.472 -2.311 -5.397) 14.695 9.651 ( 13.260 1.865 -5.083) 14.323 9.676 ( 20.830 0.214 -0.187) 20.832 9.720 ( 15.741 1.625 -0.788) 15.844 9.912 ( 14.730 -0.674 0.134) 14.746 10.011 ( 13.838 4.221 0.653) 14.482 10.155 ( 6.701 2.548 -6.535) 9.701 10.569 ( 5.691 -2.981 -1.817) 6.677 10.834 ( 4.448 5.916 5.051) 8.961 10.994 ( 5.794 1.876 6.866) 9.178 11.089 ( 8.699 1.325 3.044) 9.311 11.274 ( 5.376 -3.264 -2.997) 6.967 11.489 ( 2.825 3.120 -13.511) 14.152 11.668 ( 4.503 -0.928 -0.862) 4.678 11.831 ( 0.378 3.602 13.508) 13.985 12.128 ( 1.536 -2.400 1.588) 3.262 12.244 ( 2.477 -0.154 -0.511) 2.534 12.364 ( 5.025 2.883 1.713) 6.041 12.440 ( -0.490 -2.910 -0.284) 2.965 12.528 ( 1.588 -6.491 3.048) 7.345 13.122 ( -0.001 9.486 1.872) 9.668 13.365 ( 2.262 2.445 -2.534) 4.185 13.719 ( 4.028 -3.558 -3.492) 6.409 13.822 ( -0.550 -2.418 -1.027) 2.684 14.138 ( -2.452 -0.821 -1.652) 3.068 14.199 ( -1.721 -1.934 3.866) 4.653 14.439 ( 1.876 -4.534 -3.312) 5.920 14.559 ( -0.547 1.612 1.667) 2.383 14.669 ( -3.059 -3.236 5.356) 6.965 14.683 ( 0.213 -3.607 -1.588) 3.947 14.732 ( -1.201 -3.272 -1.376) 3.747 14.857 ( -1.392 4.608 -4.615) 6.669 15.012 ( -4.277 0.293 1.711) 4.615 15.153 ( -2.972 -1.325 0.598) 3.308 15.289 ( -5.564 -6.307 -2.094) 8.667 15.402 ( -4.170 -2.729 1.483) 5.200 17.855 ( -1.546 12.070 2.621) 12.448 17.988 ( -3.106 12.799 -2.120) 13.340 18.532 ( -1.357 0.499 1.190) 1.873 18.602 ( 0.923 -6.129 -1.509) 6.379 18.742 ( -0.021 2.730 -0.815) 2.849 18.828 ( -1.000 0.194 0.571) 1.168 19.093 ( -5.189 -4.880 3.355) 7.874 19.146 ( -3.816 -5.858 -3.341) 7.748 20.024 ( 7.729 2.324 1.361) 8.185 20.032 ( 7.674 2.269 -1.610) 8.163 20.190 ( 5.923 -1.939 -1.237) 6.354 20.217 ( 3.144 -2.006 1.281) 3.943 21.262 ( 15.010 0.903 -3.109) 15.355 21.380 ( 13.922 -1.924 -2.951) 14.361 21.448 ( 14.431 0.648 2.616) 14.681 21.492 ( 13.887 -0.552 3.360) 14.298 22.161 ( 15.611 3.909 -1.942) 16.210 22.176 ( 13.127 5.228 2.587) 14.364 22.553 ( 17.795 -5.335 -2.576) 18.755 22.723 ( 2.967 -7.441 2.793) 8.484 24.316 ( -1.760 0.759 -0.918) 2.125 24.407 ( 1.285 -2.187 -0.042) 2.537 24.503 ( 1.099 2.273 0.741) 2.632 24.598 ( 1.247 -0.750 -0.837) 1.679 28.753 ( 3.202 2.691 -0.160) 4.186 28.800 ( 3.351 2.919 0.488) 4.471 28.982 ( -1.039 -2.990 2.170) 3.838 29.071 ( -2.457 -3.653 -1.230) 4.571 29.249 ( -1.776 3.114 -0.828) 3.679 29.417 ( -2.079 -2.122 -0.549) 3.021 29.464 ( -2.052 0.637 0.050) 2.149 29.485 ( -2.400 0.565 0.467) 2.509 33.486 ( 5.874 1.980 -0.071) 6.199 33.491 ( 6.563 2.486 0.021) 7.019 33.708 ( 6.097 -3.818 0.274) 7.199 33.732 ( 6.290 -3.078 -0.134) 7.005 35.766 ( -1.492 6.132 -1.263) 6.436 35.874 ( -3.032 9.165 0.640) 9.675 36.205 ( -7.948 -4.144 1.053) 9.025 36.650 ( -16.187 -9.686 -0.634) 18.874 37.795 ( -2.647 11.910 0.989) 12.240 37.902 ( -6.591 11.212 -0.684) 13.024 38.742 ( -2.385 -9.495 -1.641) 9.926 38.797 ( -3.661 -4.959 2.041) 6.493 38.912 ( -3.403 -5.852 1.417) 6.916 39.128 ( -8.336 -3.322 -3.571) 9.658 39.473 ( -8.431 5.697 2.165) 10.403 39.488 ( -8.425 0.095 0.254) 8.430 40.117 ( -5.731 0.530 -4.801) 7.495 40.657 ( -16.498 1.685 10.733) 19.754 40.939 ( -16.049 -1.656 -7.777) 17.910 41.221 ( -23.996 -1.227 1.249) 24.060 43.154 ( -6.814 8.531 3.660) 11.515 43.599 ( -14.675 4.900 -8.184) 17.503 43.836 ( -10.593 -5.538 6.542) 13.627 44.105 ( -13.168 -4.908 -1.678) 14.153 69.433 ( -10.775 5.527 2.025) 12.278 69.630 ( -14.413 5.340 -4.488) 16.012 69.955 ( -20.177 -6.655 1.877) 21.329 70.049 ( -23.327 -2.631 0.419) 23.479 105.035 ( -2.884 0.428 1.456) 3.259 105.057 ( -4.794 0.060 -1.713) 5.091 105.072 ( -4.045 -0.021 -1.049) 4.179 105.092 ( -3.752 -0.382 1.412) 4.027 ======================= Grid point 23 (16/102) ======================= q-point: ( 0.38 0.20 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 Number of triplets: 162 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 4.241 ( 28.363 7.766 12.122) 31.807 4.565 ( 23.752 1.315 -0.722) 23.800 4.963 ( 8.930 -6.871 3.075) 11.680 5.006 ( 9.136 -2.838 -5.598) 11.084 5.077 ( 8.210 -10.798 4.219) 14.206 5.308 ( 10.718 -4.783 0.983) 11.778 5.354 ( 10.837 4.412 -5.887) 13.098 5.618 ( 14.001 -3.482 0.501) 14.436 5.681 ( 8.747 3.887 1.046) 9.629 5.701 ( 11.417 -2.614 1.812) 11.851 5.996 ( 11.395 2.237 0.400) 11.620 6.097 ( 7.348 -0.793 -2.971) 7.965 6.165 ( 6.420 -0.307 0.514) 6.448 6.219 ( 0.328 4.166 -4.336) 6.022 6.338 ( -0.082 4.501 0.765) 4.566 6.425 ( 3.852 1.226 -3.188) 5.148 6.610 ( 6.562 10.701 8.376) 15.091 6.692 ( 6.007 3.717 4.360) 8.301 6.833 ( 2.603 -3.209 -17.843) 18.315 6.983 ( 1.795 2.392 -3.810) 4.843 7.025 ( 3.527 13.492 -0.236) 13.947 7.146 ( -0.337 -5.705 3.311) 6.605 7.230 ( 2.735 2.834 -2.639) 4.741 7.370 ( -4.669 -0.227 -0.969) 4.774 7.444 ( 3.072 -4.291 6.049) 8.028 7.543 ( 1.180 5.441 -0.952) 5.648 7.691 ( 1.896 3.694 1.114) 4.299 7.817 ( 6.529 -2.465 -3.276) 7.709 7.899 ( 3.431 -3.326 -0.734) 4.835 8.210 ( -6.323 -2.582 7.734) 10.318 8.270 ( 3.807 -1.639 -5.310) 6.736 8.365 ( 2.328 0.542 3.794) 4.484 8.394 ( -1.790 -4.524 1.238) 5.020 8.536 ( -0.706 -1.953 8.816) 9.058 8.579 ( -6.223 -2.848 -6.392) 9.365 8.638 ( 2.013 -1.922 3.838) 4.741 8.750 ( -3.348 -0.485 -1.374) 3.651 8.860 ( 6.405 0.476 5.255) 8.299 8.898 ( 3.189 1.965 2.691) 4.613 9.096 ( 4.428 -2.859 -4.461) 6.906 9.371 ( 7.712 4.179 -9.917) 13.240 9.500 ( 16.982 1.565 2.605) 17.252 9.619 ( 9.732 -3.541 -1.959) 10.539 9.687 ( 7.736 -2.060 -3.007) 8.551 9.788 ( 10.927 0.030 0.989) 10.972 9.871 ( 8.344 4.683 -5.568) 11.070 9.935 ( 11.720 3.467 -3.414) 12.690 10.081 ( 13.091 0.039 4.450) 13.827 10.185 ( 11.985 -1.023 -0.915) 12.063 10.322 ( 13.848 4.512 -1.924) 14.691 10.372 ( 17.725 -2.662 -0.993) 17.951 10.707 ( 8.046 -1.779 -1.054) 8.308 10.925 ( 2.962 5.088 6.353) 8.662 11.136 ( 6.312 -0.676 4.288) 7.661 11.222 ( 3.367 -0.375 0.826) 3.487 11.382 ( 4.074 -2.969 6.446) 8.183 11.558 ( 6.456 -2.188 -9.598) 11.772 11.717 ( 0.742 -4.288 -0.306) 4.363 11.914 ( 5.024 2.800 5.617) 8.039 12.238 ( 8.867 -3.728 0.509) 9.633 12.339 ( 7.316 -1.033 -2.094) 7.679 12.465 ( 4.432 -6.062 -0.193) 7.512 12.559 ( 12.445 5.082 1.844) 13.568 12.666 ( 11.307 1.487 1.425) 11.494 13.107 ( -1.308 11.280 0.891) 11.390 13.343 ( -4.168 2.498 -1.011) 4.963 13.691 ( -6.307 -2.744 -1.525) 7.045 13.767 ( -4.303 -0.553 -2.060) 4.803 14.075 ( -3.333 -0.199 -0.544) 3.383 14.199 ( 0.727 0.328 3.185) 3.284 14.463 ( 1.045 -5.313 -4.264) 6.892 14.551 ( -0.414 0.647 1.533) 1.715 14.607 ( -2.762 -3.738 1.863) 5.007 14.697 ( -0.225 -7.434 2.784) 7.941 14.743 ( 2.307 -1.310 -1.533) 3.064 14.824 ( -0.810 4.174 -3.165) 5.300 14.963 ( -0.827 1.154 -0.329) 1.457 15.100 ( -2.325 -0.498 -0.901) 2.543 15.191 ( -4.220 -8.645 -0.636) 9.641 15.327 ( -3.845 -3.216 2.152) 5.456 17.838 ( -0.599 12.501 1.714) 12.632 17.940 ( -1.397 12.713 -1.446) 12.871 18.503 ( -1.620 0.149 0.907) 1.862 18.616 ( 0.670 -4.345 -1.913) 4.794 18.741 ( 0.417 0.570 -0.602) 0.928 18.821 ( 0.217 -1.290 1.157) 1.747 18.996 ( -5.063 -4.751 3.112) 7.608 19.061 ( -3.946 -4.846 -2.973) 6.921 20.148 ( 4.573 1.713 0.738) 4.939 20.160 ( 5.194 1.992 -1.012) 5.654 20.268 ( 1.827 -1.166 0.850) 2.328 20.288 ( 3.921 -1.207 -0.733) 4.168 21.528 ( 11.726 0.772 -2.445) 12.003 21.624 ( 10.646 -1.575 -1.970) 10.940 21.708 ( 10.825 0.615 2.174) 11.058 21.745 ( 10.542 -0.356 1.797) 10.700 22.377 ( 7.909 4.271 1.881) 9.184 22.436 ( 10.853 4.510 -1.545) 11.853 22.770 ( 1.837 -4.903 1.847) 5.552 22.848 ( 11.496 -5.080 -1.149) 12.621 24.291 ( -0.677 1.237 -0.645) 1.551 24.437 ( 1.602 -2.981 0.096) 3.385 24.535 ( 1.780 2.069 0.625) 2.800 24.621 ( 1.072 -0.475 -0.629) 1.331 28.815 ( 2.910 1.681 -0.127) 3.363 28.868 ( 3.173 1.406 0.568) 3.517 28.961 ( -1.258 -1.665 1.312) 2.465 29.026 ( -1.775 -2.246 -1.022) 3.039 29.222 ( -0.846 2.344 -0.428) 2.529 29.372 ( -2.237 -1.888 -0.647) 2.998 29.421 ( -2.230 0.593 0.161) 2.313 29.451 ( -1.123 0.231 0.416) 1.220 33.586 ( 4.026 2.314 0.020) 4.644 33.605 ( 4.715 2.814 -0.028) 5.491 33.810 ( 4.121 -3.021 0.054) 5.110 33.844 ( 4.801 -2.847 -0.004) 5.581 35.751 ( 0.339 3.709 -1.351) 3.962 35.845 ( -0.077 5.279 0.875) 5.352 36.063 ( -6.509 -3.164 1.258) 7.345 36.368 ( -11.814 -6.789 -0.880) 13.654 37.756 ( -1.885 11.512 0.485) 11.675 37.780 ( -4.822 11.721 -0.212) 12.676 38.708 ( -0.920 -10.116 0.187) 10.160 38.728 ( -3.347 -8.477 0.276) 9.118 38.876 ( -0.618 -2.984 1.232) 3.287 38.976 ( -5.917 -1.626 -2.465) 6.613 39.298 ( -8.114 -0.905 -3.654) 8.944 39.347 ( -6.544 3.024 4.778) 8.648 40.026 ( -2.409 -1.297 -3.702) 4.603 40.399 ( -11.129 5.195 7.179) 14.226 40.626 ( -14.018 -4.999 -4.174) 15.457 40.808 ( -16.923 0.696 0.224) 16.939 43.041 ( -5.026 8.180 2.502) 9.922 43.333 ( -10.299 6.796 -4.604) 13.170 43.670 ( -7.141 -6.207 3.480) 10.082 43.875 ( -9.300 -5.515 -1.268) 10.886 69.244 ( -8.237 3.748 1.499) 9.173 69.382 ( -9.461 3.164 -3.599) 10.606 69.601 ( -15.623 -3.922 3.035) 16.391 69.673 ( -14.073 -2.453 -0.969) 14.318 104.971 ( -3.341 0.151 -0.999) 3.491 104.985 ( -2.367 -0.209 0.220) 2.386 105.002 ( -2.633 0.380 -0.289) 2.676 105.028 ( -2.850 -0.278 1.096) 3.066 ======================= Grid point 24 (17/102) ======================= q-point: ( 0.44 0.20 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 Number of triplets: 160 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 4.774 ( 20.788 1.911 7.478) 22.174 4.897 ( 10.750 1.826 -0.347) 10.910 5.084 ( 2.736 -0.716 1.415) 3.163 5.128 ( 4.956 -7.230 1.838) 8.956 5.281 ( 9.096 -5.949 -1.614) 10.988 5.447 ( 3.454 -1.358 -4.201) 5.606 5.520 ( 5.428 7.414 0.707) 9.216 5.791 ( 2.737 2.092 -0.978) 3.581 5.873 ( 10.528 -2.768 8.677) 13.921 5.910 ( 8.966 2.648 1.453) 9.461 6.096 ( 1.159 1.644 -0.139) 2.016 6.170 ( -0.825 -2.441 -2.273) 3.435 6.235 ( -0.812 -0.277 -3.689) 3.787 6.312 ( 9.175 3.283 -2.407) 10.038 6.385 ( 4.786 6.671 -0.853) 8.254 6.444 ( -0.946 1.881 -1.997) 2.902 6.705 ( -3.099 2.558 1.840) 4.420 6.728 ( -5.719 -2.963 -11.269) 12.980 6.835 ( 9.493 6.406 1.944) 11.616 7.061 ( 7.434 -1.410 -9.835) 12.409 7.084 ( 1.409 3.009 -0.039) 3.322 7.169 ( 2.709 -3.425 4.458) 6.241 7.235 ( -1.872 2.957 3.747) 5.128 7.308 ( 0.622 0.866 -0.225) 1.089 7.438 ( -2.789 0.174 1.580) 3.210 7.594 ( 5.295 -3.286 4.496) 7.684 7.789 ( -3.240 -3.530 1.589) 5.048 7.830 ( 0.958 5.757 -3.263) 6.686 7.933 ( 1.008 -6.577 4.443) 8.001 8.036 ( -10.319 -5.815 5.827) 13.200 8.137 ( -11.842 -5.653 -3.907) 13.691 8.304 ( 0.772 -0.017 -1.273) 1.489 8.384 ( -7.548 1.854 -6.174) 9.926 8.472 ( -4.925 4.440 2.604) 7.124 8.527 ( 3.610 -0.785 2.326) 4.366 8.625 ( -2.294 0.350 2.194) 3.193 8.833 ( 5.734 -3.142 3.928) 7.628 8.916 ( 3.461 -1.139 -3.060) 4.758 9.071 ( 6.714 7.879 7.267) 12.647 9.154 ( 2.871 0.214 -2.934) 4.111 9.383 ( -1.872 5.250 -10.630) 12.002 9.692 ( -0.895 -2.095 -2.609) 3.464 9.779 ( 7.138 3.137 7.249) 10.646 9.829 ( 8.905 -4.909 -4.105) 10.966 9.962 ( 5.509 1.959 -2.175) 6.239 10.046 ( 8.424 1.533 -2.707) 8.980 10.136 ( 7.168 3.790 0.513) 8.124 10.256 ( 5.363 4.651 3.622) 7.970 10.389 ( 8.314 -2.422 -4.406) 9.716 10.563 ( 10.873 0.499 -3.940) 11.576 10.700 ( 11.526 -0.045 4.296) 12.300 10.852 ( 5.521 -3.033 0.452) 6.315 10.986 ( 3.070 3.595 1.185) 4.873 11.220 ( -3.135 -0.148 3.176) 4.465 11.247 ( 3.728 -1.172 1.841) 4.319 11.435 ( -0.308 -3.776 5.218) 6.448 11.653 ( 3.245 -4.650 -4.429) 7.195 11.751 ( 3.236 -6.208 -0.265) 7.006 12.005 ( 2.765 1.036 1.470) 3.298 12.366 ( 2.317 -5.759 -0.862) 6.267 12.545 ( 12.500 -0.430 0.850) 12.537 12.637 ( 12.473 -2.835 -1.750) 12.910 12.835 ( 12.974 2.421 0.288) 13.201 12.939 ( 13.146 3.094 0.683) 13.522 13.108 ( 3.088 11.430 -0.146) 11.841 13.198 ( -9.863 1.963 1.193) 10.127 13.497 ( -12.017 0.247 -0.520) 12.031 13.627 ( -9.228 2.326 -1.729) 9.673 14.011 ( -2.753 0.046 -0.293) 2.769 14.231 ( 1.501 4.724 2.488) 5.546 14.459 ( -0.496 -6.229 -3.034) 6.946 14.551 ( 0.053 -2.325 0.687) 2.425 14.568 ( -1.486 -3.193 0.844) 3.621 14.700 ( -0.030 -8.431 2.420) 8.771 14.767 ( 0.304 5.366 -3.558) 6.446 14.835 ( 2.107 -2.487 0.236) 3.268 14.967 ( 0.861 1.474 -0.353) 1.743 15.059 ( -1.238 -0.212 -1.755) 2.158 15.112 ( -3.555 -10.247 0.461) 10.856 15.258 ( -3.192 -4.042 1.761) 5.443 17.836 ( -0.050 12.899 0.890) 12.930 17.922 ( -0.359 12.379 -0.796) 12.410 18.476 ( -1.137 -0.025 0.522) 1.251 18.618 ( -0.083 -1.081 -1.184) 1.606 18.765 ( 2.159 -3.191 -1.397) 4.099 18.844 ( 1.750 -2.847 1.697) 3.748 18.906 ( -4.472 -4.396 2.874) 6.898 18.977 ( -3.752 -3.953 -2.645) 6.058 20.215 ( 2.124 1.171 0.178) 2.432 20.234 ( 2.442 2.045 -0.338) 3.203 20.295 ( 0.806 -0.663 0.395) 1.116 20.345 ( 1.869 -0.837 -0.323) 2.073 21.709 ( 6.572 0.690 -1.437) 6.762 21.787 ( 5.718 -1.241 -0.849) 5.913 21.884 ( 6.204 0.529 1.523) 6.410 21.909 ( 5.357 -0.110 0.420) 5.375 22.498 ( 3.937 3.340 0.823) 5.228 22.595 ( 5.297 4.970 -0.802) 7.308 22.795 ( 0.459 -3.481 1.234) 3.722 23.018 ( 5.634 -5.095 -0.623) 7.622 24.283 ( -0.127 1.640 -0.322) 1.676 24.466 ( 1.167 -3.240 0.115) 3.446 24.569 ( 1.361 1.452 0.330) 2.018 24.636 ( 0.522 -0.122 -0.315) 0.622 28.861 ( 1.496 0.857 -0.088) 1.726 28.923 ( 1.871 -0.182 0.703) 2.007 28.947 ( -0.023 -0.309 0.524) 0.609 28.995 ( -1.158 -1.073 -0.846) 1.790 29.211 ( -0.280 1.645 -0.130) 1.673 29.331 ( -1.554 -1.362 -0.440) 2.113 29.382 ( -1.555 0.882 0.177) 1.796 29.437 ( -0.410 -0.322 0.189) 0.555 33.646 ( 1.964 2.527 0.026) 3.201 33.677 ( 2.422 3.239 -0.028) 4.045 33.873 ( 2.105 -2.677 -0.011) 3.405 33.919 ( 2.561 -2.624 0.025) 3.667 35.772 ( 1.942 1.382 -1.196) 2.667 35.867 ( 1.690 1.727 0.523) 2.472 35.952 ( -4.661 -1.320 1.576) 5.094 36.172 ( -7.411 -4.181 -0.908) 8.557 37.685 ( -2.977 11.400 -1.201) 11.844 37.748 ( -0.479 11.979 1.432) 12.073 38.669 ( -2.196 -11.489 -0.336) 11.701 38.703 ( 0.046 -9.382 0.058) 9.382 38.854 ( -2.471 -0.227 0.503) 2.532 38.922 ( 1.388 -0.346 0.155) 1.438 39.145 ( -6.240 -2.160 -3.296) 7.380 39.248 ( -3.969 -0.494 2.968) 4.980 40.007 ( 1.084 -0.774 -1.911) 2.329 40.245 ( -5.091 7.616 1.837) 9.343 40.364 ( -11.248 -4.952 0.948) 12.326 40.558 ( -7.930 -0.718 -1.140) 8.044 42.967 ( -2.669 7.962 1.293) 8.496 43.171 ( -5.204 7.551 -2.092) 9.406 43.566 ( -3.691 -6.262 1.526) 7.427 43.731 ( -4.779 -5.815 -0.691) 7.558 69.117 ( -4.526 2.711 0.766) 5.331 69.239 ( -4.115 2.293 -2.585) 5.373 69.358 ( -8.854 -2.348 2.215) 9.424 69.468 ( -6.558 -2.465 -0.403) 7.018 104.919 ( -1.675 0.240 -0.447) 1.750 104.944 ( -1.480 -0.457 -0.489) 1.625 104.967 ( -1.030 0.383 0.287) 1.135 104.984 ( -1.679 -0.144 0.656) 1.809 ======================= Grid point 25 (18/102) ======================= q-point: (-0.50 0.20 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 Number of triplets: 86 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 4.950 ( 0.000 -1.718 0.000) 1.718 5.075 ( 0.000 -3.944 0.000) 3.944 5.104 ( 0.000 1.192 -0.000) 1.192 5.235 ( 0.000 0.353 0.000) 0.353 5.312 ( -0.000 -2.734 -0.000) 2.734 5.485 ( 0.000 -1.627 0.000) 1.627 5.564 ( 0.000 10.072 -0.000) 10.072 5.808 ( 0.000 2.958 0.000) 2.958 6.009 ( 0.000 -6.222 0.000) 6.222 6.059 ( -0.000 5.724 -0.000) 5.724 6.098 ( 0.000 -5.744 0.000) 5.744 6.115 ( -0.000 5.010 0.000) 5.010 6.217 ( 0.000 0.613 0.000) 0.613 6.406 ( 0.000 5.045 0.000) 5.045 6.439 ( 0.000 5.694 0.000) 5.694 6.444 ( 0.000 1.166 -0.000) 1.166 6.578 ( -0.000 5.603 0.000) 5.603 6.695 ( 0.000 -7.478 -0.000) 7.478 6.959 ( 0.000 0.072 0.000) 0.072 7.026 ( 0.000 -2.639 -0.000) 2.639 7.214 ( 0.000 4.377 -0.000) 4.377 7.228 ( 0.000 -1.963 0.000) 1.963 7.290 ( 0.000 4.240 -0.000) 4.240 7.295 ( -0.000 -6.076 0.000) 6.076 7.386 ( 0.000 0.571 0.000) 0.571 7.607 ( 0.000 -9.705 0.000) 9.705 7.774 ( 0.000 -1.779 -0.000) 1.779 7.832 ( 0.000 7.546 0.000) 7.546 7.854 ( 0.000 -3.479 -0.000) 3.479 7.971 ( 0.000 -1.147 -0.000) 1.147 8.018 ( 0.000 -11.264 0.000) 11.264 8.266 ( 0.000 0.929 0.000) 0.929 8.358 ( 0.000 4.843 0.000) 4.843 8.398 ( 0.000 4.451 -0.000) 4.451 8.566 ( 0.000 0.711 -0.000) 0.711 8.593 ( 0.000 -1.502 0.000) 1.502 8.914 ( 0.000 -1.231 0.000) 1.231 8.938 ( 0.000 -1.356 0.000) 1.356 9.171 ( -0.000 4.283 -0.000) 4.283 9.172 ( 0.000 8.584 0.000) 8.584 9.336 ( 0.000 0.474 -0.000) 0.474 9.670 ( 0.000 -0.108 -0.000) 0.108 9.856 ( 0.000 0.813 0.000) 0.813 9.919 ( 0.000 -4.569 0.000) 4.569 10.011 ( 0.000 4.609 -0.000) 4.609 10.137 ( 0.000 -1.049 -0.000) 1.049 10.201 ( 0.000 0.684 0.000) 0.684 10.319 ( 0.000 9.015 0.000) 9.015 10.474 ( 0.000 -2.040 0.000) 2.040 10.688 ( 0.000 0.137 0.000) 0.137 10.808 ( 0.000 3.026 -0.000) 3.026 10.910 ( 0.000 -3.783 0.000) 3.783 11.054 ( 0.000 -1.164 -0.000) 1.164 11.151 ( -0.000 2.419 0.000) 2.419 11.297 ( 0.000 -1.054 0.000) 1.054 11.420 ( 0.000 -5.526 -0.000) 5.526 11.681 ( 0.000 -3.031 -0.000) 3.031 11.794 ( 0.000 -9.468 -0.000) 9.468 12.033 ( 0.000 0.830 0.000) 0.830 12.381 ( 0.000 -5.485 0.000) 5.485 12.692 ( 0.000 3.076 0.000) 3.076 12.883 ( 0.000 -1.884 -0.000) 1.884 12.948 ( 0.000 1.432 0.000) 1.432 12.982 ( -0.000 -0.349 0.000) 0.349 13.158 ( 0.000 -1.106 0.000) 1.106 13.222 ( 0.000 2.227 -0.000) 2.227 13.302 ( 0.000 9.376 -0.000) 9.376 13.459 ( -0.000 7.825 0.000) 7.825 13.979 ( 0.000 0.043 0.000) 0.043 14.253 ( 0.000 7.993 0.000) 7.993 14.446 ( 0.000 -8.338 -0.000) 8.338 14.552 ( 0.000 -3.485 0.000) 3.485 14.554 ( 0.000 -2.612 0.000) 2.612 14.702 ( 0.000 -8.121 0.000) 8.121 14.764 ( 0.000 6.139 0.000) 6.139 14.866 ( 0.000 -3.420 0.000) 3.420 14.978 ( 0.000 1.388 0.000) 1.388 15.049 ( 0.000 -1.125 0.000) 1.125 15.068 ( 0.000 -10.009 0.000) 10.009 15.223 ( 0.000 -4.698 0.000) 4.698 17.837 ( 0.000 13.077 0.000) 13.077 17.918 ( 0.000 12.208 0.000) 12.208 18.464 ( 0.000 -0.120 -0.000) 0.120 18.615 ( 0.000 0.234 0.000) 0.234 18.805 ( 0.000 -6.595 0.000) 6.595 18.844 ( 0.000 -2.370 0.000) 2.370 18.886 ( 0.000 -4.882 0.000) 4.882 18.914 ( -0.000 -2.166 -0.000) 2.166 20.236 ( 0.000 1.004 -0.000) 1.004 20.258 ( 0.000 2.066 -0.000) 2.066 20.303 ( 0.000 -0.511 0.000) 0.511 20.363 ( 0.000 -0.712 0.000) 0.712 21.775 ( 0.000 0.654 0.000) 0.654 21.844 ( 0.000 -1.091 0.000) 1.091 21.956 ( -0.000 0.339 -0.000) 0.339 21.957 ( 0.000 0.160 0.000) 0.160 22.539 ( 0.000 2.941 -0.000) 2.941 22.647 ( 0.000 5.162 0.000) 5.162 22.799 ( 0.000 -3.082 -0.000) 3.082 23.074 ( 0.000 -5.085 0.000) 5.085 24.281 ( 0.000 1.801 0.000) 1.801 24.479 ( 0.000 -3.280 0.000) 3.280 24.584 ( 0.000 1.075 0.000) 1.075 24.641 ( 0.000 0.099 0.000) 0.099 28.874 ( 0.000 0.583 0.000) 0.583 28.938 ( 0.000 -0.992 0.000) 0.992 28.961 ( 0.000 -0.022 -0.000) 0.022 28.977 ( 0.000 -0.333 0.000) 0.333 29.208 ( 0.000 1.407 0.000) 1.407 29.314 ( 0.000 -1.132 0.000) 1.132 29.366 ( 0.000 1.054 0.000) 1.054 29.433 ( 0.000 -0.518 0.000) 0.518 33.666 ( 0.000 2.606 -0.000) 2.606 33.701 ( 0.000 3.437 0.000) 3.437 33.894 ( 0.000 -2.613 0.000) 2.613 33.945 ( 0.000 -2.521 -0.000) 2.521 35.803 ( 0.000 -0.344 0.000) 0.344 35.876 ( 0.000 -1.583 0.000) 1.583 35.913 ( 0.000 1.691 0.000) 1.691 36.087 ( 0.000 -2.638 0.000) 2.638 37.653 ( 0.000 11.496 0.000) 11.496 37.746 ( 0.000 11.963 0.000) 11.963 38.645 ( 0.000 -12.132 0.000) 12.132 38.704 ( 0.000 -9.374 -0.000) 9.374 38.826 ( 0.000 0.963 0.000) 0.963 38.959 ( 0.000 1.843 0.000) 1.843 39.061 ( 0.000 -4.502 0.000) 4.502 39.209 ( 0.000 -2.193 0.000) 2.193 40.033 ( 0.000 1.563 -0.000) 1.563 40.209 ( -0.000 4.878 0.000) 4.878 40.220 ( 0.000 -2.089 -0.000) 2.089 40.479 ( 0.000 -2.335 0.000) 2.335 42.942 ( 0.000 7.882 0.000) 7.882 43.116 ( 0.000 7.784 0.000) 7.784 43.530 ( 0.000 -6.261 0.000) 6.261 43.682 ( 0.000 -5.902 0.000) 5.902 69.071 ( 0.000 2.373 0.000) 2.373 69.199 ( 0.000 2.409 0.000) 2.409 69.267 ( 0.000 -2.266 -0.000) 2.266 69.403 ( 0.000 -2.406 0.000) 2.406 104.902 ( 0.000 0.264 0.000) 0.264 104.928 ( 0.000 -0.416 0.000) 0.416 104.958 ( 0.000 0.217 0.000) 0.217 104.967 ( 0.000 -0.050 -0.000) 0.050 ======================= Grid point 34 (19/102) ======================= q-point: ( 0.00 0.40 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 Number of triplets: 102 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.437 ( 0.000 35.370 0.000) 35.370 2.079 ( 0.000 -30.596 0.000) 30.596 2.186 ( 0.000 50.985 0.000) 50.985 2.612 ( 0.000 14.983 0.000) 14.983 3.057 ( 0.000 -18.914 0.000) 18.914 3.138 ( 0.000 -30.721 0.000) 30.721 3.389 ( 0.000 60.078 0.000) 60.078 3.494 ( 0.000 5.405 0.000) 5.405 3.688 ( 0.000 -5.080 0.000) 5.080 4.022 ( 0.000 -3.211 0.000) 3.211 4.289 ( 0.000 6.762 0.000) 6.762 4.689 ( 0.000 -2.500 0.000) 2.500 4.783 ( 0.000 12.701 0.000) 12.701 4.833 ( 0.000 2.806 0.000) 2.806 5.038 ( 0.000 0.637 0.000) 0.637 5.097 ( 0.000 0.219 0.000) 0.219 5.186 ( 0.000 -2.303 0.000) 2.303 5.252 ( 0.000 -4.882 0.000) 4.882 5.501 ( 0.000 -18.413 0.000) 18.413 5.530 ( 0.000 -36.901 0.000) 36.901 6.164 ( 0.000 1.681 0.000) 1.681 6.183 ( 0.000 -1.617 0.000) 1.617 6.525 ( 0.000 2.552 0.000) 2.552 6.577 ( 0.000 -2.931 0.000) 2.931 6.649 ( 0.000 6.392 0.000) 6.392 6.661 ( 0.000 -1.416 0.000) 1.416 6.664 ( 0.000 -0.715 0.000) 0.715 6.703 ( 0.000 0.166 0.000) 0.166 7.091 ( 0.000 5.648 0.000) 5.648 7.217 ( 0.000 2.207 0.000) 2.207 7.277 ( 0.000 -6.498 0.000) 6.498 7.304 ( 0.000 -1.862 0.000) 1.862 7.508 ( 0.000 -0.632 0.000) 0.632 7.516 ( 0.000 0.409 0.000) 0.409 7.561 ( 0.000 6.663 0.000) 6.663 7.815 ( 0.000 -14.910 0.000) 14.910 7.871 ( 0.000 10.186 0.000) 10.186 7.994 ( 0.000 3.421 0.000) 3.421 8.005 ( 0.000 5.784 0.000) 5.784 8.170 ( 0.000 -20.054 0.000) 20.054 8.535 ( 0.000 16.210 0.000) 16.210 8.668 ( 0.000 11.831 0.000) 11.831 8.738 ( 0.000 9.248 0.000) 9.248 8.766 ( 0.000 -1.776 0.000) 1.776 8.918 ( 0.000 -6.821 0.000) 6.821 9.144 ( 0.000 -5.949 0.000) 5.949 9.165 ( 0.000 9.914 0.000) 9.914 9.479 ( 0.000 -15.119 0.000) 15.119 9.547 ( 0.000 2.309 0.000) 2.309 9.634 ( 0.000 -4.949 0.000) 4.949 9.876 ( 0.000 12.155 0.000) 12.155 10.065 ( 0.000 -2.428 0.000) 2.428 10.242 ( 0.000 -8.321 0.000) 8.321 10.277 ( 0.000 -18.406 0.000) 18.406 11.614 ( 0.000 5.880 0.000) 5.880 11.665 ( 0.000 9.454 0.000) 9.454 11.808 ( 0.000 -1.994 0.000) 1.994 11.870 ( 0.000 -2.757 0.000) 2.757 12.132 ( 0.000 1.522 0.000) 1.522 12.151 ( 0.000 -0.845 0.000) 0.845 12.223 ( 0.000 8.061 0.000) 8.061 12.250 ( 0.000 1.528 0.000) 1.528 12.348 ( 0.000 4.290 0.000) 4.290 12.384 ( 0.000 6.642 0.000) 6.642 12.989 ( 0.000 1.729 0.000) 1.729 13.126 ( 0.000 -8.640 0.000) 8.640 13.311 ( 0.000 1.535 0.000) 1.535 13.521 ( 0.000 -18.690 0.000) 18.690 14.361 ( 0.000 0.024 0.000) 0.024 14.381 ( 0.000 -2.459 0.000) 2.459 14.593 ( 0.000 10.875 0.000) 10.875 14.734 ( 0.000 -2.847 0.000) 2.847 14.780 ( 0.000 9.551 0.000) 9.551 14.973 ( 0.000 -7.038 0.000) 7.038 15.134 ( 0.000 5.545 0.000) 5.545 15.252 ( 0.000 -7.890 0.000) 7.890 15.458 ( 0.000 5.141 0.000) 5.141 15.575 ( 0.000 -5.571 0.000) 5.571 16.384 ( 0.000 19.550 0.000) 19.550 16.736 ( 0.000 -16.025 0.000) 16.025 18.004 ( 0.000 11.514 0.000) 11.514 18.144 ( 0.000 3.448 0.000) 3.448 18.164 ( 0.000 -4.000 0.000) 4.000 18.202 ( 0.000 -2.686 0.000) 2.686 18.760 ( 0.000 6.243 0.000) 6.243 18.945 ( 0.000 7.218 0.000) 7.218 18.997 ( 0.000 -17.876 0.000) 17.876 19.106 ( 0.000 -9.436 0.000) 9.436 19.491 ( 0.000 4.646 0.000) 4.646 19.571 ( 0.000 -3.488 0.000) 3.488 19.795 ( 0.000 5.263 0.000) 5.263 19.873 ( 0.000 -2.767 0.000) 2.767 20.226 ( 0.000 1.674 0.000) 1.674 20.252 ( 0.000 -1.408 0.000) 1.408 20.341 ( 0.000 0.444 0.000) 0.444 20.348 ( 0.000 -0.627 0.000) 0.627 20.422 ( 0.000 0.127 0.000) 0.127 20.423 ( 0.000 -0.027 0.000) 0.027 20.508 ( 0.000 0.551 0.000) 0.551 20.521 ( 0.000 -0.796 0.000) 0.796 24.503 ( 0.000 4.040 0.000) 4.040 24.580 ( 0.000 -1.526 0.000) 1.526 24.592 ( 0.000 0.940 0.000) 0.940 24.613 ( 0.000 -3.112 0.000) 3.112 28.695 ( 0.000 7.053 0.000) 7.053 28.834 ( 0.000 -7.126 0.000) 7.126 28.915 ( 0.000 8.232 0.000) 8.232 29.089 ( 0.000 -9.381 0.000) 9.381 29.556 ( 0.000 3.197 0.000) 3.197 29.608 ( 0.000 -2.141 0.000) 2.141 29.657 ( 0.000 2.318 0.000) 2.318 29.685 ( 0.000 -0.591 0.000) 0.591 32.988 ( 0.000 0.356 0.000) 0.356 32.992 ( 0.000 -0.239 0.000) 0.239 32.997 ( 0.000 1.897 0.000) 1.897 33.040 ( 0.000 -2.292 0.000) 2.292 36.370 ( 0.000 19.860 0.000) 19.860 36.702 ( 0.000 -13.527 0.000) 13.527 37.423 ( 0.000 10.112 0.000) 10.112 37.719 ( 0.000 -20.572 0.000) 20.572 38.502 ( 0.000 14.919 0.000) 14.919 38.760 ( 0.000 19.615 0.000) 19.615 38.781 ( 0.000 -12.768 0.000) 12.768 39.096 ( 0.000 -12.668 0.000) 12.668 39.546 ( 0.000 2.249 0.000) 2.249 39.636 ( 0.000 -5.915 0.000) 5.915 39.997 ( 0.000 3.759 0.000) 3.759 40.033 ( 0.000 0.344 0.000) 0.344 42.156 ( 0.000 -0.623 0.000) 0.623 42.156 ( 0.000 -1.060 0.000) 1.060 43.486 ( 0.000 0.773 0.000) 0.773 43.507 ( 0.000 -1.452 0.000) 1.452 43.952 ( 0.000 17.822 0.000) 17.822 44.300 ( 0.000 -17.243 0.000) 17.243 45.470 ( 0.000 5.221 0.000) 5.221 45.567 ( 0.000 -4.601 0.000) 4.601 70.737 ( 0.000 27.931 0.000) 27.931 71.291 ( 0.000 -28.251 0.000) 28.251 72.835 ( 0.000 7.949 0.000) 7.949 72.966 ( 0.000 -5.583 0.000) 5.583 105.252 ( 0.000 1.438 0.000) 1.438 105.279 ( 0.000 -1.319 0.000) 1.319 105.595 ( 0.000 1.180 0.000) 1.180 105.624 ( 0.000 -1.781 0.000) 1.781 ======================= Grid point 35 (20/102) ======================= q-point: ( 0.06 0.40 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 Number of triplets: 160 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.844 ( 33.327 28.429 2.273) 43.864 2.265 ( 8.367 45.492 3.778) 46.409 2.393 ( 26.641 -23.408 4.671) 35.770 2.917 ( 26.361 4.752 -5.137) 27.274 3.213 ( 9.769 -22.260 0.644) 24.317 3.342 ( 26.492 -17.667 -8.722) 33.015 3.510 ( 12.323 55.802 1.571) 57.168 3.638 ( 13.666 4.603 5.398) 15.398 3.792 ( 10.282 -5.294 5.639) 12.866 4.116 ( 8.672 -5.104 -4.171) 10.892 4.404 ( 11.641 7.417 -1.612) 13.897 4.788 ( 8.797 2.006 -0.908) 9.068 4.833 ( 5.798 2.037 5.044) 7.950 4.953 ( 4.063 -10.090 4.880) 11.922 5.130 ( 10.786 8.076 7.856) 15.597 5.156 ( 12.251 5.350 -17.096) 21.702 5.436 ( 21.991 -0.726 0.418) 22.007 5.489 ( 22.564 -4.396 -0.925) 23.007 5.561 ( 7.435 -15.381 1.545) 17.153 5.703 ( 16.300 -32.557 0.597) 36.414 6.169 ( 0.936 1.511 -3.678) 4.086 6.194 ( 1.684 -2.090 -3.404) 4.335 6.519 ( 0.474 2.860 3.138) 4.272 6.574 ( 0.035 -3.378 6.859) 7.646 6.661 ( 1.607 5.583 -3.446) 6.755 6.704 ( 1.231 0.538 0.288) 1.374 6.850 ( 15.041 0.593 -1.546) 15.132 6.860 ( 15.220 -1.078 1.429) 15.325 7.150 ( 4.483 3.353 6.704) 8.734 7.262 ( 3.177 0.824 2.403) 4.067 7.291 ( 7.412 -1.041 -1.046) 7.557 7.424 ( 9.898 -3.866 -9.018) 13.937 7.552 ( 3.215 0.426 -0.242) 3.252 7.583 ( 6.319 0.249 0.363) 6.334 7.642 ( 7.794 4.636 -0.907) 9.114 7.834 ( 2.591 -9.791 -2.592) 10.455 7.959 ( 8.585 4.443 2.656) 10.025 8.009 ( 2.587 4.817 -4.999) 7.408 8.025 ( 2.394 2.820 -2.826) 4.655 8.167 ( 1.927 -14.056 1.459) 14.263 8.503 ( -1.341 15.477 0.597) 15.546 8.671 ( 0.420 16.226 2.035) 16.358 8.858 ( 5.624 2.022 -6.217) 8.624 8.882 ( 1.493 -6.076 7.455) 9.732 8.955 ( 11.305 -1.819 -3.206) 11.890 9.158 ( 2.065 -6.912 -3.386) 7.969 9.228 ( 5.959 7.625 5.665) 11.214 9.491 ( 1.311 -14.985 1.582) 15.125 9.572 ( 2.829 2.460 -0.200) 3.754 9.641 ( 1.408 -3.353 -3.882) 5.319 9.831 ( -4.037 10.111 -1.577) 11.001 10.069 ( -0.098 -9.402 0.123) 9.403 10.249 ( -1.384 -11.391 0.274) 11.478 10.262 ( 2.045 -7.158 2.738) 7.932 11.592 ( -2.095 7.228 0.737) 7.561 11.648 ( -2.791 7.698 4.064) 9.141 11.794 ( -0.646 0.579 -7.817) 7.865 11.867 ( -0.684 -2.132 -5.452) 5.894 12.112 ( -3.925 3.544 4.703) 7.077 12.119 ( -3.171 3.768 4.614) 6.748 12.209 ( 0.604 6.064 -0.674) 6.132 12.277 ( 3.315 -1.443 -1.645) 3.972 12.444 ( 8.801 3.944 -0.306) 9.650 12.508 ( 10.675 0.227 2.846) 11.050 12.936 ( -4.723 0.797 0.941) 4.882 13.049 ( -7.293 -8.021 4.066) 11.578 13.293 ( -1.481 2.461 -1.563) 3.270 13.473 ( -3.313 -13.802 -2.893) 14.486 14.338 ( -2.402 -0.460 1.282) 2.761 14.350 ( -2.161 -0.617 -2.992) 3.742 14.575 ( -1.670 7.615 0.144) 7.797 14.653 ( -4.457 0.545 -5.578) 7.161 14.793 ( -1.676 6.189 7.324) 9.734 14.948 ( -2.556 -6.754 1.698) 7.419 15.104 ( -2.710 6.068 -0.272) 6.651 15.227 ( -2.526 -6.941 -1.214) 7.486 15.417 ( -3.628 6.357 1.255) 7.426 15.543 ( -3.120 -5.529 -0.847) 6.405 16.209 ( -15.396 12.585 0.058) 19.886 16.396 ( -24.903 -5.668 -2.184) 25.634 18.075 ( 5.739 11.388 2.517) 12.998 18.216 ( 6.302 -3.628 0.896) 7.327 18.303 ( 8.789 3.379 -1.455) 9.528 18.393 ( 12.680 -4.925 -2.921) 13.913 18.781 ( 2.666 3.140 -0.770) 4.190 18.877 ( -4.285 1.720 -1.633) 4.898 19.053 ( 2.964 -10.649 2.811) 11.405 19.132 ( 2.105 -10.957 0.350) 11.163 19.496 ( 1.020 4.973 -1.084) 5.192 19.583 ( 1.729 -4.025 -1.573) 4.655 19.673 ( -5.503 7.980 -1.149) 9.762 19.810 ( -3.647 -6.107 0.234) 7.117 20.277 ( 5.014 1.514 -0.461) 5.258 20.307 ( 5.717 -1.628 -0.595) 5.974 20.374 ( 5.447 1.419 1.189) 5.753 20.397 ( 5.385 -0.997 1.550) 5.691 20.560 ( 14.943 1.833 -3.315) 15.415 20.603 ( 15.957 -2.492 -1.685) 16.238 20.797 ( 22.112 4.826 2.515) 22.772 20.952 ( 32.369 -13.012 6.331) 35.456 24.487 ( -1.501 3.758 0.306) 4.058 24.564 ( -1.838 -2.668 1.228) 3.465 24.579 ( -0.985 1.014 -0.899) 1.676 24.594 ( -1.492 -1.551 -0.827) 2.305 28.701 ( 0.492 6.990 0.652) 7.038 28.833 ( -0.090 -5.234 -0.654) 5.275 28.907 ( -0.701 7.259 1.275) 7.404 29.083 ( -0.531 -9.497 -0.893) 9.554 29.535 ( -1.884 3.054 -1.083) 3.749 29.583 ( -2.169 -1.818 -0.759) 2.930 29.646 ( -1.122 2.252 0.299) 2.534 29.673 ( -1.197 -0.563 0.695) 1.494 33.018 ( 3.407 1.864 0.080) 3.885 33.028 ( 3.221 1.614 0.193) 3.608 33.050 ( 4.775 -1.945 -0.064) 5.156 33.080 ( 4.001 -2.865 -0.309) 4.930 36.339 ( -3.108 19.102 0.506) 19.360 36.657 ( -4.277 -12.905 -1.613) 13.691 37.279 ( -13.555 15.029 3.559) 20.549 37.635 ( -8.346 -22.633 -1.215) 24.154 38.475 ( -2.609 15.796 -2.268) 16.170 38.684 ( -5.663 15.327 5.258) 17.165 38.795 ( -0.096 -8.762 -6.453) 10.883 39.057 ( -4.000 -14.286 2.406) 15.030 39.443 ( -8.577 7.519 0.749) 11.431 39.607 ( -3.507 -8.869 0.086) 9.538 39.996 ( -0.790 2.137 0.640) 2.367 40.009 ( -2.189 0.932 -0.706) 2.482 41.934 ( -19.987 7.192 0.441) 21.246 42.060 ( -11.112 -6.273 -7.882) 14.999 43.012 ( -36.165 19.786 -8.369) 42.064 43.241 ( -21.654 -6.404 -3.997) 22.932 43.939 ( -4.517 16.321 14.222) 22.114 44.263 ( -4.513 -16.285 5.505) 17.772 45.345 ( -11.447 3.923 -0.833) 12.129 45.416 ( -14.105 -3.284 -1.394) 14.549 70.667 ( -6.999 26.785 0.892) 27.699 71.202 ( -9.003 -27.412 1.466) 28.890 72.377 ( -41.107 18.036 -4.065) 45.074 72.589 ( -29.410 -4.519 -7.551) 30.698 105.244 ( -0.942 1.597 1.536) 2.408 105.276 ( -0.693 -1.699 2.228) 2.886 105.537 ( -5.038 2.018 -0.588) 5.459 105.574 ( -4.546 -1.877 -1.356) 5.102 ======================= Grid point 36 (21/102) ======================= q-point: ( 0.12 0.40 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 Number of triplets: 162 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.494 ( 21.858 35.563 1.600) 41.774 2.556 ( 25.331 32.255 10.041) 42.224 3.018 ( 31.489 -21.567 2.773) 38.267 3.311 ( 14.454 -33.225 6.324) 36.781 3.701 ( 34.289 9.651 -16.803) 39.385 3.883 ( 23.413 39.478 1.880) 45.937 3.904 ( 26.950 -8.707 -14.341) 31.746 4.058 ( 25.592 3.921 10.416) 27.907 4.178 ( 27.355 -9.407 15.381) 32.762 4.328 ( 14.646 -7.064 -9.960) 19.069 4.718 ( 19.359 7.809 -5.698) 21.638 4.953 ( 9.510 4.044 2.342) 10.597 5.039 ( 6.133 0.611 22.723) 23.544 5.120 ( 18.701 -16.293 -7.774) 25.993 5.331 ( 15.388 10.634 -7.168) 20.032 5.559 ( 19.583 -6.972 0.692) 20.798 5.865 ( 22.599 0.566 0.612) 22.614 5.977 ( 27.696 2.657 -2.397) 27.926 6.058 ( 27.615 -4.644 -3.304) 28.197 6.148 ( 26.336 -22.508 -0.591) 34.649 6.226 ( 10.690 -0.467 -3.868) 11.378 6.266 ( 9.699 -2.446 -7.114) 12.274 6.559 ( 2.630 4.219 6.116) 7.882 6.618 ( 2.624 -1.183 7.297) 7.844 6.703 ( 4.643 3.677 -4.577) 7.485 6.734 ( 3.440 -0.729 -0.396) 3.539 7.082 ( 4.512 3.006 4.148) 6.826 7.148 ( 10.189 -0.829 5.088) 11.419 7.345 ( 13.493 3.074 4.899) 14.680 7.457 ( 14.747 -7.701 0.171) 16.638 7.535 ( 16.112 5.707 -0.372) 17.097 7.613 ( 4.699 3.607 -0.066) 5.924 7.659 ( 13.780 -4.224 -9.684) 17.364 7.749 ( 10.660 -2.280 -1.204) 10.967 7.814 ( 8.146 2.328 -2.627) 8.870 7.901 ( 6.406 -6.370 -3.646) 9.742 8.106 ( 9.318 5.243 -2.044) 10.886 8.149 ( 11.288 0.740 -6.138) 12.870 8.215 ( 15.333 1.908 0.334) 15.455 8.312 ( 12.662 -5.585 0.947) 13.871 8.503 ( 1.653 13.513 -2.246) 13.797 8.705 ( 2.499 15.400 6.813) 17.024 8.847 ( -1.338 -11.500 0.529) 11.590 8.927 ( -0.422 4.783 5.685) 7.441 9.128 ( 4.053 -3.201 3.624) 6.309 9.224 ( 4.176 -1.854 -8.921) 10.023 9.358 ( 3.689 1.358 0.906) 4.035 9.536 ( 0.964 -13.455 2.740) 13.765 9.637 ( 1.945 5.473 -3.747) 6.912 9.707 ( 0.509 -1.766 2.212) 2.876 9.779 ( 8.236 2.769 -6.335) 10.753 10.030 ( -2.880 -19.336 -1.602) 19.615 10.306 ( 7.934 1.102 2.997) 8.552 10.372 ( 8.531 -4.908 5.925) 11.488 11.529 ( -4.652 7.777 -1.139) 9.134 11.550 ( -7.870 8.142 3.706) 11.915 11.740 ( -2.292 2.796 -16.513) 16.904 11.788 ( -4.466 2.068 -14.704) 15.506 12.019 ( -6.725 4.619 12.936) 15.294 12.061 ( -2.932 -0.654 15.459) 15.748 12.257 ( 2.711 3.743 0.473) 4.646 12.354 ( 3.196 -5.070 -0.761) 6.041 12.601 ( 2.713 6.840 0.077) 7.359 12.762 ( 11.605 -5.870 1.398) 13.080 12.867 ( -2.065 -3.026 -0.115) 3.665 12.909 ( -2.373 -4.418 5.128) 7.172 13.271 ( 0.819 5.315 -1.311) 5.535 13.432 ( 1.045 -9.271 -3.563) 9.987 14.280 ( -3.043 0.548 -0.491) 3.131 14.303 ( -1.956 -0.973 -2.003) 2.964 14.532 ( -2.800 2.974 0.941) 4.192 14.564 ( -3.233 -1.261 -4.163) 5.419 14.746 ( -3.793 6.633 5.215) 9.251 14.883 ( -4.272 -5.912 2.130) 7.599 15.034 ( -3.984 5.719 -0.403) 6.982 15.142 ( -5.501 -4.472 -1.714) 7.294 15.340 ( -4.201 5.909 2.037) 7.531 15.452 ( -5.631 -4.271 -0.194) 7.070 15.865 ( -17.066 3.346 0.322) 17.394 15.927 ( -19.928 -2.348 -3.676) 20.400 18.177 ( 2.501 12.829 3.782) 13.607 18.336 ( 4.448 -2.986 0.735) 5.407 18.441 ( 3.800 5.613 -0.359) 6.788 18.536 ( 3.095 -2.795 -2.096) 4.667 18.801 ( -1.348 6.229 -1.647) 6.582 18.860 ( 3.813 0.628 -2.156) 4.426 19.097 ( 0.614 -10.492 2.791) 10.874 19.155 ( -0.326 -12.268 -1.829) 12.408 19.554 ( 5.506 5.101 -0.367) 7.515 19.645 ( 4.421 1.829 1.253) 4.946 19.665 ( 5.243 0.737 -3.439) 6.314 19.807 ( 3.163 -7.473 1.456) 8.245 20.434 ( 10.788 2.270 -2.163) 11.235 20.479 ( 11.360 -2.158 -1.517) 11.663 20.551 ( 11.456 1.152 2.166) 11.715 20.573 ( 11.392 -1.070 2.941) 11.815 20.937 ( 22.516 2.585 -5.058) 23.222 21.002 ( 23.522 -3.934 -4.003) 24.183 21.286 ( 24.255 10.636 3.879) 26.767 21.597 ( 27.841 -23.068 6.603) 36.754 24.449 ( -2.203 2.916 0.361) 3.673 24.509 ( -3.578 -2.467 0.578) 4.385 24.558 ( -0.898 0.083 -1.242) 1.535 24.561 ( -1.414 0.208 -0.251) 1.451 28.718 ( 0.971 6.722 1.147) 6.888 28.828 ( -0.099 -0.303 -1.135) 1.179 28.900 ( -0.291 3.328 2.123) 3.958 29.064 ( -1.081 -9.343 -1.351) 9.502 29.483 ( -2.838 2.963 -1.469) 4.358 29.529 ( -2.768 -1.727 -0.908) 3.387 29.615 ( -1.951 1.972 0.352) 2.797 29.641 ( -2.157 -0.574 0.879) 2.399 33.117 ( 6.218 3.307 -0.141) 7.044 33.120 ( 5.811 1.907 -0.066) 6.116 33.168 ( 6.799 -3.446 0.475) 7.637 33.194 ( 7.082 -4.422 -0.400) 8.358 36.254 ( -5.344 17.021 0.806) 17.858 36.533 ( -7.364 -10.902 -2.733) 13.437 36.957 ( -17.982 20.983 4.348) 27.974 37.388 ( -15.488 -24.396 -1.340) 28.929 38.387 ( -5.272 17.991 -2.973) 18.981 38.577 ( -5.994 18.385 4.116) 19.770 38.743 ( -3.665 -14.410 -5.662) 15.910 38.960 ( -6.003 -16.619 4.224) 18.168 39.261 ( -8.967 12.219 0.717) 15.174 39.499 ( -6.959 -11.482 -0.234) 13.428 39.936 ( -4.647 1.724 -0.336) 4.968 39.960 ( -3.425 0.245 0.242) 3.443 41.411 ( -28.067 20.530 -6.018) 35.291 41.708 ( -21.277 -11.791 -4.498) 24.738 42.366 ( -26.658 22.642 1.647) 35.014 42.720 ( -27.793 -13.119 -1.474) 30.768 43.836 ( -7.660 15.832 8.936) 19.728 44.143 ( -8.227 -15.100 4.791) 17.851 45.041 ( -20.349 0.569 -2.134) 20.468 45.048 ( -18.497 -0.147 -1.972) 18.603 70.469 ( -12.627 23.325 1.107) 26.547 70.942 ( -16.764 -24.666 -0.043) 29.824 71.511 ( -40.207 26.146 -4.784) 48.199 71.874 ( -38.380 -11.445 -2.775) 40.147 105.219 ( -2.023 1.727 2.339) 3.542 105.254 ( -2.097 -1.880 2.834) 3.996 105.417 ( -6.341 2.105 -1.464) 6.840 105.454 ( -6.723 -1.687 -2.154) 7.259 ======================= Grid point 37 (22/102) ======================= q-point: ( 0.19 0.40 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 Number of triplets: 160 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.913 ( 21.856 33.284 10.762) 41.248 3.103 ( 25.535 23.680 1.810) 34.872 3.588 ( 24.147 -22.244 3.139) 32.981 3.669 ( 20.217 -27.146 9.369) 35.120 4.249 ( 23.737 4.392 -14.439) 28.129 4.329 ( 21.092 4.222 -5.904) 22.306 4.397 ( 23.677 7.125 -5.853) 25.410 4.522 ( 17.191 -1.895 -3.287) 17.605 4.721 ( 22.199 -2.013 2.486) 22.429 4.777 ( 24.560 -6.828 7.725) 26.637 5.139 ( 20.712 6.974 2.657) 22.016 5.232 ( 23.917 2.421 -4.328) 24.426 5.356 ( 21.220 3.244 16.839) 27.283 5.503 ( 19.446 -5.525 -2.258) 20.341 5.722 ( 21.237 6.786 -1.257) 22.330 5.915 ( 14.225 -11.981 1.673) 18.673 6.219 ( 14.910 7.748 -6.259) 17.931 6.313 ( 10.928 2.185 -9.880) 14.893 6.339 ( 13.675 0.755 0.230) 13.698 6.552 ( 10.787 -10.805 -8.404) 17.428 6.603 ( 7.243 0.116 -0.894) 7.299 6.633 ( 11.122 0.216 0.390) 11.131 6.789 ( 19.639 2.336 3.695) 20.119 6.836 ( 28.374 4.987 3.330) 29.001 6.938 ( 20.386 -0.159 -0.292) 20.388 7.008 ( 26.626 -7.436 -1.461) 27.683 7.181 ( 8.104 -0.254 8.555) 11.787 7.299 ( 6.369 -3.996 3.297) 8.210 7.507 ( 3.142 7.340 1.883) 8.203 7.705 ( 0.871 -6.195 0.796) 6.306 7.723 ( 9.881 0.281 2.763) 10.264 7.779 ( 10.064 -4.505 -2.685) 11.348 7.926 ( 14.913 9.492 -8.943) 19.811 7.999 ( 14.251 4.473 4.759) 15.676 8.082 ( 17.123 1.023 -5.873) 18.131 8.155 ( 17.667 -5.858 -5.959) 19.543 8.374 ( 16.367 3.157 2.065) 16.796 8.418 ( 16.336 -0.533 -0.646) 16.358 8.531 ( 5.880 7.790 -8.658) 13.047 8.551 ( 14.430 0.159 -0.615) 14.443 8.630 ( 13.825 0.630 2.423) 14.050 8.813 ( 2.747 -6.028 5.963) 8.913 8.851 ( 6.988 4.812 0.240) 8.488 8.974 ( 7.598 2.206 7.904) 11.183 9.197 ( 2.357 -3.987 1.739) 4.947 9.245 ( 0.652 -3.490 -4.090) 5.416 9.398 ( 1.527 2.622 -1.208) 3.266 9.533 ( -2.199 -7.346 0.975) 7.730 9.577 ( -0.840 4.415 -1.031) 4.611 9.720 ( -0.648 -7.321 -0.821) 7.395 9.995 ( 8.046 -1.840 -5.609) 9.979 10.059 ( 8.912 -8.345 -1.425) 12.292 10.556 ( 14.830 3.017 5.775) 16.198 10.620 ( 13.712 -3.365 6.517) 15.551 11.343 ( -11.535 11.880 -1.811) 16.657 11.402 ( -7.512 3.789 -7.513) 11.279 11.649 ( -2.771 1.663 -16.722) 17.032 11.673 ( -3.833 1.945 -8.628) 9.640 11.942 ( -3.895 5.844 17.016) 18.409 12.053 ( -1.346 -4.684 14.497) 15.294 12.283 ( -0.295 3.068 1.581) 3.464 12.366 ( -1.585 -4.043 0.878) 4.430 12.530 ( -7.063 3.867 0.261) 8.057 12.671 ( -10.541 -8.366 0.859) 13.485 13.019 ( 10.396 1.564 1.669) 10.644 13.077 ( 11.161 -3.718 0.480) 11.773 13.365 ( 8.713 6.259 -1.502) 10.833 13.516 ( 7.312 -8.203 -2.835) 11.349 14.220 ( -2.690 1.353 -1.088) 3.202 14.263 ( -1.799 -2.124 -1.366) 3.101 14.466 ( -3.496 1.519 -0.374) 3.830 14.509 ( -1.931 -3.966 -1.037) 4.532 14.681 ( -3.175 5.427 2.639) 6.819 14.792 ( -5.131 -4.812 2.119) 7.347 14.952 ( -4.030 3.764 -0.473) 5.535 15.015 ( -6.391 -2.185 -1.466) 6.911 15.255 ( -4.836 4.393 1.569) 6.719 15.322 ( -7.077 -1.484 0.824) 7.278 15.580 ( -10.749 -2.171 -0.360) 10.972 15.590 ( -13.243 -2.546 -3.574) 13.951 18.191 ( -1.166 14.372 3.026) 14.734 18.378 ( -0.443 2.445 -0.609) 2.558 18.454 ( -1.387 -0.607 1.639) 2.231 18.545 ( -0.919 -3.764 -0.877) 3.973 18.815 ( 2.088 8.986 -3.050) 9.716 18.907 ( 1.022 2.794 -0.477) 3.013 19.092 ( -1.326 -10.160 1.262) 10.323 19.117 ( -2.770 -10.280 -0.882) 10.684 19.709 ( 9.393 4.652 -0.668) 10.503 19.777 ( 8.044 6.328 1.641) 10.366 19.810 ( 8.905 -5.004 -3.311) 10.738 19.916 ( 6.584 -6.924 1.896) 9.741 20.686 ( 14.572 2.530 -3.198) 15.132 20.740 ( 14.710 -2.829 -2.830) 15.245 20.827 ( 15.059 1.134 3.274) 15.452 20.849 ( 14.940 -1.164 3.931) 15.492 21.404 ( 24.432 3.804 -5.037) 25.234 21.491 ( 25.208 -4.480 -3.670) 25.865 21.745 ( 20.362 11.785 3.434) 23.776 22.064 ( 17.864 -20.862 5.156) 27.945 24.407 ( -1.944 1.512 0.116) 2.466 24.436 ( -3.503 -1.103 -0.066) 3.673 24.534 ( -0.844 0.927 -0.524) 1.359 24.549 ( -0.063 -0.755 -0.439) 0.876 28.744 ( 1.418 6.104 1.335) 6.408 28.828 ( 0.355 3.000 -0.929) 3.161 28.904 ( 0.189 -0.262 2.106) 2.130 29.036 ( -1.302 -8.442 -1.430) 8.661 29.421 ( -2.941 3.118 -1.353) 4.495 29.473 ( -2.675 -2.119 -0.895) 3.528 29.572 ( -2.375 1.526 0.378) 2.848 29.593 ( -2.686 -0.547 0.787) 2.851 33.252 ( 7.253 2.762 -0.265) 7.766 33.258 ( 7.560 3.584 -0.146) 8.368 33.319 ( 7.910 -4.027 0.551) 8.893 33.347 ( 8.058 -5.153 -0.225) 9.568 36.137 ( -6.249 14.163 0.747) 15.499 36.363 ( -8.636 -7.228 -3.017) 11.659 36.621 ( -15.776 19.417 4.001) 25.336 37.043 ( -17.833 -22.742 -1.253) 28.928 38.270 ( -5.520 18.712 -1.898) 19.601 38.460 ( -6.411 18.684 2.478) 19.908 38.639 ( -5.229 -16.997 -3.637) 18.151 38.842 ( -6.658 -17.719 4.172) 19.383 39.101 ( -7.024 11.843 0.037) 13.769 39.341 ( -8.383 -11.751 -0.400) 14.440 39.820 ( -6.706 2.192 -0.804) 7.101 39.862 ( -6.303 -0.676 0.394) 6.351 40.891 ( -21.933 22.157 -4.530) 31.504 41.254 ( -22.185 -14.757 -1.060) 26.666 41.884 ( -23.037 15.303 1.620) 27.703 42.161 ( -27.552 -12.015 0.767) 30.068 43.685 ( -8.685 14.714 5.273) 17.881 43.967 ( -9.711 -13.718 2.276) 16.961 44.590 ( -22.386 4.279 -1.786) 22.861 44.672 ( -19.016 -3.872 -2.094) 19.518 70.184 ( -15.578 18.246 0.958) 24.011 70.551 ( -21.187 -18.264 -4.258) 28.295 70.796 ( -30.932 19.249 1.241) 36.454 71.117 ( -35.715 -12.459 -0.484) 37.828 105.173 ( -2.965 1.619 2.466) 4.182 105.206 ( -3.231 -1.640 2.615) 4.468 105.287 ( -6.100 1.278 -2.008) 6.548 105.310 ( -6.829 -1.077 -2.306) 7.288 ======================= Grid point 38 (23/102) ======================= q-point: ( 0.25 0.40 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 Number of triplets: 162 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.408 ( 24.622 25.471 11.942) 37.385 3.609 ( 25.153 13.721 0.610) 28.659 4.044 ( 21.609 -19.334 8.001) 30.080 4.109 ( 20.665 -18.958 6.507) 28.789 4.615 ( 15.460 2.452 -8.991) 18.051 4.696 ( 15.954 -3.822 -5.150) 17.195 4.805 ( 19.946 2.731 -11.355) 23.114 4.860 ( 18.793 -2.808 -10.078) 21.509 5.067 ( 13.868 0.772 7.019) 15.562 5.156 ( 13.664 -6.730 9.676) 18.045 5.571 ( 20.736 11.769 4.644) 24.292 5.761 ( 22.547 -2.563 -4.055) 23.052 5.823 ( 15.041 3.658 0.943) 15.508 5.877 ( 20.197 2.194 2.831) 20.512 6.001 ( 8.577 1.882 2.345) 9.089 6.183 ( 16.040 -11.819 -1.107) 19.955 6.435 ( 6.257 10.252 -7.905) 14.378 6.529 ( 7.840 2.831 3.878) 9.193 6.614 ( 6.939 -1.179 1.936) 7.300 6.655 ( 4.725 -5.367 -7.784) 10.569 6.796 ( 25.408 11.636 -4.911) 28.374 7.017 ( 23.754 0.534 -2.533) 23.895 7.073 ( 5.771 6.015 2.875) 8.818 7.188 ( 13.763 -0.792 -2.835) 14.075 7.284 ( 7.160 -6.239 4.725) 10.608 7.366 ( 11.093 -13.669 3.513) 17.951 7.480 ( 1.609 12.083 2.274) 12.400 7.501 ( 9.198 7.690 -2.369) 12.221 7.695 ( 8.407 -3.273 -0.466) 9.034 7.799 ( 22.660 -6.350 5.432) 24.152 7.984 ( 15.847 -1.282 0.192) 15.900 8.019 ( 17.103 -5.158 -3.251) 18.157 8.147 ( 12.776 9.401 -0.513) 15.870 8.262 ( 4.538 0.349 2.020) 4.979 8.381 ( 16.372 6.024 -1.571) 17.516 8.484 ( 10.839 2.587 1.710) 11.273 8.545 ( 3.192 -1.128 -10.073) 10.626 8.584 ( 2.575 4.696 -0.655) 5.396 8.679 ( 6.884 -6.609 3.725) 10.244 8.780 ( 5.943 -8.048 -4.874) 11.129 8.958 ( 15.523 1.254 3.960) 16.069 8.987 ( 20.220 -2.763 2.930) 20.618 9.100 ( 11.100 2.722 2.973) 11.809 9.207 ( 3.115 -0.795 -0.040) 3.216 9.295 ( 14.351 -5.165 3.748) 15.706 9.339 ( 14.888 -3.797 1.274) 15.417 9.441 ( 4.354 1.782 -4.731) 6.672 9.491 ( 1.786 -1.352 -3.139) 3.856 9.681 ( 9.773 2.886 0.218) 10.193 9.778 ( 8.345 -5.089 -0.901) 9.815 10.131 ( 7.958 5.552 -3.999) 10.495 10.266 ( 10.515 -8.149 -1.552) 13.393 10.853 ( 11.464 3.065 7.651) 14.119 10.890 ( 10.507 -0.782 7.334) 12.837 11.131 ( -7.122 11.177 -3.901) 13.816 11.239 ( -5.311 -0.344 -11.520) 12.690 11.566 ( -1.937 1.787 -13.337) 13.595 11.611 ( -1.582 -2.165 -2.102) 3.407 11.928 ( -0.968 7.637 14.105) 16.069 12.061 ( -0.524 -5.266 9.797) 11.135 12.273 ( -0.775 3.624 1.135) 3.876 12.346 ( 0.184 -0.128 2.344) 2.355 12.393 ( -4.360 -2.349 0.614) 4.990 12.468 ( -8.840 -6.139 -0.305) 10.767 13.203 ( 7.326 5.175 1.423) 9.081 13.279 ( 8.555 -2.064 -0.852) 8.842 13.554 ( 8.824 2.961 -1.569) 9.439 13.662 ( 6.551 -6.950 -1.769) 9.713 14.171 ( -1.789 1.539 -1.311) 2.699 14.221 ( -2.177 -2.214 -0.858) 3.221 14.403 ( -2.469 1.210 -0.612) 2.817 14.480 ( -0.884 -6.135 0.519) 6.220 14.639 ( -1.449 1.990 1.366) 2.815 14.694 ( -4.828 -3.060 2.223) 6.133 14.862 ( -4.968 2.794 -0.944) 5.778 14.908 ( -3.275 -2.178 -1.612) 4.251 15.146 ( -5.778 3.444 -0.984) 6.798 15.196 ( -5.558 -1.075 1.782) 5.935 15.375 ( -7.776 -0.692 -2.672) 8.252 15.420 ( -5.952 -4.398 0.473) 7.415 18.164 ( -1.643 15.289 1.801) 15.482 18.329 ( -3.353 11.292 -0.657) 11.798 18.435 ( -0.751 -9.533 0.674) 9.586 18.517 ( -1.743 -5.283 0.896) 5.635 18.834 ( 0.252 7.504 -3.410) 8.247 18.904 ( -1.127 4.026 0.937) 4.285 19.048 ( -3.394 -9.178 -2.298) 10.052 19.060 ( -2.496 -7.936 2.348) 8.644 19.903 ( 9.713 3.893 -1.006) 10.512 19.947 ( 8.095 5.348 1.108) 9.765 19.985 ( 8.711 -4.327 -1.989) 9.928 20.052 ( 6.240 -5.217 1.629) 8.295 20.987 ( 15.821 2.332 -3.437) 16.357 21.039 ( 15.533 -2.905 -3.346) 16.153 21.149 ( 15.984 0.998 3.350) 16.362 21.169 ( 15.720 -1.020 3.933) 16.237 21.868 ( 22.281 5.086 -4.079) 23.216 21.963 ( 21.596 -2.278 -1.303) 21.755 22.114 ( 16.369 7.276 1.623) 17.987 22.357 ( 11.086 -15.196 3.995) 19.230 24.372 ( -2.034 0.362 -0.555) 2.139 24.379 ( -1.442 -0.371 -0.099) 1.492 24.527 ( 0.298 1.623 -0.004) 1.650 24.555 ( 0.801 -1.319 -0.351) 1.582 28.779 ( 1.766 5.110 1.196) 5.537 28.840 ( 1.002 3.312 -0.347) 3.478 28.914 ( 0.358 -1.605 1.576) 2.278 29.009 ( -1.142 -6.819 -1.302) 7.035 29.362 ( -2.642 3.298 -1.103) 4.367 29.419 ( -2.471 -2.525 -0.874) 3.639 29.524 ( -2.433 1.063 0.430) 2.690 29.540 ( -2.763 -0.419 0.654) 2.870 33.401 ( 7.414 3.043 -0.137) 8.015 33.411 ( 7.623 3.839 -0.191) 8.537 33.479 ( 7.845 -4.150 0.467) 8.887 33.507 ( 7.780 -4.969 -0.168) 9.232 36.015 ( -5.820 11.148 0.375) 12.581 36.187 ( -8.115 -2.746 -2.388) 8.894 36.352 ( -11.802 12.764 3.163) 17.669 36.696 ( -16.020 -18.823 -0.977) 24.737 38.167 ( -4.367 18.382 -0.589) 18.903 38.330 ( -6.849 17.924 0.720) 19.202 38.535 ( -4.298 -16.841 -1.317) 17.430 38.711 ( -7.035 -17.843 2.273) 19.314 38.981 ( -4.900 8.586 0.008) 9.886 39.174 ( -8.030 -9.900 -0.235) 12.749 39.666 ( -8.301 2.297 -1.617) 8.764 39.715 ( -8.342 -1.009 0.745) 8.435 40.513 ( -15.379 17.851 -2.590) 23.704 40.845 ( -18.324 -14.599 1.098) 23.454 41.435 ( -21.862 10.536 0.108) 24.269 41.629 ( -25.515 -8.561 1.054) 26.933 43.520 ( -8.458 13.517 3.314) 16.286 43.775 ( -9.499 -11.879 -0.193) 15.211 44.163 ( -19.650 6.603 -0.186) 20.731 44.297 ( -17.551 -6.621 -1.818) 18.846 69.868 ( -15.638 13.007 0.876) 20.359 70.109 ( -20.918 -7.186 -6.210) 22.973 70.260 ( -23.767 6.633 4.446) 25.072 70.465 ( -29.132 -9.750 0.141) 30.721 105.113 ( -3.469 1.307 2.105) 4.263 105.139 ( -3.874 -1.325 2.072) 4.589 105.168 ( -5.279 0.579 -2.143) 5.727 105.179 ( -5.706 -0.461 -1.745) 5.985 ======================= Grid point 39 (24/102) ======================= q-point: ( 0.31 0.40 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 Number of triplets: 160 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.932 ( 24.939 18.187 10.989) 32.764 4.113 ( 24.687 4.019 1.132) 25.038 4.485 ( 19.950 -11.152 7.293) 23.991 4.513 ( 18.312 -14.737 7.741) 24.747 4.845 ( 9.900 2.920 -6.922) 12.428 4.952 ( 11.235 -7.131 -5.282) 14.317 5.169 ( 18.218 3.280 -9.873) 20.979 5.221 ( 19.091 -3.069 -10.857) 22.176 5.353 ( 13.587 0.934 7.631) 15.611 5.433 ( 12.517 -5.514 6.729) 15.244 5.923 ( 10.749 10.601 5.611) 16.106 5.975 ( 5.739 1.657 -4.403) 7.420 6.041 ( 9.055 0.353 -0.849) 9.101 6.167 ( 12.131 -7.940 2.006) 14.637 6.282 ( 12.268 7.696 -8.676) 16.882 6.408 ( 4.888 -0.054 -2.599) 5.537 6.578 ( 8.684 4.852 -9.591) 13.818 6.667 ( 5.268 6.089 3.015) 8.597 6.727 ( 6.634 1.218 6.597) 9.435 6.780 ( 8.583 -9.843 5.134) 14.033 7.083 ( 2.079 4.797 -1.247) 5.375 7.190 ( 1.740 -2.937 -2.654) 4.325 7.365 ( 12.900 5.834 1.913) 14.286 7.404 ( 1.416 3.354 3.435) 5.005 7.419 ( -2.078 4.077 -2.646) 5.286 7.521 ( -0.288 7.660 3.309) 8.348 7.561 ( 20.130 6.930 -3.471) 21.571 7.615 ( 11.137 -8.599 -2.038) 14.218 7.839 ( 6.491 0.850 2.671) 7.071 8.055 ( 6.811 -14.268 1.941) 15.928 8.243 ( -1.056 5.167 1.611) 5.514 8.288 ( 4.555 2.843 -7.723) 9.406 8.333 ( 3.165 2.043 3.201) 4.943 8.374 ( 5.418 -5.579 -2.069) 8.048 8.542 ( -0.063 4.386 7.117) 8.360 8.637 ( 10.138 -0.484 1.759) 10.301 8.657 ( 7.083 -5.906 -0.491) 9.235 8.722 ( 12.822 4.119 4.188) 14.104 8.791 ( 1.185 -7.535 -7.897) 10.979 8.886 ( 9.337 -4.904 -2.542) 10.848 9.167 ( 11.877 3.851 2.279) 12.692 9.230 ( 9.939 -3.212 0.257) 10.448 9.392 ( 10.699 -0.558 -1.014) 10.761 9.418 ( 13.392 -1.550 4.479) 14.206 9.563 ( 14.283 2.174 -3.571) 14.883 9.627 ( 16.385 -3.278 -1.836) 16.810 9.700 ( 16.389 1.124 -3.747) 16.850 9.716 ( 17.598 -0.898 -0.858) 17.641 9.928 ( 13.998 2.820 0.484) 14.287 10.002 ( 13.056 -3.798 -0.459) 13.605 10.297 ( 8.666 9.629 -2.713) 13.235 10.465 ( 9.188 -7.386 -1.094) 11.840 10.971 ( 1.861 6.468 4.212) 7.940 11.032 ( 2.873 0.276 7.575) 8.107 11.137 ( 6.014 3.892 -0.606) 7.189 11.209 ( 4.316 -3.408 -6.693) 8.663 11.526 ( 0.426 1.454 -9.380) 9.501 11.593 ( 0.001 -5.316 -0.634) 5.354 11.956 ( 0.910 7.782 10.245) 12.897 12.078 ( 1.088 -3.950 5.961) 7.234 12.250 ( 0.434 1.525 -1.436) 2.139 12.326 ( -2.967 -6.345 -0.370) 7.015 12.421 ( 8.140 2.670 1.586) 8.713 12.461 ( 7.633 -1.744 1.406) 7.955 13.308 ( 2.873 8.387 0.867) 8.907 13.398 ( 3.171 -0.489 -1.296) 3.460 13.674 ( 3.025 0.040 -0.987) 3.182 13.737 ( 0.955 -5.453 -0.644) 5.573 14.151 ( 0.061 1.387 -1.623) 2.136 14.176 ( -1.965 0.072 -0.022) 1.966 14.371 ( -0.470 -0.691 -1.406) 1.636 14.469 ( -0.786 -8.872 1.753) 9.078 14.611 ( -2.717 0.139 1.777) 3.249 14.628 ( -1.438 -1.621 2.778) 3.523 14.777 ( -2.562 3.948 -1.852) 5.058 14.865 ( -0.806 -4.253 -3.119) 5.335 15.040 ( -4.288 3.332 -2.313) 5.902 15.101 ( -4.265 -2.592 0.343) 5.002 15.249 ( -5.051 1.680 -0.637) 5.361 15.322 ( -4.504 -4.895 1.861) 6.907 18.140 ( -0.924 15.858 0.492) 15.892 18.266 ( -2.699 13.696 0.158) 13.960 18.424 ( -0.241 -11.386 -1.245) 11.457 18.487 ( -1.364 -7.038 2.565) 7.614 18.813 ( -1.552 5.465 -2.209) 6.096 18.875 ( -1.802 3.879 0.771) 4.346 18.968 ( -4.119 -6.896 -0.220) 8.035 19.010 ( -2.738 -7.107 -0.097) 7.617 20.078 ( 7.668 3.144 -0.511) 8.304 20.093 ( 6.178 3.690 0.071) 7.196 20.140 ( 6.871 -3.044 -0.748) 7.552 20.164 ( 4.538 -3.415 1.004) 5.768 21.290 ( 14.733 1.955 -3.026) 15.167 21.335 ( 14.305 -2.544 -2.936) 14.823 21.463 ( 14.330 0.831 2.734) 14.612 21.479 ( 14.149 -0.774 3.045) 14.493 22.261 ( 17.278 6.096 -3.065) 18.576 22.307 ( 12.387 6.367 2.346) 14.124 22.436 ( 15.912 -4.462 -1.633) 16.606 22.543 ( 7.028 -10.222 3.239) 12.821 24.337 ( -1.066 1.373 -0.684) 1.868 24.368 ( 0.079 -1.814 -0.360) 1.851 24.544 ( 1.224 1.955 0.397) 2.340 24.577 ( 1.325 -1.449 -0.143) 1.969 28.819 ( 1.898 3.828 0.864) 4.359 28.865 ( 1.408 1.941 0.304) 2.417 28.924 ( 0.387 -1.256 0.816) 1.547 28.987 ( -0.730 -4.786 -1.078) 4.960 29.312 ( -2.150 3.243 -0.840) 3.981 29.370 ( -2.229 -2.738 -0.823) 3.625 29.478 ( -2.264 0.728 0.437) 2.418 29.488 ( -2.399 -0.267 0.564) 2.479 33.540 ( 6.332 3.439 0.012) 7.206 33.556 ( 6.727 3.826 -0.157) 7.740 33.627 ( 6.582 -3.999 0.282) 7.707 33.653 ( 6.707 -4.605 -0.141) 8.137 35.912 ( -4.377 8.260 -0.067) 9.348 36.037 ( -6.302 -0.447 -1.380) 6.466 36.160 ( -8.100 7.138 2.216) 11.022 36.409 ( -12.334 -14.191 -0.648) 18.813 38.095 ( -2.821 17.963 0.363) 18.187 38.194 ( -6.552 17.503 -0.457) 18.695 38.466 ( -2.576 -16.507 0.183) 16.708 38.576 ( -6.481 -17.656 0.269) 18.810 38.905 ( -2.728 4.938 0.347) 5.653 39.028 ( -6.239 -6.707 -0.026) 9.160 39.487 ( -9.006 2.269 -2.471) 9.611 39.539 ( -9.346 -1.455 1.406) 9.563 40.257 ( -9.841 13.248 -1.588) 16.580 40.531 ( -13.318 -12.891 2.106) 18.654 41.019 ( -19.351 7.718 -0.727) 20.846 41.156 ( -21.635 -5.595 0.611) 22.355 43.367 ( -7.254 12.563 2.270) 14.683 43.594 ( -8.125 -9.104 -2.361) 12.429 43.813 ( -15.372 6.650 1.859) 16.851 43.973 ( -14.243 -8.309 -1.445) 16.552 69.576 ( -13.503 8.736 0.845) 16.105 69.717 ( -16.647 -1.631 -4.632) 17.356 69.847 ( -18.479 0.423 3.740) 18.859 69.956 ( -21.567 -6.556 -0.137) 22.542 105.045 ( -3.547 0.592 0.787) 3.681 105.055 ( -4.466 -0.335 -0.463) 4.502 105.074 ( -3.779 0.319 -0.695) 3.855 105.083 ( -3.733 -0.524 0.462) 3.798 ======================= Grid point 40 (25/102) ======================= q-point: ( 0.38 0.40 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 Number of triplets: 162 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 4.435 ( 22.620 11.150 8.419) 26.587 4.582 ( 20.964 -1.684 2.413) 21.169 4.833 ( 13.333 -4.933 5.258) 15.158 4.861 ( 13.026 -7.751 7.891) 17.089 5.017 ( 9.766 3.585 -6.574) 12.306 5.150 ( 10.477 -9.298 -3.825) 14.521 5.476 ( 13.697 6.243 -6.100) 16.242 5.556 ( 15.411 -2.286 -3.923) 16.066 5.645 ( 13.729 -1.907 3.035) 14.189 5.678 ( 10.647 -3.460 4.142) 11.937 6.057 ( 5.541 2.246 0.240) 5.984 6.076 ( 5.848 -0.699 -4.418) 7.363 6.211 ( 4.275 5.609 0.658) 7.083 6.306 ( 1.965 -0.407 -0.796) 2.159 6.424 ( 5.156 4.201 -10.328) 12.284 6.476 ( 4.071 2.600 -3.674) 6.069 6.665 ( 2.409 1.848 -7.802) 8.372 6.780 ( 4.923 -0.407 3.269) 5.924 6.890 ( 4.517 3.880 4.505) 7.467 6.935 ( 6.571 -4.116 9.934) 12.601 7.060 ( -3.153 2.534 -1.890) 4.465 7.161 ( -2.326 -3.265 -3.868) 5.571 7.360 ( -2.483 4.036 1.102) 4.865 7.392 ( -0.594 1.682 0.948) 2.020 7.463 ( -3.983 9.217 5.276) 11.342 7.574 ( 2.600 0.620 5.268) 5.908 7.738 ( -0.438 -2.290 0.843) 2.479 7.762 ( 6.406 -5.205 -1.150) 8.334 7.939 ( -1.040 9.873 -4.596) 10.940 8.088 ( -7.267 -6.326 -1.858) 9.813 8.278 ( 3.911 0.584 -4.297) 5.840 8.290 ( -5.830 -4.660 -1.415) 7.596 8.350 ( 7.611 -1.502 1.525) 7.906 8.431 ( 3.935 -7.089 4.004) 9.043 8.552 ( -4.417 -0.342 -1.237) 4.600 8.570 ( -0.344 -2.106 6.477) 6.820 8.774 ( 0.999 1.690 -2.947) 3.541 8.812 ( 2.613 -2.419 -2.243) 4.208 9.034 ( 12.390 7.037 7.377) 16.045 9.091 ( 7.689 0.377 2.678) 8.150 9.438 ( 8.337 2.384 -8.662) 12.256 9.488 ( 15.103 -2.280 -3.148) 15.595 9.576 ( 9.398 0.260 -0.058) 9.402 9.626 ( 8.523 -3.514 -0.038) 9.219 9.836 ( 12.323 4.211 -0.160) 13.023 9.921 ( 12.390 -3.192 -4.350) 13.514 9.974 ( 11.689 4.284 -1.322) 12.519 10.051 ( 13.872 -3.219 0.233) 14.242 10.205 ( 12.648 3.426 0.097) 13.104 10.293 ( 15.888 -4.937 -0.998) 16.668 10.464 ( 9.436 8.899 -0.778) 12.994 10.624 ( 7.295 -6.840 -0.261) 10.003 11.045 ( 3.393 6.311 5.214) 8.862 11.124 ( 4.608 -1.478 5.230) 7.126 11.235 ( 3.056 1.884 -0.539) 3.630 11.296 ( 3.418 -4.553 2.196) 6.102 11.543 ( 2.844 0.591 -6.577) 7.190 11.604 ( 1.235 -5.743 -1.332) 6.023 12.006 ( 2.576 6.683 5.717) 9.164 12.148 ( 4.108 -6.775 3.953) 8.855 12.326 ( 7.765 0.244 -2.072) 8.040 12.358 ( 7.211 -3.243 -1.919) 8.136 12.652 ( 13.349 3.317 0.729) 13.774 12.684 ( 13.596 -0.053 0.708) 13.615 13.325 ( -1.191 8.958 0.368) 9.044 13.390 ( -3.768 1.300 -0.687) 4.044 13.660 ( -4.126 0.228 0.135) 4.135 13.718 ( -2.201 -4.371 0.139) 4.896 14.127 ( -1.998 4.879 -1.560) 5.498 14.180 ( 2.011 -0.848 0.724) 2.300 14.376 ( 1.186 -2.776 -2.161) 3.713 14.450 ( -1.243 -9.679 1.411) 9.860 14.570 ( -1.786 1.085 2.219) 3.048 14.601 ( -2.118 -2.468 3.436) 4.731 14.763 ( 1.355 3.276 -2.381) 4.270 14.855 ( 0.238 -4.278 -4.448) 6.176 14.968 ( -2.251 2.123 -2.576) 4.026 15.026 ( -3.192 -3.165 -1.315) 4.684 15.155 ( -4.515 2.631 1.473) 5.429 15.238 ( -4.410 -5.253 2.825) 7.418 18.131 ( -0.030 16.179 -0.552) 16.189 18.225 ( -1.411 14.811 0.737) 14.896 18.416 ( -0.390 -10.560 -1.571) 10.684 18.479 ( -0.016 -9.419 2.655) 9.786 18.774 ( -1.727 3.362 -0.968) 3.902 18.839 ( -1.752 2.254 0.418) 2.885 18.887 ( -3.822 -4.693 -0.082) 6.053 18.951 ( -3.036 -5.903 -0.525) 6.659 20.190 ( 3.740 2.448 0.585) 4.509 20.206 ( 5.045 2.573 -1.176) 5.784 20.236 ( 2.693 -2.044 1.116) 3.560 20.254 ( 4.489 -2.196 -0.684) 5.044 21.551 ( 11.505 1.602 -2.237) 11.830 21.587 ( 11.084 -2.068 -2.042) 11.459 21.722 ( 10.813 0.771 1.954) 11.015 21.736 ( 10.720 -0.612 1.845) 10.895 22.489 ( 6.716 6.894 1.433) 9.730 22.549 ( 11.137 5.934 -1.566) 12.716 22.652 ( 4.450 -5.937 1.874) 7.653 22.720 ( 11.162 -7.658 -0.721) 13.556 24.326 ( -0.028 2.324 -0.627) 2.407 24.378 ( 0.879 -2.994 -0.410) 3.147 24.573 ( 1.460 1.865 0.535) 2.428 24.604 ( 1.293 -1.280 0.065) 1.820 28.856 ( 1.647 2.410 0.518) 2.964 28.893 ( 1.081 -0.216 0.829) 1.380 28.934 ( 0.666 0.271 0.012) 0.719 28.975 ( -0.261 -2.804 -0.797) 2.927 29.274 ( -1.491 2.859 -0.557) 3.272 29.327 ( -1.853 -2.605 -0.666) 3.266 29.436 ( -1.975 0.821 0.367) 2.170 29.449 ( -1.617 -0.456 0.440) 1.737 33.648 ( 4.390 3.907 0.072) 5.877 33.675 ( 5.105 3.934 -0.115) 6.446 33.738 ( 4.450 -3.836 0.117) 5.877 33.771 ( 5.018 -4.423 -0.076) 6.690 35.843 ( -2.446 5.434 -0.341) 5.969 35.931 ( -4.147 -1.258 -0.621) 4.377 36.035 ( -4.812 4.979 1.542) 7.093 36.201 ( -8.334 -9.691 -0.441) 12.789 38.050 ( -2.439 17.755 -0.813) 17.940 38.080 ( -3.998 17.906 1.030) 18.376 38.426 ( -1.896 -17.260 -0.244) 17.366 38.461 ( -4.435 -17.646 -0.025) 18.195 38.875 ( -0.369 2.183 0.779) 2.348 38.930 ( -3.354 -3.005 -0.242) 4.509 39.304 ( -8.554 1.976 -2.786) 9.211 39.356 ( -8.991 -2.275 1.879) 9.462 40.110 ( -4.575 9.420 -1.125) 10.532 40.322 ( -8.095 -10.626 2.167) 13.533 40.667 ( -15.402 6.555 -0.823) 16.759 40.776 ( -16.210 -3.950 0.124) 16.685 43.244 ( -5.273 11.975 1.558) 13.177 43.445 ( -5.904 -3.799 -4.141) 8.151 43.560 ( -10.468 3.112 3.764) 11.551 43.728 ( -9.928 -9.342 -1.068) 13.674 69.340 ( -9.959 5.837 0.658) 11.562 69.431 ( -11.032 -0.995 -3.154) 11.517 69.535 ( -13.304 0.010 2.879) 13.612 69.603 ( -13.622 -4.520 -0.423) 14.359 104.975 ( -3.164 0.245 -0.822) 3.279 104.980 ( -2.862 -0.261 -0.470) 2.912 105.011 ( -2.523 0.512 0.450) 2.613 105.021 ( -2.669 -0.471 0.868) 2.845 ======================= Grid point 41 (26/102) ======================= q-point: ( 0.44 0.40 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 Number of triplets: 160 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 4.824 ( 12.573 3.341 3.524) 13.478 4.898 ( 8.712 -3.236 1.567) 9.425 5.042 ( 7.694 0.675 4.139) 8.763 5.089 ( 10.827 -1.918 4.969) 12.067 5.219 ( 9.833 2.713 -3.818) 10.892 5.346 ( 7.950 -7.677 -1.608) 11.168 5.673 ( 6.638 7.467 -2.218) 10.234 5.796 ( 7.173 -5.237 0.656) 8.906 5.839 ( 6.717 2.826 2.333) 7.652 5.901 ( 8.480 -2.852 2.477) 9.283 6.155 ( 2.473 3.479 -3.386) 5.448 6.185 ( 6.135 1.729 -5.318) 8.301 6.249 ( 0.837 1.840 2.253) 3.027 6.313 ( 2.384 -2.488 -0.328) 3.462 6.465 ( -0.001 3.159 -9.024) 9.561 6.537 ( 2.898 0.636 -5.833) 6.544 6.660 ( -1.552 4.787 0.011) 5.032 6.823 ( -3.195 -4.122 -1.673) 5.477 6.868 ( -1.922 3.823 2.205) 4.814 6.995 ( -3.668 -6.517 5.022) 9.008 7.081 ( 4.317 6.289 -3.460) 8.375 7.167 ( 4.767 -1.153 -1.261) 5.064 7.320 ( -3.066 2.738 0.272) 4.119 7.371 ( -2.955 1.505 5.204) 6.171 7.440 ( 0.230 1.427 5.504) 5.691 7.515 ( 0.065 -4.016 5.223) 6.589 7.769 ( -5.712 4.043 -5.221) 8.731 7.813 ( -1.708 -2.514 5.687) 6.448 7.848 ( -0.384 -6.067 1.592) 6.284 7.901 ( -8.301 -7.588 -0.132) 11.247 8.154 ( -3.560 8.275 -9.688) 13.229 8.291 ( -1.280 -4.015 -6.232) 7.523 8.424 ( -0.899 3.827 1.354) 4.158 8.504 ( 2.820 -2.192 3.410) 4.938 8.523 ( -1.489 0.885 4.640) 4.953 8.562 ( -0.878 -4.483 2.515) 5.214 8.846 ( 5.859 2.907 -1.166) 6.643 8.891 ( 4.654 -1.606 -2.940) 5.735 9.178 ( 1.833 2.909 1.580) 3.784 9.214 ( 4.234 2.780 6.841) 8.512 9.493 ( 0.927 7.391 -9.099) 11.759 9.651 ( 3.986 -5.131 -2.586) 6.993 9.740 ( 4.619 -1.102 -0.682) 4.797 9.779 ( 5.458 -2.476 3.923) 7.163 10.042 ( 7.786 4.846 -1.333) 9.267 10.114 ( 7.125 2.157 -2.041) 7.719 10.135 ( 4.610 1.528 -2.260) 5.357 10.282 ( 10.008 -7.280 -3.517) 12.865 10.433 ( 9.577 10.064 2.256) 14.075 10.578 ( 11.448 -1.543 -0.928) 11.589 10.677 ( 10.414 -0.484 0.165) 10.426 10.753 ( 4.753 -6.265 -0.070) 7.865 11.096 ( 0.659 7.018 4.072) 8.140 11.202 ( 2.009 -2.909 5.626) 6.644 11.246 ( -1.387 1.875 -0.260) 2.347 11.323 ( -1.550 -6.158 2.826) 6.950 11.600 ( 3.291 -0.902 -3.225) 4.695 11.632 ( 1.709 -4.512 -2.136) 5.276 12.065 ( 1.940 5.601 1.898) 6.224 12.213 ( 1.742 -8.947 0.985) 9.168 12.561 ( 14.600 1.348 -0.503) 14.671 12.590 ( 14.807 -1.780 -1.552) 14.995 12.894 ( 8.748 3.403 -0.498) 9.400 12.951 ( 10.483 -1.922 -0.477) 10.668 13.254 ( -8.051 3.348 1.188) 8.800 13.273 ( -4.128 3.244 0.033) 5.250 13.557 ( -4.748 6.132 0.809) 7.798 13.652 ( -4.223 -1.507 0.317) 4.495 14.082 ( -1.938 7.735 -1.031) 8.040 14.235 ( 2.918 -4.692 1.178) 5.650 14.389 ( -0.035 -1.283 -1.340) 1.855 14.446 ( 1.218 -7.076 -1.063) 7.259 14.534 ( -2.295 0.184 1.113) 2.557 14.569 ( -1.676 -3.758 3.320) 5.287 14.796 ( 1.689 0.628 -0.965) 2.044 14.842 ( -0.639 -1.627 -3.780) 4.165 14.941 ( -0.663 -1.481 -1.275) 2.064 14.974 ( -0.878 -1.924 -2.969) 3.645 15.078 ( -3.318 2.469 2.264) 4.715 15.160 ( -3.720 -5.418 2.809) 7.147 18.134 ( 0.356 16.302 -0.785) 16.325 18.210 ( -0.399 15.821 0.719) 15.842 18.403 ( -0.595 -9.150 -0.453) 9.181 18.492 ( 0.758 -11.776 1.149) 11.856 18.747 ( -0.865 1.627 -0.228) 1.857 18.808 ( -1.663 -3.076 0.517) 3.535 18.826 ( -1.573 0.238 -0.543) 1.681 18.891 ( -2.616 -4.486 -0.336) 5.204 20.245 ( 1.720 1.713 0.193) 2.435 20.275 ( 1.551 -0.818 -0.771) 1.916 20.280 ( 2.052 1.854 0.764) 2.869 20.320 ( 2.147 -1.743 -0.284) 2.780 21.729 ( 6.408 1.314 -1.224) 6.654 21.758 ( 6.069 -1.624 -0.989) 6.360 21.896 ( 6.000 0.595 1.115) 6.132 21.905 ( 5.689 -0.345 0.733) 5.746 22.587 ( 3.018 5.576 0.808) 6.392 22.694 ( 3.154 -3.118 -0.483) 4.461 22.733 ( 4.014 5.415 0.815) 6.790 22.887 ( 5.567 -8.061 -0.495) 9.809 24.328 ( 0.292 3.041 -0.378) 3.078 24.396 ( 0.830 -3.782 -0.274) 3.882 24.599 ( 0.964 1.588 0.371) 1.895 24.626 ( 0.766 -1.011 0.119) 1.274 28.883 ( 0.817 1.332 0.247) 1.582 28.909 ( 0.445 -1.224 0.601) 1.434 28.951 ( 0.901 0.739 -0.088) 1.168 28.971 ( -0.059 -1.249 -0.522) 1.355 29.251 ( -0.730 2.345 -0.260) 2.470 29.296 ( -1.131 -2.185 -0.379) 2.490 29.404 ( -1.207 1.244 0.227) 1.748 29.425 ( -0.813 -0.918 0.226) 1.247 33.715 ( 2.184 4.292 0.050) 4.816 33.755 ( 2.836 4.398 -0.077) 5.233 33.804 ( 2.102 -4.009 0.054) 4.527 33.849 ( 2.701 -4.389 -0.029) 5.154 35.812 ( -0.649 2.667 -0.370) 2.770 35.866 ( -2.345 -2.341 -0.127) 3.316 35.972 ( -1.802 4.007 0.959) 4.497 36.072 ( -4.528 -5.729 -0.358) 7.311 37.982 ( -2.692 18.381 -1.200) 18.616 38.053 ( -0.365 18.267 1.674) 18.347 38.363 ( -2.921 -18.614 -1.513) 18.903 38.426 ( -0.520 -17.892 0.956) 17.925 38.877 ( -0.427 1.919 1.107) 2.256 38.911 ( 2.069 -1.224 -0.612) 2.480 39.139 ( -7.185 1.914 -2.048) 7.712 39.202 ( -6.159 -3.700 1.400) 7.320 40.066 ( 0.229 6.217 -0.835) 6.277 40.210 ( -3.808 -7.772 1.679) 8.816 40.412 ( -9.432 6.632 -0.543) 11.543 40.515 ( -9.529 -3.858 -0.159) 10.282 43.166 ( -2.770 11.749 0.829) 12.099 43.345 ( -3.126 5.572 -3.943) 7.507 43.410 ( -5.260 -5.288 3.751) 8.349 43.575 ( -5.079 -9.987 -0.593) 11.220 69.187 ( -5.335 4.262 0.304) 6.835 69.262 ( -5.309 -2.371 -1.882) 6.111 69.333 ( -7.147 2.195 1.735) 7.675 69.404 ( -6.420 -3.968 -0.166) 7.549 104.926 ( -1.605 0.416 -0.451) 1.718 104.935 ( -1.516 -0.494 -0.456) 1.658 104.974 ( -1.261 0.364 0.381) 1.366 104.980 ( -1.494 -0.272 0.532) 1.609 ======================= Grid point 42 (27/102) ======================= q-point: (-0.50 0.40 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 Number of triplets: 86 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 4.931 ( 0.000 0.303 0.000) 0.303 4.974 ( 0.000 -4.285 -0.000) 4.285 5.159 ( 0.000 3.888 0.000) 3.888 5.241 ( 0.000 -4.340 0.000) 4.340 5.315 ( 0.000 5.903 -0.000) 5.903 5.423 ( 0.000 -4.714 0.000) 4.714 5.735 ( 0.000 7.620 -0.000) 7.620 5.855 ( 0.000 -2.772 0.000) 2.772 5.904 ( 0.000 0.645 0.000) 0.645 5.986 ( -0.000 -5.456 -0.000) 5.456 6.182 ( 0.000 6.094 0.000) 6.094 6.241 ( 0.000 0.629 -0.000) 0.629 6.272 ( 0.000 8.997 0.000) 8.997 6.383 ( 0.000 -3.779 0.000) 3.779 6.436 ( 0.000 -0.113 0.000) 0.113 6.531 ( 0.000 -8.534 -0.000) 8.534 6.658 ( 0.000 12.448 -0.000) 12.448 6.729 ( -0.000 7.805 0.000) 7.805 6.910 ( -0.000 -5.456 0.000) 5.456 6.914 ( 0.000 -8.098 -0.000) 8.098 7.180 ( 0.000 -2.066 -0.000) 2.066 7.183 ( -0.000 -1.247 0.000) 1.247 7.261 ( -0.000 0.607 0.000) 0.607 7.320 ( 0.000 -3.913 -0.000) 3.913 7.523 ( -0.000 8.233 -0.000) 8.233 7.523 ( 0.000 2.975 0.000) 2.975 7.695 ( -0.000 -4.213 0.000) 4.213 7.750 ( 0.000 -6.721 0.000) 6.721 7.819 ( -0.000 -2.607 -0.000) 2.607 7.835 ( 0.000 -5.374 -0.000) 5.374 8.122 ( 0.000 9.733 -0.000) 9.733 8.250 ( 0.000 -3.328 0.000) 3.328 8.451 ( 0.000 4.565 0.000) 4.565 8.482 ( -0.000 4.046 -0.000) 4.046 8.536 ( 0.000 -3.738 -0.000) 3.738 8.550 ( 0.000 -2.935 0.000) 2.935 8.926 ( 0.000 1.334 -0.000) 1.334 8.929 ( 0.000 0.243 0.000) 0.243 9.196 ( 0.000 1.623 0.000) 1.623 9.256 ( 0.000 -1.241 -0.000) 1.241 9.490 ( 0.000 12.748 0.000) 12.748 9.683 ( 0.000 -1.705 0.000) 1.705 9.783 ( 0.000 -4.057 -0.000) 4.057 9.834 ( 0.000 -4.525 0.000) 4.525 10.116 ( 0.000 2.607 0.000) 2.607 10.168 ( 0.000 -2.936 0.000) 2.936 10.199 ( 0.000 9.601 -0.000) 9.601 10.385 ( 0.000 -7.782 -0.000) 7.782 10.543 ( 0.000 12.714 0.000) 12.714 10.722 ( 0.000 3.783 -0.000) 3.783 10.775 ( 0.000 -10.305 0.000) 10.305 10.807 ( 0.000 -3.665 -0.000) 3.665 11.103 ( 0.000 6.812 -0.000) 6.812 11.207 ( 0.000 2.941 0.000) 2.941 11.265 ( 0.000 -2.364 0.000) 2.364 11.269 ( -0.000 -8.888 -0.000) 8.888 11.635 ( 0.000 -1.486 -0.000) 1.486 11.649 ( 0.000 -4.009 -0.000) 4.009 12.086 ( 0.000 5.268 0.000) 5.268 12.230 ( 0.000 -8.863 0.000) 8.863 12.773 ( 0.000 4.459 0.000) 4.459 12.843 ( 0.000 -2.621 -0.000) 2.621 12.945 ( 0.000 -0.611 0.000) 0.611 12.955 ( -0.000 -1.573 -0.000) 1.573 13.187 ( 0.000 2.859 -0.000) 2.859 13.230 ( 0.000 -1.162 -0.000) 1.162 13.513 ( 0.000 9.578 0.000) 9.578 13.590 ( 0.000 2.743 0.000) 2.743 14.059 ( 0.000 8.989 0.000) 8.989 14.275 ( 0.000 -10.599 0.000) 10.599 14.382 ( -0.000 5.004 -0.000) 5.004 14.467 ( 0.000 -4.597 0.000) 4.597 14.505 ( 0.000 -1.240 0.000) 1.240 14.551 ( 0.000 -6.096 0.000) 6.096 14.813 ( 0.000 -1.325 -0.000) 1.325 14.828 ( 0.000 -1.337 -0.000) 1.337 14.927 ( 0.000 -0.153 0.000) 0.153 14.973 ( 0.000 -2.144 0.000) 2.144 15.044 ( 0.000 1.845 -0.000) 1.845 15.120 ( 0.000 -5.350 0.000) 5.350 18.137 ( 0.000 16.307 0.000) 16.307 18.208 ( 0.000 16.424 0.000) 16.424 18.395 ( 0.000 -8.747 -0.000) 8.747 18.503 ( 0.000 -12.791 0.000) 12.791 18.738 ( 0.000 0.915 0.000) 0.915 18.786 ( 0.000 -3.305 0.000) 3.305 18.818 ( 0.000 -0.310 0.000) 0.310 18.859 ( -0.000 -3.220 -0.000) 3.220 20.262 ( 0.000 1.475 -0.000) 1.475 20.288 ( 0.000 -1.099 -0.000) 1.099 20.302 ( 0.000 2.302 0.000) 2.302 20.341 ( 0.000 -1.595 0.000) 1.595 21.793 ( 0.000 1.175 0.000) 1.175 21.819 ( 0.000 -1.410 0.000) 1.410 21.960 ( 0.000 0.173 -0.000) 0.173 21.961 ( 0.000 0.120 0.000) 0.120 22.618 ( 0.000 4.988 0.000) 4.988 22.718 ( 0.000 -5.065 -0.000) 5.065 22.779 ( 0.000 8.164 0.000) 8.164 22.942 ( 0.000 -8.144 0.000) 8.144 24.332 ( 0.000 3.316 0.000) 3.316 24.405 ( 0.000 -4.070 0.000) 4.070 24.610 ( 0.000 1.439 0.000) 1.439 24.634 ( 0.000 -0.874 0.000) 0.874 28.890 ( 0.000 1.087 0.000) 1.087 28.914 ( 0.000 -1.322 0.000) 1.322 28.962 ( 0.000 0.216 -0.000) 0.216 28.969 ( 0.000 -0.448 0.000) 0.448 29.243 ( 0.000 2.099 0.000) 2.099 29.283 ( 0.000 -1.931 -0.000) 1.931 29.391 ( 0.000 1.473 0.000) 1.473 29.417 ( 0.000 -1.144 0.000) 1.144 33.736 ( 0.000 4.445 -0.000) 4.445 33.785 ( 0.000 4.885 0.000) 4.885 33.825 ( 0.000 -4.376 -0.000) 4.376 33.877 ( 0.000 -4.392 -0.000) 4.392 35.809 ( 0.000 0.992 0.000) 0.992 35.839 ( 0.000 -2.009 0.000) 2.009 35.958 ( 0.000 2.948 -0.000) 2.948 36.023 ( 0.000 -3.634 0.000) 3.634 37.953 ( 0.000 18.662 0.000) 18.662 38.052 ( 0.000 18.753 -0.000) 18.753 38.330 ( 0.000 -19.212 0.000) 19.212 38.422 ( 0.000 -18.328 -0.000) 18.328 38.875 ( 0.000 3.799 0.000) 3.799 38.963 ( 0.000 -5.156 0.000) 5.156 39.034 ( -0.000 5.241 -0.000) 5.241 39.138 ( 0.000 -4.962 -0.000) 4.962 40.087 ( -0.000 3.788 0.000) 3.788 40.163 ( 0.000 -3.724 0.000) 3.724 40.315 ( -0.000 5.589 -0.000) 5.589 40.413 ( 0.000 -4.395 0.000) 4.395 43.139 ( 0.000 11.717 0.000) 11.717 43.309 ( 0.000 11.338 0.000) 11.338 43.362 ( 0.000 -10.746 -0.000) 10.746 43.523 ( 0.000 -10.227 0.000) 10.227 69.133 ( 0.000 3.785 0.000) 3.785 69.208 ( 0.000 -3.719 0.000) 3.719 69.262 ( 0.000 3.898 -0.000) 3.898 69.340 ( 0.000 -3.896 0.000) 3.896 104.909 ( 0.000 0.455 0.000) 0.455 104.919 ( 0.000 -0.523 0.000) 0.523 104.962 ( 0.000 0.194 0.000) 0.194 104.965 ( 0.000 -0.116 -0.000) 0.116 ======================= Grid point 85 (28/102) ======================= q-point: ( 0.00 0.00 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 Number of triplets: 96 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.663 ( 6.906 0.000 33.278) 33.987 1.166 ( -3.932 0.000 56.768) 56.904 1.934 ( -3.380 0.000 -24.574) 24.806 1.967 ( -2.694 0.000 92.720) 92.759 2.855 ( -0.182 0.000 5.387) 5.390 3.219 ( -1.134 0.000 -29.952) 29.973 3.449 ( 1.525 0.000 -21.366) 21.421 3.615 ( 0.993 0.000 18.203) 18.230 3.884 ( -1.473 0.000 12.885) 12.969 4.064 ( -1.924 0.000 -0.310) 1.949 4.196 ( 6.143 0.000 -7.281) 9.526 4.447 ( -1.353 0.000 -8.472) 8.580 4.501 ( 4.340 0.000 -4.881) 6.531 4.574 ( 3.962 0.000 -1.977) 4.428 5.127 ( 1.329 0.000 6.718) 6.848 5.270 ( 2.369 0.000 11.935) 12.168 5.320 ( -0.097 0.000 -6.676) 6.677 5.347 ( 1.319 0.000 -2.535) 2.857 5.685 ( -6.081 0.000 -0.651) 6.116 5.952 ( 1.702 0.000 -45.672) 45.704 6.237 ( -0.439 0.000 -11.213) 11.222 6.250 ( -0.288 0.000 5.306) 5.314 6.427 ( 2.780 0.000 -9.370) 9.773 6.447 ( 2.119 0.000 -7.013) 7.327 6.463 ( -2.437 0.000 -11.070) 11.335 6.664 ( -1.348 0.000 1.907) 2.335 6.676 ( 1.706 0.000 -4.173) 4.508 6.735 ( 0.114 0.000 -3.877) 3.878 7.080 ( -4.207 0.000 7.824) 8.884 7.175 ( 0.638 0.000 2.249) 2.338 7.241 ( -2.192 0.000 15.073) 15.232 7.325 ( 0.306 0.000 -1.265) 1.302 7.495 ( 5.725 0.000 3.822) 6.884 7.533 ( -5.525 0.000 -2.551) 6.086 7.656 ( -3.972 0.000 -12.196) 12.826 7.686 ( 1.515 0.000 -1.869) 2.406 7.697 ( -2.203 0.000 1.682) 2.771 7.920 ( 2.961 0.000 10.239) 10.659 8.220 ( 1.536 0.000 16.998) 17.067 8.253 ( -0.493 0.000 4.787) 4.812 8.534 ( -5.282 0.000 14.086) 15.044 8.646 ( 3.918 0.000 -6.812) 7.858 8.705 ( -11.038 0.000 -1.218) 11.105 8.756 ( -1.916 0.000 0.887) 2.111 8.821 ( 4.956 0.000 -3.043) 5.816 9.143 ( -1.416 0.000 -13.177) 13.253 9.294 ( 3.385 0.000 6.432) 7.268 9.313 ( -3.745 0.000 14.239) 14.723 9.554 ( 4.200 0.000 3.629) 5.551 9.708 ( -2.585 0.000 -2.580) 3.652 10.355 ( -11.963 0.000 7.221) 13.973 10.504 ( 1.033 0.000 -8.055) 8.121 10.524 ( 2.927 0.000 15.887) 16.154 10.884 ( -11.305 0.000 -12.510) 16.861 10.896 ( 2.832 0.000 -7.608) 8.118 11.367 ( -1.347 0.000 -20.673) 20.717 11.765 ( 4.097 0.000 6.541) 7.718 11.880 ( -8.924 0.000 -1.841) 9.112 12.043 ( 2.573 0.000 6.474) 6.966 12.140 ( 3.642 0.000 0.910) 3.754 12.247 ( -9.591 0.000 4.382) 10.544 12.291 ( 3.698 0.000 5.548) 6.667 12.307 ( 9.026 0.000 -1.724) 9.189 12.467 ( 2.233 0.000 4.274) 4.823 12.757 ( 3.512 0.000 13.143) 13.604 13.232 ( 1.904 0.000 3.516) 3.999 13.455 ( -0.340 0.000 -3.213) 3.231 13.564 ( -12.593 0.000 -14.657) 19.324 14.397 ( 0.206 0.000 -1.651) 1.664 14.401 ( 1.381 0.000 -3.279) 3.558 14.456 ( -2.126 0.000 -6.797) 7.122 14.534 ( 3.359 0.000 -6.978) 7.745 14.854 ( -1.373 0.000 -0.637) 1.513 14.906 ( 1.460 0.000 -1.427) 2.042 15.357 ( -7.357 0.000 6.685) 9.940 15.377 ( -6.722 0.000 15.905) 17.267 15.618 ( -0.665 0.000 7.673) 7.701 15.636 ( 1.621 0.000 -4.330) 4.624 16.305 ( 26.599 0.000 -3.223) 26.793 16.451 ( -1.851 0.000 -7.160) 7.396 17.774 ( 4.097 0.000 6.129) 7.373 18.053 ( -25.188 0.000 -5.172) 25.713 18.218 ( 2.277 0.000 1.997) 3.029 18.248 ( -8.789 0.000 1.046) 8.851 18.736 ( -1.405 0.000 0.764) 1.600 18.771 ( -0.838 0.000 -0.836) 1.184 19.235 ( 2.013 0.000 2.715) 3.379 19.324 ( -1.680 0.000 -0.949) 1.930 19.504 ( 6.234 0.000 -4.863) 7.906 19.525 ( -2.893 0.000 -3.826) 4.796 19.783 ( -4.634 0.000 7.470) 8.791 20.031 ( 11.220 0.000 -3.319) 11.701 20.129 ( -0.426 0.000 1.555) 1.612 20.240 ( 3.970 0.000 -3.656) 5.397 20.318 ( -5.859 0.000 -1.957) 6.177 20.367 ( -2.954 0.000 -0.231) 2.963 20.394 ( 0.176 0.000 -0.149) 0.231 20.424 ( 6.718 0.000 0.192) 6.720 20.530 ( 30.574 0.000 2.667) 30.690 20.557 ( -9.405 0.000 1.107) 9.470 24.464 ( 0.035 0.000 0.356) 0.358 24.531 ( -0.048 0.000 -1.991) 1.992 24.582 ( 0.482 0.000 2.523) 2.569 24.647 ( -0.492 0.000 -0.381) 0.622 28.506 ( 0.479 0.000 0.258) 0.544 28.514 ( -0.463 0.000 -0.115) 0.477 29.159 ( 2.503 0.000 4.611) 5.247 29.374 ( -0.400 0.000 -3.702) 3.724 29.525 ( -3.403 0.000 0.121) 3.405 29.545 ( 0.052 0.000 -0.879) 0.881 29.612 ( 0.538 0.000 0.900) 1.048 29.648 ( -0.481 0.000 -0.536) 0.720 32.920 ( -0.090 0.000 0.593) 0.600 32.962 ( 0.738 0.000 -1.377) 1.562 33.027 ( 0.549 0.000 1.658) 1.747 33.083 ( -0.036 0.000 -0.879) 0.880 35.887 ( -0.558 0.000 3.916) 3.955 36.082 ( 0.503 0.000 -3.792) 3.825 38.026 ( -0.063 0.000 0.176) 0.187 38.084 ( 3.839 0.000 -3.490) 5.188 38.364 ( 15.626 0.000 9.664) 18.373 38.718 ( -3.810 0.000 -3.638) 5.268 39.070 ( -48.591 0.000 -1.775) 48.623 39.086 ( 9.427 0.000 -5.816) 11.077 39.436 ( 2.521 0.000 3.210) 4.082 39.582 ( -6.620 0.000 -3.460) 7.470 39.964 ( 1.182 0.000 2.121) 2.428 39.979 ( -0.940 0.000 1.960) 2.174 40.800 ( -3.433 0.000 13.464) 13.894 41.689 ( 7.419 0.000 -27.592) 28.572 42.776 ( -0.524 0.000 22.388) 22.394 43.403 ( 0.198 0.000 -8.452) 8.454 44.765 ( 1.908 0.000 7.336) 7.580 45.152 ( 1.014 0.000 -9.737) 9.789 45.472 ( 9.788 0.000 6.245) 11.611 45.646 ( -2.201 0.000 -2.313) 3.193 70.161 ( 0.154 0.000 7.370) 7.371 70.658 ( -0.547 0.000 -13.279) 13.290 72.685 ( 10.474 0.000 12.661) 16.432 73.182 ( -61.625 0.000 -8.026) 62.145 105.248 ( 0.842 0.000 2.825) 2.947 105.387 ( -0.886 0.000 -2.673) 2.816 105.627 ( 11.493 0.000 0.710) 11.515 105.665 ( -1.900 0.000 -0.768) 2.049 ======================= Grid point 86 (29/102) ======================= q-point: ( 0.06 0.00 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 Number of triplets: 96 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.406 ( 15.735 0.000 48.386) 50.880 1.523 ( 47.914 0.000 23.543) 53.385 2.265 ( 36.735 0.000 -24.382) 44.090 2.285 ( 18.400 0.000 80.677) 82.748 3.092 ( 20.690 0.000 5.455) 21.397 3.251 ( 10.345 0.000 -35.062) 36.556 3.606 ( 16.998 0.000 -15.001) 22.671 3.822 ( 15.377 0.000 16.215) 22.347 4.060 ( 16.180 0.000 7.570) 17.863 4.137 ( 8.241 0.000 2.231) 8.537 4.433 ( 18.383 0.000 -3.755) 18.762 4.584 ( 16.236 0.000 -8.287) 18.229 4.689 ( 11.580 0.000 -9.414) 14.923 4.719 ( 10.486 0.000 -2.203) 10.715 5.215 ( 5.665 0.000 8.701) 10.383 5.393 ( 9.401 0.000 10.268) 13.922 5.480 ( 13.772 0.000 -12.448) 18.564 5.606 ( 22.735 0.000 -3.398) 22.987 5.643 ( 5.884 0.000 0.241) 5.888 5.925 ( 5.648 0.000 -44.481) 44.838 6.207 ( -0.319 0.000 -11.103) 11.108 6.234 ( -1.444 0.000 -0.355) 1.487 6.387 ( 0.915 0.000 -16.582) 16.607 6.480 ( 2.812 0.000 -4.532) 5.333 6.512 ( 3.200 0.000 0.211) 3.207 6.760 ( 1.421 0.000 -1.387) 1.986 6.835 ( 14.770 0.000 -1.108) 14.811 6.874 ( 17.030 0.000 -4.178) 17.535 7.125 ( 7.021 0.000 8.851) 11.298 7.245 ( 5.284 0.000 4.202) 6.751 7.275 ( 3.489 0.000 11.184) 11.716 7.422 ( 8.874 0.000 -1.854) 9.066 7.536 ( 5.355 0.000 0.231) 5.360 7.604 ( 1.801 0.000 -3.517) 3.951 7.649 ( 3.718 0.000 3.217) 4.917 7.753 ( 5.685 0.000 -2.375) 6.161 7.754 ( 11.572 0.000 -3.101) 11.980 8.069 ( 9.527 0.000 3.579) 10.177 8.240 ( -1.068 0.000 4.345) 4.474 8.307 ( 4.410 0.000 13.902) 14.585 8.433 ( -6.830 0.000 9.541) 11.733 8.655 ( 1.528 0.000 -5.642) 5.846 8.715 ( -0.133 0.000 4.573) 4.575 8.790 ( 11.203 0.000 -7.725) 13.608 8.978 ( 6.838 0.000 -7.948) 10.485 9.120 ( 0.994 0.000 -4.590) 4.697 9.337 ( 2.975 0.000 17.821) 18.067 9.385 ( 4.140 0.000 2.053) 4.622 9.710 ( 2.495 0.000 -2.220) 3.340 9.716 ( 12.047 0.000 3.814) 12.636 10.115 ( -10.692 0.000 9.829) 14.523 10.465 ( -3.661 0.000 -6.548) 7.502 10.619 ( 2.421 0.000 18.051) 18.213 10.667 ( -7.146 0.000 -4.753) 8.582 10.907 ( -0.374 0.000 -3.337) 3.357 11.232 ( -6.810 0.000 -22.422) 23.433 11.639 ( -12.016 0.000 -2.847) 12.348 11.788 ( -3.194 0.000 10.636) 11.105 12.140 ( -3.113 0.000 7.818) 8.415 12.168 ( 8.383 0.000 -0.892) 8.430 12.233 ( 3.991 0.000 4.624) 6.108 12.359 ( 0.977 0.000 1.073) 1.451 12.443 ( 9.011 0.000 6.533) 11.130 12.696 ( 12.230 0.000 -12.207) 17.280 12.845 ( 2.961 0.000 11.905) 12.268 13.185 ( -7.109 0.000 2.094) 7.411 13.288 ( -5.550 0.000 0.977) 5.635 13.390 ( -5.115 0.000 -2.173) 5.558 14.381 ( -2.774 0.000 -4.225) 5.054 14.389 ( -1.193 0.000 -1.574) 1.974 14.404 ( -0.541 0.000 -1.782) 1.862 14.586 ( 3.289 0.000 -7.431) 8.126 14.830 ( -0.752 0.000 -2.351) 2.468 14.874 ( -4.236 0.000 5.778) 7.164 15.112 ( -11.787 0.000 16.987) 20.676 15.225 ( -11.227 0.000 14.980) 18.720 15.584 ( -3.017 0.000 7.412) 8.002 15.619 ( -2.298 0.000 -4.226) 4.810 16.082 ( -14.094 0.000 1.522) 14.175 16.165 ( -20.687 0.000 -13.425) 24.662 17.919 ( 6.035 0.000 10.492) 12.104 18.123 ( 2.699 0.000 -13.328) 13.599 18.329 ( 6.077 0.000 5.135) 7.956 18.353 ( 10.607 0.000 -7.725) 13.122 18.709 ( -0.860 0.000 1.293) 1.553 18.789 ( 1.971 0.000 -1.377) 2.404 19.319 ( 5.319 0.000 3.744) 6.505 19.326 ( 2.313 0.000 -2.552) 3.444 19.461 ( -3.165 0.000 -5.836) 6.639 19.630 ( 6.153 0.000 -3.005) 6.848 19.681 ( -5.786 0.000 5.540) 8.011 20.007 ( -0.716 0.000 -0.806) 1.078 20.214 ( 5.246 0.000 0.061) 5.246 20.332 ( 5.734 0.000 -0.226) 5.739 20.364 ( 5.024 0.000 1.394) 5.213 20.418 ( 13.430 0.000 -2.505) 13.662 20.478 ( 8.541 0.000 1.606) 8.690 20.651 ( 16.530 0.000 -5.197) 17.328 20.682 ( 17.271 0.000 0.802) 17.289 21.709 ( 55.924 0.000 -48.572) 74.073 24.444 ( -1.916 0.000 1.361) 2.350 24.513 ( -1.239 0.000 -2.134) 2.468 24.583 ( -0.755 0.000 2.200) 2.326 24.610 ( -2.838 0.000 -0.582) 2.897 28.516 ( 0.641 0.000 -0.390) 0.750 28.529 ( 1.627 0.000 0.613) 1.739 29.187 ( -0.699 0.000 5.424) 5.469 29.344 ( -1.728 0.000 -4.215) 4.556 29.424 ( -4.933 0.000 4.474) 6.660 29.531 ( -1.103 0.000 -0.754) 1.336 29.618 ( -0.320 0.000 1.014) 1.064 29.633 ( -0.968 0.000 -0.827) 1.273 32.952 ( 3.140 0.000 0.537) 3.186 32.997 ( 2.954 0.000 -1.329) 3.239 33.135 ( 5.177 0.000 -0.539) 5.205 33.179 ( 10.956 0.000 -5.727) 12.363 35.858 ( -2.891 0.000 3.479) 4.524 36.050 ( -2.694 0.000 -3.439) 4.369 37.732 ( -41.688 0.000 27.983) 50.209 37.982 ( -3.714 0.000 0.151) 3.717 38.259 ( -7.092 0.000 10.999) 13.088 38.473 ( -17.135 0.000 -8.132) 18.967 38.675 ( 6.783 0.000 -0.294) 6.790 39.270 ( 6.637 0.000 3.262) 7.395 39.448 ( -7.182 0.000 -3.090) 7.818 39.475 ( -0.038 0.000 3.356) 3.356 39.944 ( -2.820 0.000 1.973) 3.442 39.988 ( 0.003 0.000 1.725) 1.725 40.717 ( -7.326 0.000 11.014) 13.228 41.678 ( -2.042 0.000 -26.344) 26.423 42.676 ( -14.132 0.000 21.493) 25.723 43.247 ( -13.489 0.000 -7.959) 15.662 44.549 ( -44.029 0.000 29.382) 52.932 44.719 ( -8.256 0.000 5.038) 9.672 45.259 ( -12.073 0.000 4.484) 12.879 45.400 ( -19.355 0.000 -5.972) 20.255 70.139 ( -3.932 0.000 7.927) 8.849 70.553 ( -7.010 0.000 -13.021) 14.788 72.028 ( -38.168 0.000 18.779) 42.537 72.675 ( -15.475 0.000 19.522) 24.911 105.257 ( -0.610 0.000 3.438) 3.491 105.343 ( -2.749 0.000 -3.360) 4.341 105.573 ( -6.271 0.000 -3.180) 7.031 105.608 ( -7.862 0.000 5.000) 9.318 ======================= Grid point 87 (30/102) ======================= q-point: ( 0.12 0.00 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 Number of triplets: 96 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.944 ( 27.803 0.000 35.905) 45.411 2.298 ( 24.384 0.000 48.230) 54.044 3.060 ( 42.365 0.000 -22.394) 47.920 3.109 ( 45.545 0.000 35.615) 57.817 3.467 ( 19.357 0.000 -35.819) 40.715 3.618 ( 29.256 0.000 3.889) 29.514 4.008 ( 23.913 0.000 -4.809) 24.392 4.243 ( 21.798 0.000 7.135) 22.936 4.380 ( 15.029 0.000 11.790) 19.101 4.496 ( 24.603 0.000 -3.757) 24.888 4.903 ( 21.407 0.000 9.776) 23.533 4.914 ( 11.194 0.000 -2.988) 11.586 4.930 ( 20.373 0.000 -13.419) 24.395 5.058 ( 28.759 0.000 -3.215) 28.938 5.373 ( 8.618 0.000 10.048) 13.238 5.639 ( 10.308 0.000 -11.341) 15.326 5.677 ( 16.199 0.000 -11.023) 19.594 6.004 ( 12.223 0.000 -36.167) 38.177 6.038 ( 21.898 0.000 -10.398) 24.242 6.140 ( 17.818 0.000 -0.877) 17.840 6.231 ( 4.204 0.000 -2.680) 4.985 6.248 ( 16.050 0.000 1.694) 16.139 6.416 ( 5.644 0.000 -3.913) 6.867 6.575 ( 9.910 0.000 -4.263) 10.788 6.618 ( 9.574 0.000 -2.017) 9.784 6.775 ( 0.633 0.000 1.685) 1.800 7.096 ( 1.391 0.000 2.278) 2.669 7.159 ( 13.270 0.000 2.653) 13.532 7.350 ( 14.294 0.000 7.458) 16.122 7.438 ( 10.601 0.000 3.120) 11.051 7.468 ( 16.497 0.000 2.169) 16.639 7.559 ( 4.610 0.000 0.983) 4.714 7.720 ( 9.537 0.000 -0.774) 9.569 7.749 ( 16.362 0.000 0.714) 16.377 7.824 ( 16.650 0.000 0.386) 16.654 7.918 ( 11.317 0.000 -3.723) 11.914 8.016 ( 10.057 0.000 -0.838) 10.092 8.290 ( 7.291 0.000 4.905) 8.788 8.292 ( 11.934 0.000 1.333) 12.008 8.338 ( -2.259 0.000 5.585) 6.025 8.469 ( 10.383 0.000 1.006) 10.432 8.670 ( 0.615 0.000 4.184) 4.229 8.775 ( 5.443 0.000 3.862) 6.674 8.906 ( 1.198 0.000 -7.460) 7.556 9.030 ( 1.338 0.000 -5.309) 5.475 9.190 ( 6.234 0.000 -3.882) 7.344 9.438 ( 0.952 0.000 1.474) 1.754 9.465 ( 4.946 0.000 16.111) 16.853 9.776 ( 2.574 0.000 -0.051) 2.574 10.033 ( 15.595 0.000 -6.770) 17.001 10.034 ( 1.526 0.000 8.993) 9.122 10.350 ( -4.679 0.000 4.423) 6.438 10.515 ( -6.322 0.000 -1.321) 6.459 10.734 ( 4.764 0.000 11.533) 12.479 10.856 ( -5.526 0.000 -0.526) 5.551 11.050 ( -4.678 0.000 -21.437) 21.942 11.400 ( -10.667 0.000 -6.146) 12.311 11.720 ( -4.921 0.000 7.978) 9.374 12.114 ( -1.989 0.000 9.686) 9.888 12.262 ( -1.630 0.000 4.004) 4.323 12.303 ( 4.466 0.000 -0.950) 4.566 12.410 ( 1.363 0.000 0.357) 1.409 12.617 ( 4.723 0.000 6.254) 7.837 12.783 ( 2.813 0.000 -10.868) 11.226 12.968 ( 8.349 0.000 2.355) 8.675 13.114 ( -5.405 0.000 5.192) 7.495 13.277 ( -4.574 0.000 3.521) 5.772 13.325 ( 11.034 0.000 -3.811) 11.673 14.313 ( -2.856 0.000 -3.221) 4.305 14.375 ( -0.170 0.000 -1.261) 1.272 14.375 ( -1.993 0.000 -0.202) 2.004 14.630 ( 2.627 0.000 -8.340) 8.745 14.798 ( -4.542 0.000 9.978) 10.963 14.813 ( -0.432 0.000 -3.305) 3.333 14.989 ( -4.723 0.000 8.017) 9.305 15.016 ( -11.791 0.000 13.336) 17.801 15.520 ( -5.021 0.000 7.017) 8.629 15.530 ( -6.056 0.000 -3.947) 7.229 15.722 ( -17.553 0.000 -17.403) 24.718 15.865 ( -9.309 0.000 -2.040) 9.530 17.993 ( -1.082 0.000 10.090) 10.147 18.072 ( -4.070 0.000 -10.785) 11.527 18.448 ( 5.118 0.000 4.167) 6.599 18.492 ( 5.952 0.000 -3.819) 7.072 18.711 ( -0.018 0.000 3.979) 3.979 18.820 ( 1.200 0.000 -2.446) 2.725 19.377 ( -3.677 0.000 -5.944) 6.989 19.410 ( 6.498 0.000 -3.634) 7.445 19.449 ( 5.753 0.000 3.349) 6.657 19.558 ( -4.410 0.000 4.517) 6.313 19.773 ( 7.042 0.000 -1.931) 7.302 20.040 ( 3.332 0.000 0.519) 3.373 20.363 ( 9.853 0.000 -0.127) 9.854 20.509 ( 11.447 0.000 -0.890) 11.481 20.546 ( 12.123 0.000 1.287) 12.191 20.686 ( 13.605 0.000 5.030) 14.505 20.805 ( 21.314 0.000 -3.418) 21.586 21.075 ( 20.881 0.000 0.720) 20.893 21.106 ( 27.684 0.000 -0.467) 27.687 22.350 ( 21.950 0.000 -33.352) 39.927 24.409 ( -1.659 0.000 1.586) 2.295 24.473 ( -2.361 0.000 -2.046) 3.124 24.546 ( -3.053 0.000 -0.119) 3.055 24.567 ( -1.028 0.000 0.568) 1.174 28.538 ( 1.692 0.000 -0.436) 1.747 28.573 ( 2.573 0.000 0.838) 2.706 29.174 ( -1.622 0.000 7.275) 7.454 29.290 ( -2.714 0.000 -4.098) 4.915 29.357 ( -3.011 0.000 2.565) 3.956 29.503 ( -1.406 0.000 -1.094) 1.781 29.602 ( -1.436 0.000 0.676) 1.587 29.604 ( -1.763 0.000 -0.677) 1.888 33.044 ( 5.783 0.000 0.534) 5.808 33.078 ( 5.254 0.000 -1.080) 5.364 33.272 ( 8.086 0.000 0.118) 8.086 33.363 ( 8.536 0.000 -4.922) 9.853 35.799 ( -3.320 0.000 1.856) 3.804 35.972 ( -4.108 0.000 -2.560) 4.840 37.136 ( -24.091 0.000 25.575) 35.135 37.898 ( -4.439 0.000 1.253) 4.612 38.045 ( -22.797 0.000 -9.730) 24.787 38.193 ( -4.135 0.000 4.086) 5.813 38.761 ( 2.213 0.000 -1.996) 2.980 39.291 ( -7.526 0.000 -1.521) 7.678 39.333 ( -0.880 0.000 3.253) 3.370 39.438 ( -4.210 0.000 2.367) 4.830 39.877 ( -4.450 0.000 3.000) 5.367 39.953 ( -3.848 0.000 0.483) 3.878 40.562 ( -9.700 0.000 7.660) 12.360 41.521 ( -7.921 0.000 -23.297) 24.607 42.323 ( -24.581 0.000 21.324) 32.542 42.857 ( -23.152 0.000 -6.328) 24.001 43.947 ( -23.674 0.000 25.992) 35.157 44.450 ( -17.816 0.000 -7.728) 19.420 44.967 ( -20.606 0.000 -0.942) 20.628 45.005 ( -14.069 0.000 -1.147) 14.116 70.039 ( -7.689 0.000 7.768) 10.930 70.335 ( -11.791 0.000 -11.321) 16.346 71.465 ( -25.666 0.000 2.311) 25.770 72.190 ( -34.288 0.000 15.470) 37.616 105.238 ( -2.004 0.000 3.456) 3.995 105.270 ( -3.701 0.000 -3.494) 5.089 105.425 ( -7.256 0.000 -4.053) 8.311 105.462 ( -7.412 0.000 5.454) 9.202 ======================= Grid point 88 (31/102) ======================= q-point: ( 0.19 0.00 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 Number of triplets: 96 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.629 ( 33.360 0.000 26.044) 42.322 2.857 ( 22.597 0.000 48.166) 53.204 3.737 ( 29.160 0.000 -20.022) 35.372 3.784 ( 25.347 0.000 -30.114) 39.361 4.091 ( 37.830 0.000 12.242) 39.762 4.220 ( 28.431 0.000 0.211) 28.432 4.498 ( 23.803 0.000 4.271) 24.183 4.610 ( 15.274 0.000 2.073) 15.414 4.828 ( 22.788 0.000 10.116) 24.932 4.952 ( 20.634 0.000 -10.476) 23.141 5.137 ( 13.457 0.000 4.530) 14.199 5.225 ( 17.657 0.000 -1.181) 17.697 5.407 ( 18.673 0.000 11.532) 21.947 5.676 ( 29.024 0.000 -0.097) 29.024 5.716 ( 23.278 0.000 -3.434) 23.530 5.880 ( 15.136 0.000 -5.397) 16.069 5.941 ( 16.627 0.000 -31.190) 35.345 6.108 ( 6.183 0.000 -15.273) 16.478 6.227 ( 10.902 0.000 -18.787) 21.721 6.346 ( 3.921 0.000 -5.139) 6.464 6.367 ( 9.862 0.000 -4.552) 10.862 6.609 ( 8.574 0.000 7.104) 11.135 6.737 ( 23.629 0.000 9.850) 25.600 6.779 ( 2.159 0.000 2.934) 3.643 6.958 ( 3.856 0.000 4.851) 6.197 7.035 ( 28.410 0.000 0.173) 28.410 7.126 ( 22.513 0.000 -2.084) 22.609 7.329 ( 5.059 0.000 -0.769) 5.117 7.625 ( 12.656 0.000 -1.141) 12.707 7.641 ( 9.687 0.000 0.040) 9.687 7.709 ( 7.041 0.000 4.889) 8.572 7.830 ( 20.145 0.000 1.284) 20.186 7.933 ( 8.306 0.000 4.174) 9.296 8.102 ( 1.215 0.000 3.159) 3.385 8.158 ( 14.059 0.000 1.946) 14.193 8.183 ( 23.087 0.000 -1.139) 23.115 8.278 ( 26.233 0.000 2.155) 26.322 8.368 ( 8.856 0.000 0.560) 8.873 8.538 ( 11.010 0.000 1.937) 11.179 8.608 ( 17.400 0.000 -3.994) 17.852 8.647 ( 4.283 0.000 -6.312) 7.628 8.791 ( 13.247 0.000 9.147) 16.098 8.903 ( 3.163 0.000 -4.568) 5.557 8.948 ( 10.798 0.000 1.335) 10.880 9.085 ( 7.236 0.000 -1.893) 7.480 9.296 ( 4.969 0.000 -3.287) 5.958 9.472 ( 2.842 0.000 4.597) 5.404 9.593 ( 4.845 0.000 15.428) 16.171 9.758 ( -4.364 0.000 3.346) 5.499 10.001 ( -11.135 0.000 -11.818) 16.237 10.158 ( 3.985 0.000 11.525) 12.194 10.440 ( 2.325 0.000 -4.933) 5.454 10.520 ( 11.461 0.000 5.255) 12.608 10.677 ( -7.851 0.000 -8.961) 11.914 10.864 ( 6.049 0.000 7.838) 9.901 11.026 ( 5.198 0.000 -4.513) 6.884 11.205 ( -6.747 0.000 -8.650) 10.970 11.641 ( -3.856 0.000 3.122) 4.962 12.089 ( -2.650 0.000 9.313) 9.682 12.211 ( -3.515 0.000 -1.238) 3.726 12.347 ( 0.639 0.000 -0.425) 0.768 12.362 ( -4.741 0.000 1.090) 4.864 12.623 ( -4.657 0.000 2.168) 5.137 12.843 ( 0.424 0.000 -5.448) 5.464 13.019 ( -0.010 0.000 -0.081) 0.082 13.076 ( 1.352 0.000 0.256) 1.376 13.346 ( 10.241 0.000 5.831) 11.784 13.587 ( 13.297 0.000 -2.285) 13.492 14.253 ( -2.492 0.000 -2.987) 3.890 14.330 ( -2.432 0.000 0.749) 2.545 14.383 ( 1.267 0.000 -0.744) 1.469 14.644 ( -0.073 0.000 -8.264) 8.264 14.736 ( -3.411 0.000 6.740) 7.554 14.793 ( -1.086 0.000 -2.932) 3.127 14.847 ( -6.752 0.000 11.365) 13.220 14.929 ( -3.048 0.000 7.152) 7.775 15.311 ( -12.011 0.000 -11.156) 16.392 15.414 ( -6.880 0.000 7.525) 10.196 15.486 ( -4.848 0.000 -8.864) 10.103 15.679 ( -8.679 0.000 -3.378) 9.313 17.947 ( -4.395 0.000 7.397) 8.604 17.951 ( -5.351 0.000 -7.823) 9.478 18.543 ( 3.049 0.000 3.528) 4.663 18.587 ( 3.908 0.000 -2.573) 4.679 18.712 ( -0.758 0.000 4.338) 4.404 18.827 ( 0.157 0.000 -2.277) 2.283 19.290 ( -3.626 0.000 -5.395) 6.500 19.417 ( -5.465 0.000 3.139) 6.303 19.571 ( 9.917 0.000 -3.211) 10.424 19.661 ( 9.405 0.000 3.127) 9.911 19.915 ( 7.469 0.000 -0.853) 7.518 20.121 ( 4.235 0.000 0.757) 4.302 20.605 ( 14.120 0.000 -0.197) 14.121 20.770 ( 14.421 0.000 -1.110) 14.463 20.831 ( 15.607 0.000 0.754) 15.625 20.983 ( 14.785 0.000 4.183) 15.365 21.252 ( 23.245 0.000 -3.391) 23.491 21.494 ( 20.203 0.000 0.963) 20.226 21.676 ( 27.325 0.000 4.058) 27.624 22.596 ( 9.990 0.000 -17.330) 20.003 24.390 ( -0.367 0.000 0.962) 1.029 24.413 ( -3.055 0.000 -0.950) 3.199 24.499 ( -1.512 0.000 0.368) 1.556 24.548 ( -0.631 0.000 -1.403) 1.538 28.582 ( 2.727 0.000 -0.323) 2.746 28.633 ( 3.275 0.000 0.822) 3.376 29.156 ( -1.726 0.000 6.635) 6.856 29.221 ( -3.291 0.000 -3.578) 4.861 29.303 ( -2.808 0.000 1.882) 3.380 29.473 ( -1.291 0.000 -1.702) 2.136 29.560 ( -2.450 0.000 -0.446) 2.490 29.567 ( -2.073 0.000 0.297) 2.094 33.178 ( 7.277 0.000 0.457) 7.291 33.197 ( 6.691 0.000 -0.788) 6.737 33.444 ( 8.674 0.000 0.347) 8.681 33.510 ( 7.091 0.000 -2.294) 7.453 35.739 ( -2.780 0.000 0.276) 2.794 35.887 ( -3.777 0.000 -1.449) 4.046 36.792 ( -15.937 0.000 16.141) 22.683 37.551 ( -23.827 0.000 -8.899) 25.435 37.818 ( -3.785 0.000 1.484) 4.066 38.087 ( -6.911 0.000 1.428) 7.057 38.773 ( -0.229 0.000 -1.864) 1.878 39.154 ( -5.956 0.000 1.281) 6.093 39.269 ( -5.225 0.000 0.131) 5.226 39.325 ( -7.164 0.000 0.895) 7.220 39.775 ( -6.508 0.000 4.150) 7.719 39.838 ( -7.475 0.000 -0.961) 7.537 40.377 ( -9.703 0.000 4.440) 10.671 41.282 ( -10.943 0.000 -19.589) 22.438 41.828 ( -28.001 0.000 18.572) 33.601 42.329 ( -27.542 0.000 -4.283) 27.873 43.620 ( -14.962 0.000 17.188) 22.788 44.036 ( -19.222 0.000 -16.320) 25.216 44.597 ( -17.405 0.000 6.472) 18.569 44.699 ( -15.694 0.000 -3.105) 15.999 69.871 ( -10.406 0.000 6.990) 12.536 70.049 ( -14.145 0.000 -9.059) 16.797 70.945 ( -26.094 0.000 -1.850) 26.160 71.464 ( -38.661 0.000 8.934) 39.679 105.185 ( -4.013 0.000 -3.144) 5.098 105.193 ( -3.077 0.000 3.054) 4.335 105.277 ( -6.606 0.000 -3.086) 7.292 105.334 ( -6.411 0.000 3.463) 7.287 ======================= Grid point 89 (32/102) ======================= q-point: ( 0.25 0.00 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 Number of triplets: 96 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.361 ( 34.362 0.000 18.380) 38.969 3.417 ( 24.090 0.000 39.245) 46.049 4.181 ( 20.535 0.000 -20.191) 28.799 4.263 ( 28.427 0.000 -27.372) 39.462 4.709 ( 20.225 0.000 0.524) 20.231 4.728 ( 24.858 0.000 2.321) 24.967 4.897 ( 12.297 0.000 5.924) 13.650 4.927 ( 17.238 0.000 9.301) 19.587 5.163 ( 11.790 0.000 0.069) 11.790 5.263 ( 13.431 0.000 -7.638) 15.451 5.511 ( 19.012 0.000 -0.578) 19.020 5.557 ( 14.862 0.000 6.972) 16.416 5.812 ( 15.853 0.000 -5.001) 16.623 6.022 ( 6.675 0.000 5.002) 8.341 6.050 ( 13.446 0.000 -5.146) 14.398 6.171 ( 12.432 0.000 1.726) 12.551 6.240 ( 12.775 0.000 -22.134) 25.556 6.295 ( 15.812 0.000 -7.332) 17.429 6.406 ( 9.301 0.000 -13.426) 16.333 6.574 ( 12.894 0.000 -1.124) 12.943 6.634 ( 21.177 0.000 -6.846) 22.256 6.806 ( 12.173 0.000 4.043) 12.826 6.836 ( 3.235 0.000 0.472) 3.269 6.933 ( 6.898 0.000 4.003) 7.975 7.114 ( 8.716 0.000 17.189) 19.272 7.360 ( 3.538 0.000 -4.166) 5.466 7.546 ( 17.034 0.000 1.243) 17.079 7.565 ( 4.069 0.000 -9.306) 10.156 7.873 ( 9.713 0.000 6.377) 11.619 7.900 ( 26.241 0.000 -3.222) 26.438 7.979 ( 1.209 0.000 6.432) 6.545 8.096 ( 26.798 0.000 -2.702) 26.934 8.174 ( 9.790 0.000 -4.439) 10.749 8.176 ( 7.502 0.000 6.398) 9.860 8.393 ( 7.957 0.000 8.313) 11.508 8.613 ( 9.365 0.000 2.871) 9.795 8.645 ( 15.753 0.000 -3.525) 16.143 8.691 ( 15.151 0.000 2.858) 15.418 8.716 ( 10.158 0.000 -6.013) 11.804 8.759 ( 6.522 0.000 7.884) 10.232 8.920 ( 20.838 0.000 -4.519) 21.322 9.036 ( 11.242 0.000 -3.673) 11.827 9.179 ( 21.369 0.000 -4.165) 21.771 9.195 ( 10.070 0.000 -2.384) 10.348 9.344 ( 17.798 0.000 4.212) 18.289 9.386 ( 4.431 0.000 3.435) 5.607 9.583 ( 0.808 0.000 -1.704) 1.886 9.677 ( 4.420 0.000 7.100) 8.363 9.738 ( -11.348 0.000 -1.825) 11.494 9.759 ( 10.216 0.000 12.483) 16.131 10.158 ( -3.406 0.000 9.817) 10.391 10.468 ( -4.477 0.000 -9.601) 10.593 10.629 ( 13.468 0.000 -0.770) 13.490 10.731 ( 5.747 0.000 -10.028) 11.558 11.004 ( 6.436 0.000 4.926) 8.105 11.117 ( 0.545 0.000 -8.858) 8.874 11.233 ( 13.301 0.000 6.448) 14.781 11.587 ( -1.527 0.000 -0.671) 1.668 12.048 ( -3.192 0.000 7.799) 8.427 12.131 ( -3.068 0.000 -4.662) 5.581 12.276 ( -3.496 0.000 0.674) 3.560 12.358 ( 1.207 0.000 0.239) 1.230 12.488 ( -7.179 0.000 -0.785) 7.222 12.739 ( -6.339 0.000 -0.031) 6.339 13.101 ( 0.413 0.000 5.568) 5.583 13.127 ( 7.506 0.000 -6.681) 10.048 13.567 ( 9.322 0.000 1.111) 9.388 13.799 ( 7.316 0.000 0.691) 7.349 14.202 ( -1.904 0.000 -2.949) 3.510 14.284 ( -2.459 0.000 1.626) 2.948 14.422 ( 2.549 0.000 0.009) 2.549 14.594 ( -2.716 0.000 -3.570) 4.486 14.692 ( -1.830 0.000 2.608) 3.186 14.752 ( -2.945 0.000 2.981) 4.190 14.794 ( -0.893 0.000 0.074) 0.896 14.895 ( -1.996 0.000 8.682) 8.908 15.099 ( -6.386 0.000 -11.206) 12.898 15.284 ( -7.571 0.000 7.885) 10.931 15.404 ( -2.237 0.000 -5.390) 5.836 15.510 ( -7.126 0.000 -4.501) 8.428 17.842 ( -3.955 0.000 -5.478) 6.757 17.872 ( -4.120 0.000 5.370) 6.769 18.580 ( 0.071 0.000 3.599) 3.599 18.632 ( 1.189 0.000 -2.648) 2.902 18.703 ( -0.779 0.000 2.902) 3.004 18.825 ( 0.215 0.000 -1.714) 1.727 19.208 ( -3.653 0.000 -4.603) 5.876 19.315 ( -5.307 0.000 3.138) 6.165 19.776 ( 10.650 0.000 -2.428) 10.923 19.860 ( 9.357 0.000 1.929) 9.554 20.063 ( 7.169 0.000 -0.219) 7.172 20.202 ( 3.530 0.000 0.762) 3.611 20.911 ( 15.966 0.000 0.101) 15.967 21.069 ( 15.344 0.000 -0.839) 15.367 21.155 ( 16.206 0.000 0.290) 16.209 21.284 ( 14.253 0.000 2.947) 14.555 21.696 ( 21.226 0.000 -3.112) 21.453 21.871 ( 16.934 0.000 1.392) 16.991 22.184 ( 22.329 0.000 3.033) 22.534 22.722 ( 5.760 0.000 -7.686) 9.605 24.356 ( -2.449 0.000 0.645) 2.533 24.399 ( 1.076 0.000 0.218) 1.098 24.485 ( -0.154 0.000 0.989) 1.001 24.540 ( 0.313 0.000 -3.132) 3.147 28.645 ( 3.567 0.000 -0.077) 3.568 28.706 ( 3.731 0.000 0.566) 3.774 29.127 ( -2.524 0.000 4.656) 5.296 29.147 ( -3.372 0.000 -2.934) 4.470 29.258 ( -2.052 0.000 2.653) 3.354 29.445 ( -1.061 0.000 -2.342) 2.571 29.505 ( -2.890 0.000 -0.257) 2.902 29.523 ( -2.281 0.000 0.117) 2.284 33.328 ( 7.411 0.000 0.277) 7.416 33.334 ( 6.906 0.000 -0.455) 6.921 33.612 ( 7.934 0.000 0.151) 7.936 33.640 ( 6.233 0.000 -0.766) 6.280 35.693 ( -1.702 0.000 -0.473) 1.767 35.822 ( -2.362 0.000 -0.545) 2.424 36.539 ( -12.427 0.000 10.737) 16.422 37.078 ( -21.153 0.000 -7.934) 22.592 37.755 ( -2.936 0.000 2.376) 3.777 37.932 ( -8.262 0.000 -0.797) 8.300 38.756 ( -0.835 0.000 -1.377) 1.610 39.060 ( -3.984 0.000 3.577) 5.354 39.144 ( -7.297 0.000 1.808) 7.518 39.170 ( -7.215 0.000 -4.831) 8.683 39.638 ( -7.940 0.000 5.222) 9.503 39.660 ( -9.670 0.000 -2.238) 9.925 40.205 ( -7.848 0.000 1.709) 8.032 41.018 ( -11.398 0.000 -15.607) 19.326 41.311 ( -26.468 0.000 14.815) 30.332 41.767 ( -27.347 0.000 -2.127) 27.429 43.388 ( -11.635 0.000 12.008) 16.721 43.650 ( -15.693 0.000 -14.688) 21.495 44.285 ( -15.265 0.000 7.334) 16.935 44.381 ( -14.925 0.000 -3.846) 15.413 69.662 ( -11.492 0.000 5.805) 12.875 69.748 ( -13.924 0.000 -6.839) 15.513 70.433 ( -24.060 0.000 -2.106) 24.152 70.740 ( -34.213 0.000 4.707) 34.535 105.098 ( -3.999 0.000 -2.546) 4.741 105.131 ( -3.604 0.000 2.366) 4.312 105.151 ( -5.449 0.000 -1.663) 5.697 105.220 ( -5.473 0.000 1.852) 5.778 ======================= Grid point 90 (33/102) ======================= q-point: ( 0.31 0.00 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 Number of triplets: 96 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.981 ( 24.729 0.000 29.572) 38.549 4.049 ( 30.127 0.000 10.302) 31.839 4.515 ( 17.916 0.000 -17.941) 25.355 4.772 ( 25.733 0.000 -19.240) 32.130 5.011 ( 8.888 0.000 2.840) 9.330 5.128 ( 15.615 0.000 -1.950) 15.737 5.150 ( 12.598 0.000 6.906) 14.367 5.252 ( 14.339 0.000 4.763) 15.109 5.392 ( 11.731 0.000 0.431) 11.739 5.484 ( 10.101 0.000 -3.558) 10.709 5.807 ( 12.432 0.000 -10.314) 16.153 5.854 ( 12.157 0.000 10.592) 16.124 5.985 ( 7.691 0.000 -22.699) 23.967 6.123 ( 3.066 0.000 4.285) 5.269 6.250 ( 4.629 0.000 2.100) 5.083 6.321 ( 2.867 0.000 -5.343) 6.063 6.330 ( 8.821 0.000 -4.532) 9.917 6.587 ( -2.386 0.000 3.699) 4.402 6.628 ( 14.614 0.000 -9.167) 17.251 6.667 ( 8.790 0.000 8.056) 11.923 6.873 ( 1.179 0.000 -7.388) 7.482 7.032 ( 12.715 0.000 3.026) 13.071 7.085 ( 16.750 0.000 -0.060) 16.750 7.262 ( 6.321 0.000 14.403) 15.729 7.338 ( 17.635 0.000 -11.448) 21.025 7.423 ( 4.610 0.000 -2.164) 5.093 7.533 ( 4.361 0.000 -2.626) 5.091 7.752 ( 6.029 0.000 3.301) 6.874 7.894 ( -6.992 0.000 13.150) 14.894 8.196 ( -2.102 0.000 -10.958) 11.158 8.207 ( 17.860 0.000 -1.496) 17.923 8.348 ( 12.253 0.000 -1.793) 12.383 8.407 ( 11.095 0.000 4.928) 12.140 8.477 ( -0.724 0.000 7.108) 7.145 8.567 ( 13.055 0.000 -6.814) 14.726 8.730 ( 4.368 0.000 3.105) 5.359 8.832 ( 0.887 0.000 -8.406) 8.453 8.873 ( 12.358 0.000 1.053) 12.403 8.878 ( 3.422 0.000 2.646) 4.325 9.007 ( 9.928 0.000 17.279) 19.928 9.208 ( 2.194 0.000 -2.100) 3.037 9.221 ( 3.039 0.000 3.409) 4.567 9.342 ( 14.733 0.000 -12.093) 19.060 9.464 ( 7.454 0.000 -1.428) 7.589 9.534 ( 10.856 0.000 -2.075) 11.053 9.621 ( 4.224 0.000 4.999) 6.545 9.715 ( 21.169 0.000 3.285) 21.422 9.793 ( 20.508 0.000 5.641) 21.269 9.963 ( 14.913 0.000 3.119) 15.236 10.048 ( 14.108 0.000 8.172) 16.304 10.143 ( 1.995 0.000 9.070) 9.287 10.452 ( 4.945 0.000 -8.323) 9.681 10.815 ( 6.135 0.000 -13.741) 15.048 10.843 ( 6.544 0.000 -2.708) 7.082 11.130 ( 5.542 0.000 -1.075) 5.645 11.247 ( 14.045 0.000 -0.098) 14.045 11.486 ( 9.003 0.000 -5.301) 10.448 11.595 ( 3.028 0.000 8.098) 8.646 11.997 ( -2.983 0.000 5.429) 6.195 12.106 ( 2.278 0.000 -5.957) 6.378 12.244 ( 1.040 0.000 0.323) 1.089 12.393 ( 0.471 0.000 3.560) 3.591 12.430 ( 5.190 0.000 -2.953) 5.971 12.647 ( -2.390 0.000 -1.573) 2.861 13.095 ( -2.478 0.000 6.548) 7.001 13.230 ( 3.684 0.000 -6.885) 7.808 13.698 ( 3.483 0.000 -0.730) 3.559 13.865 ( -1.245 0.000 3.219) 3.452 14.165 ( -1.197 0.000 -2.859) 3.099 14.233 ( -3.243 0.000 2.471) 4.077 14.479 ( 2.936 0.000 0.925) 3.078 14.549 ( -1.010 0.000 -2.575) 2.766 14.677 ( -0.147 0.000 0.300) 0.334 14.692 ( -3.313 0.000 2.907) 4.407 14.785 ( 0.417 0.000 -3.087) 3.115 14.882 ( -1.225 0.000 8.749) 8.835 15.006 ( -1.445 0.000 -7.763) 7.897 15.153 ( -6.938 0.000 7.772) 10.418 15.362 ( -1.440 0.000 -3.344) 3.641 15.379 ( -4.881 0.000 -5.581) 7.415 17.773 ( -1.864 0.000 -3.987) 4.401 17.810 ( -3.063 0.000 4.053) 5.080 18.571 ( -1.535 0.000 3.650) 3.960 18.631 ( -0.473 0.000 -2.704) 2.745 18.697 ( -0.145 0.000 0.912) 0.923 18.834 ( 1.014 0.000 -0.802) 1.292 19.122 ( -4.026 0.000 -4.162) 5.791 19.218 ( -4.995 0.000 3.379) 6.031 19.969 ( 8.747 0.000 -1.703) 8.912 20.031 ( 7.202 0.000 1.177) 7.297 20.193 ( 5.732 0.000 -0.165) 5.734 20.263 ( 2.394 0.000 0.924) 2.566 21.227 ( 15.115 0.000 0.511) 15.124 21.368 ( 14.321 0.000 -0.158) 14.322 21.465 ( 14.406 0.000 -0.156) 14.407 21.557 ( 12.324 0.000 1.776) 12.451 22.073 ( 16.773 0.000 -2.809) 17.007 22.169 ( 12.358 0.000 1.699) 12.475 22.577 ( 16.638 0.000 -0.217) 16.640 22.805 ( 3.586 0.000 -1.847) 4.034 24.320 ( -1.400 0.000 2.120) 2.540 24.432 ( 2.151 0.000 -0.696) 2.261 24.494 ( 0.720 0.000 1.718) 1.863 24.549 ( 1.320 0.000 -4.070) 4.278 28.722 ( 3.961 0.000 0.205) 3.966 28.783 ( 3.919 0.000 0.190) 3.924 29.075 ( -3.262 0.000 2.740) 4.260 29.077 ( -2.976 0.000 -2.352) 3.793 29.235 ( -1.001 0.000 3.533) 3.672 29.419 ( -1.070 0.000 -2.848) 3.042 29.446 ( -2.976 0.000 -0.069) 2.977 29.479 ( -2.026 0.000 0.093) 2.028 33.464 ( 5.894 0.000 -0.144) 5.896 33.468 ( 6.292 0.000 0.049) 6.292 33.754 ( 5.197 0.000 -0.011) 5.197 33.758 ( 6.512 0.000 -0.160) 6.514 35.673 ( -0.113 0.000 -0.564) 0.575 35.794 ( -0.364 0.000 -0.073) 0.371 36.334 ( -10.049 0.000 7.574) 12.583 36.681 ( -16.854 0.000 -6.368) 18.016 37.709 ( -2.204 0.000 2.401) 3.259 37.768 ( -7.512 0.000 -1.718) 7.706 38.740 ( -0.454 0.000 -0.929) 1.034 38.993 ( -7.393 0.000 0.888) 7.446 39.008 ( -2.118 0.000 4.571) 5.038 39.032 ( -5.706 0.000 -5.293) 7.783 39.454 ( -9.954 0.000 -3.147) 10.440 39.490 ( -7.567 0.000 5.159) 9.158 40.074 ( -5.274 0.000 -0.528) 5.300 40.769 ( -10.944 0.000 -10.908) 15.452 40.850 ( -21.457 0.000 10.308) 23.805 41.246 ( -24.055 0.000 -0.056) 24.055 43.199 ( -9.467 0.000 8.518) 12.735 43.350 ( -11.671 0.000 -10.622) 15.781 44.020 ( -12.500 0.000 6.009) 13.870 44.098 ( -12.208 0.000 -3.795) 12.784 69.446 ( -10.843 0.000 4.489) 11.736 69.477 ( -11.561 0.000 -4.998) 12.595 69.992 ( -19.205 0.000 -1.806) 19.290 70.137 ( -26.417 0.000 2.756) 26.560 105.017 ( -3.542 0.000 -1.611) 3.891 105.053 ( -4.107 0.000 -0.740) 4.174 105.063 ( -3.455 0.000 1.444) 3.745 105.124 ( -4.419 0.000 0.886) 4.506 ======================= Grid point 91 (34/102) ======================= q-point: ( 0.38 0.00 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 Number of triplets: 96 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 4.522 ( 23.669 0.000 20.537) 31.336 4.547 ( 18.063 0.000 -2.493) 18.234 4.859 ( 18.740 0.000 -7.712) 20.265 5.123 ( 2.813 0.000 4.121) 4.990 5.135 ( 12.273 0.000 -6.809) 14.036 5.340 ( 5.496 0.000 -3.107) 6.313 5.396 ( 9.702 0.000 5.785) 11.296 5.545 ( 14.142 0.000 -11.238) 18.064 5.654 ( 14.321 0.000 4.711) 15.075 5.678 ( 11.207 0.000 2.108) 11.404 5.996 ( 9.169 0.000 -9.994) 13.563 6.042 ( 5.828 0.000 -0.464) 5.846 6.096 ( 6.499 0.000 -14.634) 16.012 6.156 ( -0.065 0.000 0.505) 0.509 6.290 ( 0.681 0.000 5.946) 5.985 6.381 ( 3.473 0.000 -2.630) 4.356 6.555 ( 11.922 0.000 -11.252) 16.394 6.576 ( 3.444 0.000 9.065) 9.697 6.767 ( -0.070 0.000 8.845) 8.845 6.780 ( 1.919 0.000 -8.483) 8.697 6.883 ( 3.137 0.000 -6.968) 7.641 7.155 ( 1.979 0.000 10.493) 10.678 7.276 ( 2.731 0.000 1.670) 3.201 7.405 ( 4.113 0.000 4.815) 6.333 7.496 ( 0.768 0.000 1.591) 1.766 7.520 ( 11.514 0.000 -4.537) 12.376 7.755 ( -6.582 0.000 9.425) 11.496 7.790 ( 9.073 0.000 -5.850) 10.795 7.966 ( 12.475 0.000 5.252) 13.535 8.148 ( 1.263 0.000 -12.262) 12.327 8.356 ( -9.183 0.000 3.141) 9.705 8.376 ( -1.551 0.000 -7.454) 7.614 8.434 ( -2.762 0.000 -0.964) 2.925 8.529 ( -4.188 0.000 0.611) 4.232 8.661 ( -6.325 0.000 -1.931) 6.613 8.745 ( -3.243 0.000 6.435) 7.206 8.777 ( 8.272 0.000 5.512) 9.940 8.893 ( -1.651 0.000 -1.927) 2.537 8.997 ( 2.249 0.000 -3.148) 3.868 9.119 ( -1.039 0.000 12.046) 12.091 9.292 ( 8.080 0.000 7.315) 10.900 9.476 ( 20.059 0.000 -2.573) 20.223 9.649 ( 17.090 0.000 -7.693) 18.741 9.663 ( 11.316 0.000 -0.920) 11.354 9.763 ( 6.236 0.000 6.914) 9.311 9.808 ( 11.903 0.000 3.945) 12.540 9.974 ( 3.174 0.000 11.695) 12.118 10.145 ( 11.612 0.000 -0.453) 11.621 10.250 ( 13.698 0.000 -0.793) 13.721 10.279 ( 6.821 0.000 8.407) 10.826 10.378 ( 18.501 0.000 0.140) 18.501 10.614 ( 11.822 0.000 -7.474) 13.987 10.905 ( 1.350 0.000 -5.650) 5.809 10.934 ( 8.487 0.000 -13.908) 16.293 11.223 ( 3.519 0.000 -0.360) 3.538 11.539 ( 1.269 0.000 -16.344) 16.393 11.578 ( 15.939 0.000 2.337) 16.110 11.725 ( 3.413 0.000 17.409) 17.740 11.977 ( 1.015 0.000 1.542) 1.846 12.184 ( 5.974 0.000 -8.257) 10.191 12.363 ( 10.926 0.000 0.548) 10.939 12.492 ( 7.811 0.000 3.982) 8.767 12.614 ( 13.607 0.000 -0.899) 13.636 12.650 ( 3.906 0.000 -1.692) 4.257 13.035 ( -4.537 0.000 5.609) 7.215 13.239 ( -1.511 0.000 -5.747) 5.942 13.696 ( -3.591 0.000 -1.173) 3.778 13.772 ( -8.476 0.000 4.492) 9.593 14.138 ( -0.973 0.000 -2.927) 3.084 14.160 ( -4.466 0.000 2.444) 5.091 14.537 ( 0.434 0.000 -3.809) 3.834 14.539 ( 2.696 0.000 1.740) 3.209 14.648 ( -1.631 0.000 3.557) 3.913 14.671 ( -1.047 0.000 0.912) 1.389 14.810 ( 2.773 0.000 -3.224) 4.252 14.885 ( 0.005 0.000 5.985) 5.985 14.983 ( -0.001 0.000 -4.575) 4.575 15.044 ( -5.421 0.000 7.509) 9.261 15.288 ( -3.011 0.000 -6.383) 7.058 15.319 ( -2.515 0.000 -1.863) 3.130 17.748 ( -0.002 0.000 -3.022) 3.022 17.766 ( -2.090 0.000 3.081) 3.723 18.540 ( -2.093 0.000 3.426) 4.015 18.610 ( -0.915 0.000 -2.449) 2.614 18.706 ( 1.103 0.000 -0.871) 1.405 18.864 ( 2.113 0.000 0.249) 2.128 19.029 ( -4.306 0.000 -4.096) 5.943 19.128 ( -4.747 0.000 3.669) 6.000 20.111 ( 5.734 0.000 -1.106) 5.840 20.150 ( 4.520 0.000 0.749) 4.582 20.288 ( 3.742 0.000 -0.430) 3.767 20.302 ( 1.324 0.000 1.204) 1.790 21.504 ( 12.060 0.000 0.930) 12.096 21.628 ( 11.258 0.000 0.731) 11.282 21.720 ( 10.813 0.000 -0.513) 10.825 21.775 ( 8.899 0.000 0.491) 8.913 22.349 ( 11.293 0.000 -2.459) 11.558 22.372 ( 7.648 0.000 1.648) 7.824 22.851 ( 11.066 0.000 -3.139) 11.503 22.857 ( 1.640 0.000 1.608) 2.297 24.307 ( -0.573 0.000 3.313) 3.363 24.477 ( 2.455 0.000 -1.970) 3.148 24.516 ( 0.896 0.000 2.148) 2.327 24.573 ( 1.793 0.000 -3.832) 4.231 28.799 ( 3.541 0.000 0.435) 3.568 28.861 ( 3.721 0.000 -0.148) 3.724 29.017 ( -2.814 0.000 1.875) 3.381 29.020 ( -2.237 0.000 -1.911) 2.943 29.227 ( -0.613 0.000 3.414) 3.469 29.387 ( -1.548 0.000 -2.748) 3.154 29.390 ( -2.528 0.000 0.314) 2.547 29.447 ( -1.124 0.000 -0.321) 1.169 33.564 ( 4.040 0.000 0.101) 4.041 33.575 ( 4.361 0.000 -0.155) 4.364 33.845 ( 3.798 0.000 0.374) 3.816 33.869 ( 4.637 0.000 -0.420) 4.656 35.688 ( 1.775 0.000 -0.329) 1.806 35.808 ( 1.743 0.000 -0.024) 1.743 36.166 ( -8.155 0.000 5.600) 9.893 36.377 ( -12.395 0.000 -4.962) 13.352 37.636 ( -5.208 0.000 -1.281) 5.363 37.674 ( -1.806 0.000 1.515) 2.357 38.736 ( 0.283 0.000 -0.746) 0.798 38.868 ( -4.955 0.000 -0.375) 4.969 38.919 ( -4.583 0.000 -2.748) 5.344 38.993 ( -0.479 0.000 4.525) 4.550 39.260 ( -8.359 0.000 -3.580) 9.094 39.366 ( -5.696 0.000 3.639) 6.759 39.997 ( -1.991 0.000 -2.261) 3.012 40.452 ( -17.059 0.000 5.973) 18.074 40.595 ( -7.149 0.000 -6.495) 9.659 40.815 ( -18.901 0.000 1.911) 18.998 43.046 ( -7.186 0.000 5.769) 9.215 43.139 ( -7.467 0.000 -7.036) 10.260 43.814 ( -9.058 0.000 4.476) 10.104 43.884 ( -8.286 0.000 -3.219) 8.889 69.256 ( -8.709 0.000 3.232) 9.290 69.273 ( -7.733 0.000 -3.695) 8.570 69.666 ( -12.852 0.000 -1.652) 12.957 69.699 ( -17.862 0.000 2.227) 18.000 104.953 ( -2.517 0.000 -0.503) 2.567 104.983 ( -2.725 0.000 -0.333) 2.745 105.003 ( -2.634 0.000 0.467) 2.675 105.047 ( -3.315 0.000 0.358) 3.335 ======================= Grid point 92 (35/102) ======================= q-point: ( 0.44 0.00 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 Number of triplets: 96 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 4.813 ( 10.642 0.000 -5.089) 11.796 4.985 ( 17.378 0.000 11.186) 20.667 5.118 ( 3.826 0.000 -1.397) 4.073 5.200 ( 7.528 0.000 2.059) 7.805 5.258 ( 2.369 0.000 -3.816) 4.492 5.352 ( -2.260 0.000 -5.439) 5.890 5.545 ( 3.669 0.000 4.734) 5.989 5.708 ( 6.069 0.000 -4.172) 7.364 5.877 ( 3.502 0.000 -12.431) 12.915 5.949 ( 10.866 0.000 6.925) 12.886 6.115 ( -0.236 0.000 -7.735) 7.739 6.121 ( 2.223 0.000 -0.826) 2.371 6.196 ( 10.766 0.000 -1.859) 10.925 6.211 ( 9.249 0.000 2.126) 9.490 6.278 ( -2.703 0.000 0.827) 2.827 6.404 ( -1.115 0.000 -1.934) 2.233 6.683 ( -1.179 0.000 6.940) 7.039 6.711 ( 10.695 0.000 -0.854) 10.729 6.768 ( -0.220 0.000 -8.419) 8.421 6.921 ( 16.560 0.000 2.497) 16.747 6.937 ( 3.090 0.000 -0.407) 3.117 7.220 ( 2.123 0.000 4.503) 4.978 7.372 ( -6.591 0.000 4.610) 8.044 7.374 ( 5.215 0.000 4.127) 6.651 7.501 ( -0.176 0.000 3.482) 3.486 7.597 ( -4.196 0.000 -7.125) 8.269 7.723 ( 1.552 0.000 2.710) 3.123 7.862 ( 1.366 0.000 -3.911) 4.142 8.072 ( -11.924 0.000 -8.456) 14.618 8.161 ( 2.879 0.000 2.885) 4.076 8.184 ( 0.503 0.000 -4.517) 4.545 8.204 ( -17.890 0.000 0.357) 17.894 8.323 ( -0.759 0.000 -1.774) 1.929 8.386 ( -2.844 0.000 3.509) 4.517 8.584 ( -4.477 0.000 -3.804) 5.875 8.663 ( -5.933 0.000 4.166) 7.249 8.877 ( 1.479 0.000 -0.899) 1.731 8.895 ( 4.227 0.000 -2.469) 4.895 9.145 ( 8.779 0.000 9.004) 12.576 9.147 ( 1.103 0.000 9.503) 9.567 9.421 ( 2.765 0.000 10.620) 10.974 9.792 ( 8.263 0.000 -4.460) 9.390 9.822 ( 2.571 0.000 7.849) 8.260 9.882 ( 6.789 0.000 7.127) 9.843 9.955 ( 13.250 0.000 -5.112) 14.202 9.962 ( 4.537 0.000 9.123) 10.188 10.096 ( 6.351 0.000 2.521) 6.833 10.263 ( 2.501 0.000 -8.165) 8.540 10.378 ( 2.332 0.000 6.307) 6.724 10.459 ( 7.829 0.000 -4.546) 9.053 10.737 ( 15.479 0.000 -1.124) 15.519 10.815 ( 7.861 0.000 -5.486) 9.586 10.882 ( -2.243 0.000 -6.761) 7.123 11.076 ( 7.223 0.000 -11.240) 13.361 11.254 ( -0.920 0.000 1.919) 2.128 11.499 ( -1.627 0.000 -13.425) 13.523 11.779 ( -0.114 0.000 11.933) 11.934 11.832 ( 8.464 0.000 1.100) 8.535 12.029 ( 2.395 0.000 2.248) 3.285 12.273 ( 4.269 0.000 -10.194) 11.052 12.620 ( 13.585 0.000 -0.698) 13.603 12.664 ( 6.975 0.000 4.320) 8.205 12.851 ( 15.844 0.000 0.829) 15.866 12.941 ( 6.453 0.000 3.553) 7.366 12.967 ( 8.774 0.000 -0.159) 8.776 13.145 ( -6.681 0.000 -3.311) 7.456 13.548 ( -10.795 0.000 -1.269) 10.869 13.554 ( -14.143 0.000 4.968) 14.990 14.074 ( -4.226 0.000 1.734) 4.568 14.115 ( -0.556 0.000 -3.347) 3.393 14.554 ( 2.043 0.000 -3.080) 3.696 14.593 ( 2.233 0.000 2.314) 3.216 14.633 ( -2.813 0.000 1.458) 3.168 14.636 ( -0.642 0.000 3.854) 3.908 14.878 ( 4.413 0.000 -2.417) 5.031 14.896 ( -0.627 0.000 3.449) 3.505 14.973 ( -2.824 0.000 6.405) 7.000 14.980 ( 0.493 0.000 -2.765) 2.808 15.230 ( -1.319 0.000 -6.462) 6.595 15.251 ( -3.835 0.000 -1.008) 3.966 17.736 ( -1.531 0.000 2.173) 2.658 17.755 ( 1.099 0.000 -2.207) 2.466 18.507 ( -1.754 0.000 2.993) 3.470 18.590 ( -0.466 0.000 -2.007) 2.061 18.739 ( 2.538 0.000 -1.998) 3.230 18.919 ( 3.055 0.000 0.956) 3.202 18.936 ( -3.881 0.000 -3.954) 5.540 19.043 ( -4.611 0.000 3.748) 5.943 20.195 ( 2.907 0.000 -0.585) 2.965 20.216 ( 1.931 0.000 0.390) 1.970 20.322 ( 0.398 0.000 1.374) 1.431 20.343 ( 1.906 0.000 -0.618) 2.003 21.703 ( 7.321 0.000 1.509) 7.475 21.809 ( 6.271 0.000 1.568) 6.464 21.887 ( 5.741 0.000 -1.204) 5.866 21.907 ( 4.210 0.000 -0.451) 4.234 22.486 ( 3.472 0.000 1.239) 3.686 22.515 ( 5.817 0.000 -2.079) 6.177 22.876 ( -0.249 0.000 3.316) 3.325 23.011 ( 5.934 0.000 -4.737) 7.593 24.308 ( -0.250 0.000 4.125) 4.133 24.515 ( 1.788 0.000 -3.417) 3.857 24.534 ( 0.282 0.000 2.113) 2.131 24.600 ( 1.526 0.000 -2.676) 3.081 28.857 ( 1.947 0.000 0.658) 2.055 28.927 ( 2.737 0.000 -0.468) 2.777 28.976 ( -1.504 0.000 1.421) 2.069 28.980 ( -1.257 0.000 -1.456) 1.924 29.221 ( -0.602 0.000 2.679) 2.746 29.350 ( -1.374 0.000 -2.343) 2.716 29.351 ( -1.323 0.000 1.098) 1.720 29.431 ( -0.399 0.000 -0.990) 1.068 33.625 ( 1.954 0.000 0.258) 1.971 33.640 ( 2.172 0.000 -0.293) 2.191 33.905 ( 2.028 0.000 0.590) 2.112 33.939 ( 2.419 0.000 -0.601) 2.493 35.741 ( 3.430 0.000 0.040) 3.430 35.857 ( 2.829 0.000 -0.359) 2.852 36.030 ( -6.483 0.000 4.387) 7.828 36.164 ( -7.699 0.000 -3.915) 8.637 37.560 ( -2.122 0.000 -0.070) 2.123 37.642 ( -1.615 0.000 0.017) 1.615 38.747 ( 0.889 0.000 -0.620) 1.083 38.795 ( -2.395 0.000 0.178) 2.402 38.845 ( -2.067 0.000 -0.863) 2.240 38.992 ( -1.363 0.000 2.128) 2.527 39.127 ( -3.280 0.000 -1.754) 3.720 39.277 ( -3.766 0.000 1.372) 4.008 39.995 ( 2.631 0.000 -3.339) 4.251 40.176 ( -11.232 0.000 3.705) 11.827 40.485 ( -2.544 0.000 -4.566) 5.227 40.502 ( -12.854 0.000 3.770) 13.395 42.938 ( -4.517 0.000 3.588) 5.768 43.023 ( -2.905 0.000 -4.454) 5.318 43.679 ( -5.228 0.000 3.267) 6.165 43.757 ( -3.796 0.000 -2.435) 4.509 69.120 ( -5.305 0.000 2.097) 5.704 69.157 ( -3.017 0.000 -2.949) 4.219 69.430 ( -9.532 0.000 2.430) 9.837 69.473 ( -6.123 0.000 -1.554) 6.317 104.916 ( -1.203 0.000 0.315) 1.243 104.944 ( -1.140 0.000 0.039) 1.141 104.962 ( -1.387 0.000 -0.327) 1.425 104.993 ( -2.130 0.000 -0.031) 2.130 ======================= Grid point 93 (36/102) ======================= q-point: (-0.50 0.00 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 Number of triplets: 96 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 4.971 ( 5.678 0.000 -0.964) 5.759 5.022 ( -13.876 0.000 -5.618) 14.970 5.115 ( -2.190 0.000 2.964) 3.685 5.262 ( -1.915 0.000 -5.175) 5.517 5.341 ( 4.938 0.000 -0.121) 4.940 5.422 ( 9.474 0.000 6.355) 11.408 5.549 ( -4.283 0.000 2.594) 5.007 5.773 ( -2.037 0.000 -13.596) 13.747 5.833 ( 0.358 0.000 0.127) 0.380 6.008 ( -5.933 0.000 1.337) 6.081 6.092 ( 0.690 0.000 -7.423) 7.455 6.129 ( -0.328 0.000 5.235) 5.246 6.225 ( -1.198 0.000 -6.013) 6.131 6.361 ( 0.879 0.000 -1.693) 1.907 6.382 ( 2.739 0.000 6.657) 7.199 6.433 ( 5.411 0.000 2.531) 5.973 6.706 ( -4.980 0.000 -6.914) 8.521 6.734 ( 5.090 0.000 3.684) 6.284 6.931 ( 9.310 0.000 6.605) 11.415 7.039 ( 7.178 0.000 3.669) 8.061 7.155 ( -4.679 0.000 0.126) 4.681 7.202 ( -0.129 0.000 -0.276) 0.305 7.345 ( -1.182 0.000 3.510) 3.703 7.388 ( -4.977 0.000 1.188) 5.117 7.455 ( 2.112 0.000 -8.364) 8.627 7.518 ( 2.279 0.000 4.257) 4.829 7.748 ( 0.021 0.000 -5.965) 5.965 7.845 ( 1.159 0.000 1.590) 1.968 7.864 ( -12.221 0.000 -1.229) 12.283 7.897 ( -2.544 0.000 -10.163) 10.476 8.164 ( -1.697 0.000 2.975) 3.424 8.255 ( 3.189 0.000 0.320) 3.205 8.361 ( 2.583 0.000 3.065) 4.008 8.382 ( 4.289 0.000 3.794) 5.726 8.504 ( -1.130 0.000 -6.224) 6.326 8.555 ( -4.287 0.000 -0.354) 4.302 8.892 ( -1.516 0.000 0.165) 1.525 8.954 ( 1.356 0.000 -0.768) 1.558 9.165 ( -2.137 0.000 6.501) 6.843 9.300 ( 4.314 0.000 9.073) 10.046 9.466 ( -0.172 0.000 13.746) 13.747 9.813 ( -2.946 0.000 3.947) 4.925 9.859 ( 0.536 0.000 10.415) 10.428 10.031 ( 4.642 0.000 0.608) 4.682 10.044 ( 1.178 0.000 9.205) 9.280 10.097 ( 1.007 0.000 -2.195) 2.415 10.155 ( -1.892 0.000 1.606) 2.482 10.242 ( -3.056 0.000 -8.562) 9.091 10.445 ( 4.094 0.000 0.433) 4.116 10.528 ( 0.593 0.000 -12.598) 12.612 10.789 ( -5.297 0.000 -0.324) 5.307 10.883 ( 0.338 0.000 -5.840) 5.850 10.980 ( 8.269 0.000 -4.917) 9.620 11.111 ( -2.652 0.000 -10.396) 10.729 11.191 ( -5.464 0.000 3.331) 6.399 11.458 ( 0.649 0.000 -7.801) 7.828 11.786 ( -1.239 0.000 5.976) 6.103 11.908 ( -0.729 0.000 -0.453) 0.858 12.052 ( -0.702 0.000 2.936) 3.019 12.327 ( 3.505 0.000 -8.639) 9.323 12.711 ( -4.058 0.000 4.225) 5.859 12.894 ( 12.975 0.000 -1.861) 13.108 12.932 ( 1.682 0.000 0.875) 1.896 12.942 ( -10.759 0.000 -1.143) 10.820 13.216 ( 11.034 0.000 1.468) 11.131 13.230 ( -10.721 0.000 0.170) 10.722 13.240 ( -12.027 0.000 5.305) 13.145 13.371 ( 11.791 0.000 -0.222) 11.793 14.016 ( -1.496 0.000 0.975) 1.785 14.105 ( 0.319 0.000 -3.034) 3.051 14.576 ( -2.687 0.000 -0.154) 2.692 14.600 ( 2.100 0.000 0.110) 2.102 14.634 ( 0.305 0.000 2.142) 2.164 14.635 ( 1.339 0.000 2.629) 2.951 14.865 ( -2.525 0.000 3.282) 4.141 14.949 ( -1.471 0.000 3.481) 3.779 14.949 ( 1.413 0.000 1.568) 2.111 15.003 ( 3.374 0.000 -4.205) 5.391 15.177 ( -2.618 0.000 -1.091) 2.836 15.216 ( 1.171 0.000 -5.320) 5.447 17.711 ( -1.325 0.000 1.226) 1.805 17.777 ( 1.349 0.000 -1.315) 1.883 18.487 ( -0.769 0.000 2.560) 2.673 18.587 ( 0.620 0.000 -1.576) 1.694 18.798 ( 3.813 0.000 -2.453) 4.534 18.856 ( -2.958 0.000 -4.192) 5.131 18.959 ( -4.507 0.000 3.554) 5.740 18.994 ( 3.900 0.000 1.795) 4.293 20.229 ( 0.540 0.000 -0.163) 0.564 20.231 ( -0.484 0.000 0.003) 0.484 20.324 ( -0.423 0.000 1.304) 1.371 20.364 ( 0.353 0.000 -0.528) 0.636 21.795 ( 1.251 0.000 2.489) 2.786 21.879 ( 0.363 0.000 2.115) 2.146 21.920 ( -1.606 0.000 -2.494) 2.967 21.954 ( 0.086 0.000 -0.755) 0.760 22.517 ( -0.650 0.000 0.723) 0.972 22.576 ( 0.751 0.000 -1.664) 1.826 22.865 ( -1.466 0.000 3.434) 3.734 23.072 ( 1.195 0.000 -4.793) 4.939 24.312 ( -0.264 0.000 4.483) 4.491 24.529 ( 0.365 0.000 -4.178) 4.194 24.533 ( -0.831 0.000 1.721) 1.912 24.619 ( 0.802 0.000 -1.701) 1.881 28.879 ( 0.220 0.000 1.044) 1.067 28.941 ( -1.055 0.000 -1.584) 1.903 28.957 ( -0.890 0.000 0.793) 1.192 28.983 ( 1.525 0.000 -0.090) 1.528 29.217 ( -0.217 0.000 2.227) 2.238 29.331 ( 0.100 0.000 -2.260) 2.262 29.344 ( 0.262 0.000 1.756) 1.775 29.424 ( -0.062 0.000 -1.384) 1.386 33.644 ( -0.016 0.000 0.320) 0.321 33.661 ( 0.017 0.000 -0.350) 0.350 33.927 ( -0.022 0.000 0.693) 0.693 33.962 ( 0.015 0.000 -0.696) 0.696 35.813 ( 2.624 0.000 0.612) 2.695 35.877 ( -1.844 0.000 -1.670) 2.488 35.936 ( -2.723 0.000 3.704) 4.597 36.088 ( 1.965 0.000 -2.554) 3.222 37.550 ( 0.972 0.000 1.122) 1.485 37.612 ( -1.134 0.000 -1.298) 1.724 38.763 ( -0.909 0.000 0.002) 0.909 38.766 ( 1.046 0.000 -0.117) 1.053 38.846 ( 2.227 0.000 1.246) 2.551 38.930 ( -3.574 0.000 -2.349) 4.276 39.141 ( 3.461 0.000 2.421) 4.224 39.218 ( -2.202 0.000 -0.868) 2.366 40.025 ( -4.181 0.000 0.343) 4.195 40.094 ( 7.856 0.000 -3.479) 8.592 40.318 ( -6.299 0.000 5.170) 8.150 40.479 ( 2.703 0.000 -2.222) 3.499 42.883 ( -1.563 0.000 2.075) 2.598 43.005 ( 1.982 0.000 -2.862) 3.481 43.620 ( -1.285 0.000 2.470) 2.785 43.723 ( 0.854 0.000 -1.722) 1.922 69.059 ( -1.001 0.000 1.145) 1.520 69.142 ( 2.010 0.000 -2.559) 3.254 69.325 ( -1.547 0.000 2.692) 3.105 69.414 ( 0.539 0.000 -1.270) 1.380 104.907 ( 0.285 0.000 0.725) 0.779 104.939 ( 0.550 0.000 0.530) 0.764 104.946 ( -0.151 0.000 -0.844) 0.857 104.963 ( -0.687 0.000 -0.413) 0.802 ======================= Grid point 94 (37/102) ======================= q-point: (-0.44 0.00 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 Number of triplets: 96 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 4.610 ( -24.518 0.000 -2.596) 24.655 4.984 ( -7.397 0.000 6.710) 9.987 5.085 ( -0.266 0.000 1.195) 1.224 5.195 ( -3.781 0.000 -4.655) 5.997 5.366 ( -10.492 0.000 0.878) 10.528 5.403 ( -2.530 0.000 -0.588) 2.597 5.532 ( -0.572 0.000 5.565) 5.594 5.629 ( -7.021 0.000 -14.724) 16.312 5.835 ( -10.317 0.000 2.930) 10.725 5.841 ( -2.799 0.000 1.943) 3.407 6.036 ( -4.011 0.000 -9.530) 10.340 6.186 ( 4.006 0.000 5.804) 7.053 6.203 ( 0.764 0.000 -3.684) 3.762 6.360 ( -4.167 0.000 2.083) 4.659 6.385 ( -7.147 0.000 3.104) 7.792 6.395 ( -0.702 0.000 -1.337) 1.510 6.583 ( -3.308 0.000 -8.939) 9.531 6.639 ( -17.643 0.000 -8.383) 19.533 6.956 ( -11.081 0.000 3.163) 11.524 7.113 ( 0.708 0.000 -6.170) 6.210 7.153 ( 6.551 0.000 10.663) 12.514 7.222 ( 1.919 0.000 6.390) 6.672 7.279 ( 1.481 0.000 1.178) 1.892 7.358 ( 5.785 0.000 2.909) 6.475 7.563 ( -0.717 0.000 4.826) 4.879 7.606 ( -9.179 0.000 4.891) 10.401 7.612 ( 3.691 0.000 1.523) 3.993 7.805 ( 0.578 0.000 -13.124) 13.136 7.820 ( 0.487 0.000 -10.495) 10.507 8.002 ( 8.980 0.000 3.267) 9.556 8.177 ( 5.397 0.000 -0.603) 5.431 8.272 ( 0.775 0.000 -0.569) 0.961 8.451 ( -1.127 0.000 -2.575) 2.811 8.489 ( 2.010 0.000 -3.405) 3.954 8.535 ( 6.295 0.000 3.349) 7.130 8.565 ( 9.283 0.000 5.694) 10.890 8.810 ( -5.050 0.000 -2.145) 5.487 8.927 ( -4.154 0.000 1.028) 4.279 9.050 ( -10.695 0.000 6.226) 12.375 9.344 ( -1.243 0.000 1.000) 1.596 9.476 ( -2.283 0.000 11.965) 12.181 9.724 ( -7.661 0.000 10.186) 12.745 9.895 ( 0.811 0.000 6.857) 6.905 9.986 ( -12.373 0.000 -1.865) 12.512 10.010 ( -9.174 0.000 1.266) 9.261 10.069 ( -0.380 0.000 -0.276) 0.470 10.075 ( -2.448 0.000 14.919) 15.118 10.116 ( -6.467 0.000 -7.876) 10.191 10.443 ( -5.904 0.000 -14.681) 15.824 10.485 ( -2.786 0.000 4.239) 5.072 10.665 ( -7.755 0.000 3.833) 8.651 10.818 ( -5.039 0.000 -6.194) 7.985 10.950 ( -10.078 0.000 -1.315) 10.163 10.950 ( -8.706 0.000 -16.129) 18.329 11.154 ( 1.687 0.000 -3.603) 3.978 11.469 ( 0.688 0.000 -4.790) 4.839 11.748 ( -3.533 0.000 2.916) 4.581 11.842 ( -4.869 0.000 2.671) 5.554 12.013 ( -3.886 0.000 1.699) 4.241 12.351 ( -0.525 0.000 -8.382) 8.398 12.574 ( -8.727 0.000 1.630) 8.878 12.697 ( -12.020 0.000 2.531) 12.284 12.844 ( -18.989 0.000 3.172) 19.252 12.866 ( -17.329 0.000 -1.046) 17.360 12.988 ( 0.154 0.000 2.771) 2.776 13.146 ( 9.963 0.000 -3.250) 10.480 13.536 ( 13.305 0.000 1.297) 13.368 13.666 ( 12.688 0.000 1.958) 12.838 14.021 ( 1.684 0.000 0.027) 1.684 14.118 ( 1.467 0.000 -1.271) 1.941 14.533 ( -1.236 0.000 -2.386) 2.687 14.595 ( -1.904 0.000 2.202) 2.911 14.651 ( -0.361 0.000 2.031) 2.063 14.688 ( 3.653 0.000 0.526) 3.691 14.826 ( -1.712 0.000 2.401) 2.949 14.921 ( -1.645 0.000 2.164) 2.718 14.936 ( -2.500 0.000 4.019) 4.733 15.076 ( 3.789 0.000 -3.085) 4.887 15.174 ( 2.884 0.000 -2.505) 3.820 15.245 ( 2.272 0.000 -4.018) 4.616 17.689 ( -0.957 0.000 0.342) 1.016 17.802 ( 1.368 0.000 -0.383) 1.421 18.487 ( 0.265 0.000 2.201) 2.217 18.609 ( 1.776 0.000 -1.226) 2.158 18.803 ( -1.424 0.000 -3.941) 4.190 18.866 ( -0.676 0.000 0.056) 0.679 18.891 ( 1.170 0.000 0.705) 1.366 19.080 ( 4.225 0.000 1.946) 4.652 20.196 ( -2.908 0.000 -0.407) 2.937 20.217 ( -1.739 0.000 0.134) 1.744 20.310 ( -1.304 0.000 0.965) 1.622 20.355 ( -1.209 0.000 -0.132) 1.216 21.758 ( -5.575 0.000 3.738) 6.713 21.827 ( -6.967 0.000 -3.309) 7.712 21.837 ( -4.866 0.000 2.549) 5.493 21.892 ( -6.107 0.000 -1.553) 6.301 22.459 ( -5.322 0.000 0.172) 5.325 22.540 ( -4.086 0.000 -0.997) 4.206 22.835 ( -2.074 0.000 1.941) 2.841 23.039 ( -3.742 0.000 -3.377) 5.040 24.317 ( -0.138 0.000 4.393) 4.395 24.509 ( -1.744 0.000 1.112) 2.069 24.513 ( -1.093 0.000 -3.770) 3.926 24.623 ( -0.031 0.000 -1.595) 1.595 28.869 ( -1.785 0.000 1.405) 2.271 28.902 ( -2.568 0.000 -1.281) 2.870 28.946 ( 0.117 0.000 0.187) 0.221 29.015 ( 1.792 0.000 -0.141) 1.797 29.223 ( 0.206 0.000 2.654) 2.662 29.347 ( 1.913 0.000 -2.309) 2.998 29.367 ( 1.609 0.000 1.636) 2.294 29.422 ( 0.190 0.000 -1.551) 1.562 33.625 ( -1.961 0.000 0.291) 1.982 33.639 ( -2.160 0.000 -0.326) 2.185 33.907 ( -2.125 0.000 0.662) 2.225 33.937 ( -2.359 0.000 -0.674) 2.453 35.799 ( -2.790 0.000 2.018) 3.443 35.807 ( -3.546 0.000 -2.402) 4.283 35.987 ( 5.749 0.000 2.985) 6.478 36.201 ( 8.623 0.000 -2.447) 8.964 37.596 ( 0.091 0.000 -1.629) 1.631 37.599 ( 3.418 0.000 1.575) 3.763 38.760 ( 0.722 0.000 -1.143) 1.352 38.788 ( 1.122 0.000 0.916) 1.448 38.871 ( -1.563 0.000 -2.470) 2.923 38.935 ( 6.026 0.000 3.019) 6.740 39.187 ( -0.416 0.000 -2.704) 2.736 39.245 ( 6.059 0.000 2.806) 6.677 40.011 ( 3.069 0.000 -3.577) 4.713 40.203 ( 0.008 0.000 5.000) 5.001 40.360 ( 12.717 0.000 -1.958) 12.867 40.587 ( 8.308 0.000 0.122) 8.309 42.885 ( 1.399 0.000 1.326) 1.927 43.091 ( 7.067 0.000 -2.288) 7.428 43.637 ( 2.511 0.000 2.149) 3.305 43.783 ( 5.420 0.000 -1.221) 5.555 69.085 ( 3.347 0.000 0.454) 3.377 69.222 ( 6.281 0.000 -1.771) 6.526 69.382 ( 6.826 0.000 1.886) 7.082 69.492 ( 7.531 0.000 -0.545) 7.551 104.931 ( 1.982 0.000 0.913) 2.182 104.948 ( 0.526 0.000 -0.924) 1.064 104.967 ( 2.062 0.000 0.970) 2.279 104.968 ( 1.277 0.000 -0.963) 1.599 ======================= Grid point 95 (38/102) ======================= q-point: (-0.38 0.00 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 Number of triplets: 96 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 4.071 ( -28.957 0.000 4.618) 29.323 4.670 ( -26.296 0.000 9.698) 28.028 5.050 ( -4.863 0.000 3.147) 5.793 5.073 ( -7.924 0.000 -7.200) 10.707 5.082 ( -13.158 0.000 -4.005) 13.754 5.337 ( -6.916 0.000 3.697) 7.842 5.436 ( -9.949 0.000 4.923) 11.100 5.448 ( -7.910 0.000 -12.721) 14.980 5.668 ( -6.346 0.000 3.106) 7.065 5.706 ( -10.459 0.000 1.210) 10.529 5.894 ( -7.797 0.000 -11.514) 13.906 6.098 ( -18.953 0.000 -10.125) 21.488 6.206 ( -4.248 0.000 4.128) 5.923 6.216 ( -8.070 0.000 -1.254) 8.167 6.274 ( -0.224 0.000 -2.075) 2.087 6.320 ( -5.668 0.000 -1.691) 5.915 6.409 ( 3.191 0.000 6.373) 7.128 6.575 ( 1.954 0.000 -6.681) 6.961 6.703 ( -13.433 0.000 1.503) 13.517 7.047 ( -7.034 0.000 -2.681) 7.528 7.162 ( -1.854 0.000 -5.101) 5.427 7.189 ( -5.143 0.000 -0.931) 5.227 7.397 ( -8.346 0.000 -4.969) 9.713 7.470 ( 4.704 0.000 10.431) 11.443 7.475 ( -5.788 0.000 -2.272) 6.218 7.539 ( -1.770 0.000 18.945) 19.027 7.616 ( 4.609 0.000 1.191) 4.760 7.808 ( 0.550 0.000 -1.541) 1.636 7.854 ( 5.025 0.000 -8.047) 9.487 8.162 ( 5.344 0.000 1.401) 5.525 8.238 ( -5.003 0.000 -1.426) 5.202 8.277 ( -1.564 0.000 -2.510) 2.957 8.445 ( -6.811 0.000 2.326) 7.197 8.448 ( 4.538 0.000 -2.833) 5.350 8.553 ( -4.999 0.000 -5.314) 7.296 8.764 ( 0.495 0.000 6.243) 6.262 8.780 ( -7.458 0.000 5.711) 9.393 8.839 ( 2.673 0.000 2.622) 3.745 8.886 ( 4.051 0.000 -0.099) 4.052 9.267 ( -4.851 0.000 -4.214) 6.426 9.397 ( -6.600 0.000 3.500) 7.471 9.503 ( -17.098 0.000 7.177) 18.543 9.630 ( -20.036 0.000 -7.136) 21.269 9.781 ( -12.803 0.000 5.756) 14.038 9.912 ( -2.504 0.000 8.390) 8.756 9.935 ( -10.755 0.000 -7.670) 13.210 10.039 ( -7.149 0.000 16.482) 17.966 10.050 ( -3.010 0.000 7.890) 8.444 10.217 ( -13.655 0.000 -7.793) 15.722 10.279 ( -18.527 0.000 7.291) 19.910 10.485 ( -10.212 0.000 6.277) 11.987 10.688 ( -6.193 0.000 -5.618) 8.361 10.742 ( -7.990 0.000 -4.190) 9.022 10.773 ( -4.259 0.000 -20.828) 21.259 11.124 ( -4.287 0.000 -6.195) 7.534 11.443 ( -2.456 0.000 -3.792) 4.518 11.659 ( -5.501 0.000 -2.962) 6.248 11.766 ( -3.251 0.000 9.440) 9.984 11.891 ( -8.537 0.000 2.488) 8.892 12.246 ( -7.355 0.000 -7.241) 10.321 12.415 ( -6.664 0.000 0.938) 6.730 12.454 ( -14.222 0.000 4.767) 15.000 12.553 ( -10.887 0.000 -0.926) 10.927 12.574 ( -5.354 0.000 -1.917) 5.687 13.010 ( 0.497 0.000 3.611) 3.645 13.298 ( 5.605 0.000 -3.527) 6.623 13.746 ( 7.366 0.000 -0.404) 7.377 13.855 ( 5.148 0.000 3.507) 6.229 14.073 ( 3.460 0.000 -1.176) 3.655 14.157 ( 2.278 0.000 1.012) 2.492 14.519 ( 0.401 0.000 -3.654) 3.676 14.548 ( -2.966 0.000 0.935) 3.110 14.630 ( -1.832 0.000 0.755) 1.982 14.757 ( 2.843 0.000 -0.469) 2.881 14.811 ( -0.341 0.000 2.752) 2.773 14.904 ( -0.833 0.000 6.958) 7.008 14.904 ( -0.156 0.000 1.059) 1.070 15.136 ( 2.690 0.000 -2.291) 3.534 15.260 ( 5.797 0.000 -2.670) 6.382 15.278 ( 1.843 0.000 -4.050) 4.450 17.678 ( -0.086 0.000 -0.318) 0.330 17.835 ( 2.058 0.000 0.356) 2.089 18.504 ( 0.866 0.000 1.924) 2.110 18.648 ( 2.142 0.000 -0.904) 2.325 18.784 ( 0.261 0.000 -3.467) 3.477 18.801 ( -3.630 0.000 2.638) 4.488 18.978 ( 5.113 0.000 -2.054) 5.510 19.170 ( 4.327 0.000 1.811) 4.690 20.110 ( -5.634 0.000 -0.875) 5.701 20.157 ( -4.416 0.000 0.427) 4.436 20.275 ( -2.374 0.000 0.254) 2.388 20.314 ( -2.898 0.000 0.606) 2.961 21.595 ( -11.219 0.000 4.570) 12.114 21.634 ( -11.378 0.000 -4.139) 12.107 21.699 ( -9.467 0.000 3.473) 10.083 21.709 ( -11.473 0.000 -2.261) 11.693 22.304 ( -9.998 0.000 -0.885) 10.037 22.406 ( -9.269 0.000 0.085) 9.270 22.787 ( -2.926 0.000 -0.946) 3.075 22.905 ( -9.205 0.000 -0.593) 9.224 24.328 ( 0.484 0.000 3.988) 4.017 24.474 ( -1.738 0.000 0.329) 1.769 24.474 ( -1.911 0.000 -2.721) 3.326 24.612 ( -0.651 0.000 -1.946) 2.052 28.817 ( -3.400 0.000 1.424) 3.686 28.834 ( -3.843 0.000 -1.106) 3.999 28.965 ( 1.417 0.000 0.149) 1.425 29.060 ( 2.766 0.000 -0.150) 2.770 29.236 ( 0.468 0.000 3.325) 3.358 29.389 ( 2.420 0.000 -2.629) 3.574 29.411 ( 2.437 0.000 1.144) 2.692 29.428 ( 0.883 0.000 -1.241) 1.523 33.566 ( -3.970 0.000 0.188) 3.974 33.573 ( -4.406 0.000 -0.243) 4.413 33.846 ( -4.005 0.000 0.448) 4.030 33.867 ( -4.522 0.000 -0.494) 4.549 35.747 ( -1.696 0.000 -2.476) 3.002 35.756 ( -1.663 0.000 2.071) 2.657 36.136 ( 8.093 0.000 4.582) 9.300 36.406 ( 12.414 0.000 -3.896) 13.011 37.615 ( 2.116 0.000 -0.638) 2.210 37.686 ( 4.802 0.000 0.873) 4.881 38.786 ( 2.155 0.000 -2.787) 3.524 38.822 ( 2.213 0.000 2.407) 3.270 38.860 ( 0.932 0.000 -1.185) 1.508 39.093 ( 8.747 0.000 4.278) 9.737 39.192 ( 1.712 0.000 -4.426) 4.745 39.390 ( 7.740 0.000 2.377) 8.096 40.125 ( 9.252 0.000 -7.827) 12.118 40.226 ( 1.644 0.000 8.137) 8.302 40.699 ( 20.698 0.000 -3.860) 21.055 40.810 ( 13.602 0.000 2.731) 13.874 42.943 ( 4.023 0.000 1.381) 4.254 43.278 ( 12.169 0.000 -3.053) 12.546 43.727 ( 5.974 0.000 2.606) 6.517 43.933 ( 9.673 0.000 -0.944) 9.719 69.190 ( 6.956 0.000 0.137) 6.958 69.382 ( 9.923 0.000 -0.734) 9.950 69.605 ( 15.088 0.000 -0.177) 15.089 69.719 ( 15.228 0.000 0.887) 15.254 104.966 ( 1.508 0.000 -0.989) 1.803 104.991 ( 3.760 0.000 0.950) 3.879 105.006 ( 2.598 0.000 -1.254) 2.885 105.023 ( 3.275 0.000 1.281) 3.517 ======================= Grid point 96 (39/102) ======================= q-point: (-0.31 0.00 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 Number of triplets: 96 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.488 ( -30.883 0.000 13.967) 33.894 4.037 ( -37.176 0.000 11.641) 38.956 4.788 ( -15.275 0.000 -5.730) 16.315 4.819 ( -15.022 0.000 -16.761) 22.508 4.919 ( -9.673 0.000 2.004) 9.879 5.146 ( -12.555 0.000 6.529) 14.151 5.158 ( -18.956 0.000 4.631) 19.514 5.235 ( -12.624 0.000 -8.365) 15.144 5.466 ( -12.747 0.000 4.592) 13.549 5.523 ( -11.763 0.000 3.688) 12.328 5.701 ( -16.007 0.000 -6.247) 17.183 5.741 ( -2.218 0.000 -15.548) 15.706 6.020 ( -13.590 0.000 2.762) 13.868 6.069 ( -9.842 0.000 0.282) 9.846 6.216 ( -3.918 0.000 -3.519) 5.266 6.290 ( 0.058 0.000 -1.068) 1.070 6.418 ( -9.619 0.000 5.502) 11.081 6.548 ( -5.162 0.000 -5.648) 7.652 6.562 ( 2.938 0.000 4.988) 5.789 6.864 ( -10.567 0.000 -1.305) 10.648 6.946 ( -17.871 0.000 -2.957) 18.114 7.030 ( -9.249 0.000 -9.869) 13.526 7.225 ( -6.683 0.000 -9.088) 11.281 7.324 ( -5.123 0.000 -3.868) 6.419 7.357 ( -15.378 0.000 9.905) 18.291 7.626 ( -0.237 0.000 10.841) 10.843 7.657 ( -6.376 0.000 3.651) 7.347 7.728 ( -2.565 0.000 -9.655) 9.990 7.938 ( -1.484 0.000 1.996) 2.487 8.072 ( -10.872 0.000 6.654) 12.746 8.125 ( -6.697 0.000 -9.887) 11.941 8.259 ( -7.937 0.000 11.737) 14.169 8.272 ( 2.461 0.000 4.750) 5.349 8.449 ( -8.283 0.000 4.467) 9.411 8.512 ( 0.819 0.000 -10.383) 10.415 8.618 ( -8.024 0.000 -2.636) 8.446 8.652 ( -6.023 0.000 3.627) 7.031 8.849 ( -12.797 0.000 3.150) 13.179 8.897 ( -7.293 0.000 0.851) 7.342 9.137 ( -16.776 0.000 2.732) 16.997 9.197 ( -18.255 0.000 -6.633) 19.422 9.264 ( 6.541 0.000 -2.476) 6.994 9.359 ( 1.068 0.000 -4.671) 4.791 9.519 ( -14.186 0.000 4.935) 15.020 9.584 ( -23.463 0.000 -2.498) 23.596 9.647 ( -24.882 0.000 0.407) 24.886 9.862 ( -9.436 0.000 11.924) 15.205 9.874 ( -18.301 0.000 7.112) 19.634 9.967 ( -11.939 0.000 3.468) 12.432 9.981 ( -7.879 0.000 6.423) 10.165 10.384 ( -1.189 0.000 12.779) 12.834 10.577 ( -2.851 0.000 -5.877) 6.532 10.612 ( -4.778 0.000 -5.456) 7.252 10.669 ( -3.243 0.000 -13.830) 14.205 10.976 ( -8.086 0.000 -4.154) 9.091 11.355 ( -5.728 0.000 -5.011) 7.611 11.503 ( -7.546 0.000 -11.998) 14.174 11.753 ( -4.282 0.000 7.251) 8.421 11.757 ( -0.660 0.000 15.466) 15.480 12.088 ( -6.080 0.000 -7.326) 9.520 12.255 ( -5.641 0.000 1.770) 5.912 12.318 ( -2.845 0.000 -1.484) 3.209 12.477 ( 2.389 0.000 3.094) 3.909 12.531 ( 1.193 0.000 -4.030) 4.202 13.012 ( -1.152 0.000 2.214) 2.495 13.349 ( -0.041 0.000 -2.267) 2.268 13.827 ( 1.140 0.000 -2.634) 2.870 13.876 ( -3.972 0.000 4.943) 6.341 14.144 ( 3.675 0.000 -2.180) 4.274 14.208 ( 2.375 0.000 2.253) 3.273 14.490 ( -2.702 0.000 -0.485) 2.746 14.517 ( -0.716 0.000 -1.770) 1.910 14.603 ( -0.238 0.000 -0.510) 0.563 14.792 ( 1.596 0.000 -2.228) 2.741 14.824 ( 0.878 0.000 4.255) 4.344 14.927 ( 2.757 0.000 -1.308) 3.051 14.958 ( 3.950 0.000 10.451) 11.173 15.173 ( 1.799 0.000 -3.336) 3.790 15.306 ( 2.195 0.000 -5.697) 6.105 15.387 ( 7.250 0.000 -1.660) 7.438 17.687 ( 1.036 0.000 -0.642) 1.219 17.893 ( 3.732 0.000 0.670) 3.792 18.526 ( 0.738 0.000 1.722) 1.874 18.682 ( 1.208 0.000 -0.635) 1.365 18.743 ( -2.658 0.000 2.689) 3.781 18.798 ( 1.767 0.000 -2.771) 3.286 19.075 ( 4.937 0.000 -2.304) 5.448 19.261 ( 4.466 0.000 1.611) 4.747 19.965 ( -8.644 0.000 -1.414) 8.759 20.041 ( -7.258 0.000 0.847) 7.308 20.213 ( -3.735 0.000 -0.912) 3.845 20.243 ( -4.419 0.000 1.703) 4.736 21.341 ( -14.900 0.000 5.072) 15.740 21.360 ( -14.761 0.000 -4.849) 15.537 21.437 ( -14.796 0.000 -2.706) 15.041 21.480 ( -13.076 0.000 4.425) 13.804 22.055 ( -14.462 0.000 -2.548) 14.685 22.167 ( -14.741 0.000 1.431) 14.810 22.668 ( -14.727 0.000 3.468) 15.129 22.712 ( -3.845 0.000 -5.481) 6.695 24.356 ( 1.566 0.000 3.433) 3.773 24.431 ( -1.789 0.000 -1.541) 2.361 24.447 ( -0.713 0.000 -0.538) 0.893 24.592 ( -0.883 0.000 -2.317) 2.480 28.748 ( -3.605 0.000 1.519) 3.912 28.749 ( -4.248 0.000 -1.066) 4.380 28.995 ( 1.383 0.000 0.521) 1.478 29.124 ( 3.587 0.000 -0.096) 3.589 29.259 ( 1.191 0.000 3.670) 3.858 29.418 ( 1.198 0.000 -2.970) 3.202 29.463 ( 2.576 0.000 -0.750) 2.683 29.466 ( 2.752 0.000 0.684) 2.836 33.464 ( -6.376 0.000 -0.121) 6.377 33.469 ( -5.733 0.000 0.024) 5.733 33.751 ( -5.448 0.000 -0.016) 5.448 33.756 ( -6.392 0.000 -0.150) 6.393 35.732 ( 0.769 0.000 -2.586) 2.698 35.744 ( 0.019 0.000 1.865) 1.866 36.330 ( 10.022 0.000 7.713) 12.646 36.681 ( 16.114 0.000 -6.433) 17.351 37.683 ( 4.759 0.000 1.538) 5.001 37.787 ( 5.097 0.000 -0.840) 5.166 38.831 ( 3.079 0.000 -4.740) 5.652 38.889 ( 3.154 0.000 4.749) 5.701 38.910 ( 4.731 0.000 0.404) 4.748 39.229 ( 3.241 0.000 -3.710) 4.926 39.300 ( 10.397 0.000 2.782) 10.763 39.557 ( 8.248 0.000 1.628) 8.408 40.304 ( 4.168 0.000 10.015) 10.848 40.339 ( 13.978 0.000 -12.324) 18.635 41.136 ( 17.806 0.000 5.834) 18.737 41.159 ( 25.945 0.000 -4.577) 26.346 43.048 ( 5.978 0.000 2.317) 6.411 43.560 ( 16.658 0.000 -6.146) 17.755 43.888 ( 9.380 0.000 4.775) 10.525 44.162 ( 13.246 0.000 -0.834) 13.272 69.357 ( 9.475 0.000 0.362) 9.482 69.614 ( 13.311 0.000 -0.876) 13.340 69.977 ( 22.137 0.000 -2.370) 22.263 70.109 ( 23.330 0.000 3.326) 23.565 105.003 ( 2.363 0.000 -0.950) 2.546 105.064 ( 3.401 0.000 -1.354) 3.660 105.084 ( 5.179 0.000 0.544) 5.207 105.102 ( 4.395 0.000 1.740) 4.727 ======================= Grid point 97 (40/102) ======================= q-point: (-0.25 0.00 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 Number of triplets: 96 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.907 ( -30.964 0.000 26.133) 40.518 3.282 ( -40.220 0.000 15.332) 43.043 4.419 ( -19.805 0.000 -26.128) 32.786 4.432 ( -18.857 0.000 -7.861) 20.430 4.657 ( -17.178 0.000 -1.271) 17.225 4.686 ( -29.377 0.000 3.877) 29.632 4.887 ( -20.166 0.000 -1.668) 20.235 4.893 ( -13.521 0.000 10.046) 16.845 5.227 ( -16.618 0.000 -2.826) 16.856 5.235 ( -12.619 0.000 7.123) 14.490 5.426 ( -11.278 0.000 -7.663) 13.635 5.580 ( -28.761 0.000 6.517) 29.490 5.733 ( -1.400 0.000 -5.016) 5.208 5.792 ( -18.478 0.000 5.529) 19.288 6.135 ( -4.217 0.000 -6.172) 7.476 6.168 ( -17.358 0.000 -0.385) 17.363 6.249 ( -6.647 0.000 -1.976) 6.934 6.318 ( -14.178 0.000 -13.691) 19.709 6.514 ( -9.618 0.000 0.671) 9.641 6.645 ( -13.531 0.000 -4.336) 14.209 6.657 ( -6.645 0.000 4.561) 8.060 6.787 ( -11.177 0.000 -9.789) 14.858 7.039 ( -6.433 0.000 -9.295) 11.304 7.054 ( -12.925 0.000 8.046) 15.225 7.297 ( 0.190 0.000 -7.388) 7.390 7.381 ( -18.570 0.000 0.113) 18.570 7.390 ( -14.499 0.000 -2.009) 14.638 7.726 ( -23.810 0.000 0.863) 23.825 7.781 ( -23.827 0.000 4.588) 24.265 7.857 ( 7.487 0.000 4.204) 8.587 7.873 ( -8.710 0.000 4.551) 9.828 8.138 ( -6.521 0.000 -7.517) 9.952 8.241 ( -13.768 0.000 11.916) 18.208 8.274 ( -14.998 0.000 -2.344) 15.180 8.401 ( -0.474 0.000 7.061) 7.077 8.433 ( -14.876 0.000 13.077) 19.807 8.548 ( -4.719 0.000 -1.436) 4.933 8.619 ( -2.956 0.000 -7.374) 7.944 8.670 ( -16.050 0.000 1.384) 16.109 8.862 ( -14.319 0.000 -4.647) 15.054 8.872 ( -13.008 0.000 -0.760) 13.030 9.040 ( -23.700 0.000 -2.421) 23.824 9.092 ( -22.999 0.000 -2.019) 23.087 9.110 ( -14.812 0.000 -1.227) 14.863 9.301 ( -10.929 0.000 -3.744) 11.553 9.427 ( -15.604 0.000 -0.685) 15.619 9.658 ( -11.939 0.000 1.447) 12.026 9.667 ( 4.933 0.000 9.164) 10.407 9.873 ( -0.945 0.000 3.203) 3.339 9.873 ( 3.082 0.000 10.818) 11.249 10.443 ( 2.936 0.000 6.807) 7.414 10.476 ( -8.018 0.000 -8.399) 11.612 10.505 ( -5.149 0.000 6.420) 8.230 10.623 ( 1.182 0.000 -4.240) 4.402 10.829 ( -5.782 0.000 -0.945) 5.859 11.204 ( -5.753 0.000 -6.490) 8.673 11.386 ( -1.133 0.000 -16.768) 16.806 11.750 ( 1.288 0.000 10.144) 10.226 11.790 ( 0.321 0.000 17.057) 17.060 11.968 ( -4.383 0.000 -10.245) 11.143 12.220 ( 1.346 0.000 0.522) 1.444 12.299 ( 1.139 0.000 -1.067) 1.560 12.599 ( 6.932 0.000 4.499) 8.264 12.611 ( 7.381 0.000 -4.288) 8.536 12.978 ( -1.529 0.000 -0.142) 1.536 13.286 ( -5.864 0.000 -0.555) 5.890 13.717 ( -12.839 0.000 5.768) 14.076 13.786 ( -4.251 0.000 -3.958) 5.808 14.208 ( 3.300 0.000 -2.883) 4.382 14.258 ( 2.126 0.000 2.116) 3.000 14.444 ( -1.398 0.000 -2.417) 2.792 14.484 ( -1.830 0.000 0.799) 1.997 14.613 ( 0.751 0.000 0.819) 1.111 14.834 ( 2.842 0.000 -1.120) 3.055 14.862 ( 1.939 0.000 4.406) 4.814 15.016 ( 6.472 0.000 -2.776) 7.042 15.082 ( 5.707 0.000 12.440) 13.686 15.206 ( 2.830 0.000 -5.311) 6.017 15.355 ( 4.528 0.000 -8.520) 9.648 15.543 ( 8.695 0.000 -1.431) 8.812 17.715 ( 1.830 0.000 -0.550) 1.911 17.991 ( 5.994 0.000 0.409) 6.008 18.532 ( -0.745 0.000 1.500) 1.675 18.685 ( -0.945 0.000 -0.443) 1.044 18.708 ( -1.261 0.000 3.018) 3.271 18.840 ( 2.769 0.000 -1.925) 3.373 19.164 ( 4.426 0.000 -2.903) 5.293 19.356 ( 4.733 0.000 1.498) 4.965 19.763 ( -10.952 0.000 -1.825) 11.103 19.876 ( -9.136 0.000 1.310) 9.229 20.121 ( -5.138 0.000 -2.413) 5.676 20.148 ( -5.430 0.000 2.955) 6.182 21.032 ( -16.604 0.000 -5.033) 17.350 21.033 ( -16.552 0.000 5.222) 17.356 21.121 ( -15.744 0.000 -2.832) 15.997 21.205 ( -15.057 0.000 4.982) 15.860 21.718 ( -18.371 0.000 -4.443) 18.901 21.827 ( -19.432 0.000 2.744) 19.625 22.335 ( -19.701 0.000 8.335) 21.392 22.607 ( -4.923 0.000 -12.795) 13.709 24.402 ( -0.846 0.000 -0.511) 0.988 24.406 ( 2.811 0.000 2.730) 3.918 24.445 ( 0.687 0.000 -1.223) 1.403 24.570 ( -0.768 0.000 -2.447) 2.565 28.664 ( -3.934 0.000 -0.996) 4.059 28.682 ( -3.285 0.000 1.547) 3.631 29.019 ( 0.787 0.000 1.612) 1.794 29.200 ( 3.893 0.000 -0.171) 3.897 29.301 ( 2.233 0.000 3.579) 4.218 29.436 ( 1.357 0.000 -2.853) 3.159 29.514 ( 2.482 0.000 -0.601) 2.554 29.522 ( 2.714 0.000 0.334) 2.734 33.323 ( -7.466 0.000 0.042) 7.466 33.342 ( -6.715 0.000 -0.228) 6.719 33.613 ( -7.867 0.000 0.278) 7.871 33.631 ( -6.329 0.000 -0.877) 6.389 35.761 ( 1.224 0.000 1.667) 2.068 35.767 ( 3.232 0.000 -2.837) 4.300 36.571 ( 11.919 0.000 12.708) 17.423 37.018 ( 18.971 0.000 -9.550) 21.239 37.815 ( 7.902 0.000 4.155) 8.928 37.882 ( 4.729 0.000 -2.747) 5.469 38.885 ( 3.396 0.000 -6.671) 7.486 38.972 ( 4.398 0.000 5.204) 6.814 39.049 ( 8.347 0.000 4.590) 9.526 39.290 ( 3.758 0.000 -5.748) 6.867 39.519 ( 10.388 0.000 3.975) 11.123 39.716 ( 7.139 0.000 0.620) 7.166 40.429 ( 5.791 0.000 11.788) 13.133 40.624 ( 17.309 0.000 -17.049) 24.295 41.535 ( 20.050 0.000 9.463) 22.171 41.708 ( 29.590 0.000 -5.217) 30.046 43.188 ( 7.131 0.000 4.548) 8.458 43.893 ( 17.274 0.000 -11.467) 20.733 44.142 ( 15.507 0.000 8.567) 17.716 44.451 ( 15.511 0.000 -0.832) 15.534 69.563 ( 10.620 0.000 1.227) 10.691 69.901 ( 15.338 0.000 -2.327) 15.513 70.472 ( 27.818 0.000 -4.660) 28.206 70.666 ( 31.038 0.000 7.331) 31.892 105.055 ( 2.848 0.000 -0.696) 2.932 105.133 ( 3.658 0.000 -1.292) 3.879 105.182 ( 4.541 0.000 0.358) 4.555 105.220 ( 6.831 0.000 1.641) 7.025 ======================= Grid point 98 (41/102) ======================= q-point: (-0.19 0.00 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 Number of triplets: 96 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.375 ( -28.768 0.000 41.308) 50.338 2.518 ( -39.283 0.000 21.776) 44.915 3.848 ( -40.339 0.000 -3.542) 40.495 3.992 ( -23.823 0.000 -10.684) 26.109 4.072 ( -23.303 0.000 -22.170) 32.164 4.211 ( -26.813 0.000 -4.176) 27.136 4.454 ( -22.244 0.000 -0.678) 22.254 4.664 ( -12.640 0.000 15.490) 19.993 4.776 ( -34.713 0.000 8.823) 35.817 4.946 ( -17.664 0.000 3.486) 18.005 4.980 ( -20.614 0.000 -1.984) 20.710 5.157 ( -17.517 0.000 -1.155) 17.555 5.403 ( -18.126 0.000 3.584) 18.477 5.642 ( -29.467 0.000 -3.082) 29.627 5.683 ( -5.778 0.000 -0.016) 5.778 5.862 ( -30.208 0.000 -7.073) 31.025 5.990 ( -5.939 0.000 -25.984) 26.655 6.146 ( -2.929 0.000 -1.263) 3.189 6.396 ( -5.318 0.000 -0.995) 5.410 6.398 ( -3.981 0.000 -10.429) 11.163 6.457 ( -13.578 0.000 11.355) 17.701 6.638 ( -5.773 0.000 -7.247) 9.265 6.837 ( -15.205 0.000 -6.363) 16.482 6.876 ( -19.001 0.000 4.910) 19.625 6.970 ( -23.164 0.000 -3.869) 23.485 7.014 ( -11.991 0.000 -4.637) 12.857 7.204 ( -22.040 0.000 -4.513) 22.497 7.302 ( -6.487 0.000 -6.589) 9.246 7.341 ( -5.108 0.000 1.968) 5.474 7.755 ( -11.944 0.000 13.305) 17.880 7.809 ( -17.174 0.000 4.957) 17.875 7.920 ( -12.992 0.000 2.405) 13.213 7.935 ( -9.873 0.000 5.824) 11.463 8.018 ( -11.515 0.000 -11.672) 16.397 8.246 ( -17.562 0.000 0.967) 17.588 8.278 ( -6.664 0.000 16.627) 17.912 8.290 ( -12.072 0.000 4.247) 12.798 8.391 ( -13.605 0.000 2.746) 13.880 8.522 ( -11.379 0.000 -4.149) 12.112 8.548 ( -8.484 0.000 -11.679) 14.435 8.560 ( -18.908 0.000 -2.114) 19.026 8.615 ( -15.681 0.000 7.324) 17.307 8.865 ( 1.248 0.000 1.039) 1.624 8.964 ( -4.312 0.000 -1.568) 4.589 9.062 ( -15.258 0.000 2.746) 15.503 9.145 ( -2.218 0.000 -2.795) 3.568 9.462 ( -6.827 0.000 -4.311) 8.074 9.669 ( -5.022 0.000 7.159) 8.744 9.994 ( 1.222 0.000 -5.051) 5.197 10.002 ( 5.209 0.000 9.026) 10.421 10.292 ( -2.960 0.000 -0.397) 2.986 10.367 ( -4.948 0.000 -2.070) 5.363 10.584 ( 4.184 0.000 15.695) 16.243 10.641 ( 1.878 0.000 -8.469) 8.675 10.731 ( -4.122 0.000 7.985) 8.986 11.180 ( 4.681 0.000 -3.179) 5.659 11.364 ( 2.549 0.000 -19.694) 19.858 11.807 ( -1.463 0.000 -4.560) 4.789 11.821 ( 2.992 0.000 12.128) 12.492 11.905 ( 0.330 0.000 7.664) 7.671 12.279 ( 3.444 0.000 -0.413) 3.469 12.347 ( 3.140 0.000 0.740) 3.226 12.654 ( -3.588 0.000 2.893) 4.609 12.779 ( 9.461 0.000 -3.930) 10.245 13.038 ( 8.653 0.000 -0.799) 8.690 13.122 ( -10.142 0.000 0.281) 10.146 13.399 ( -19.721 0.000 6.354) 20.719 13.663 ( -6.452 0.000 -2.780) 7.025 14.265 ( 3.044 0.000 -3.137) 4.371 14.298 ( 1.519 0.000 1.188) 1.929 14.428 ( 0.535 0.000 -4.727) 4.757 14.460 ( -0.740 0.000 1.001) 1.245 14.632 ( 0.606 0.000 5.355) 5.390 14.885 ( 1.788 0.000 0.953) 2.026 14.918 ( 2.744 0.000 3.676) 4.587 15.162 ( 8.236 0.000 -2.580) 8.630 15.229 ( 5.877 0.000 14.842) 15.964 15.282 ( 6.374 0.000 -8.079) 10.290 15.456 ( 7.453 0.000 -10.843) 13.157 15.732 ( 10.702 0.000 -2.818) 11.066 17.751 ( 1.622 0.000 0.057) 1.623 18.130 ( 7.655 0.000 -0.470) 7.670 18.490 ( -3.854 0.000 1.305) 4.069 18.640 ( -3.362 0.000 -0.302) 3.376 18.705 ( 0.179 0.000 3.416) 3.421 18.897 ( 3.191 0.000 -1.290) 3.442 19.241 ( 4.085 0.000 -3.726) 5.529 19.456 ( 4.792 0.000 1.512) 5.024 19.536 ( -10.770 0.000 -1.788) 10.917 19.695 ( -8.740 0.000 1.639) 8.893 20.002 ( -5.795 0.000 -4.104) 7.101 20.042 ( -5.776 0.000 3.991) 7.021 20.694 ( -15.600 0.000 -4.308) 16.184 20.715 ( -15.827 0.000 4.840) 16.550 20.809 ( -14.503 0.000 -2.579) 14.731 20.910 ( -15.153 0.000 5.063) 15.976 21.311 ( -20.711 0.000 -6.029) 21.571 21.414 ( -22.009 0.000 3.719) 22.321 21.918 ( -23.997 0.000 12.548) 27.080 22.443 ( -8.294 0.000 -25.444) 26.762 24.397 ( 0.381 0.000 0.208) 0.434 24.464 ( 1.786 0.000 -1.281) 2.198 24.481 ( 3.665 0.000 1.574) 3.989 24.553 ( -0.398 0.000 -2.021) 2.060 28.591 ( -3.126 0.000 -0.806) 3.228 28.624 ( -2.830 0.000 1.330) 3.127 29.036 ( 0.464 0.000 3.313) 3.345 29.275 ( 3.612 0.000 -0.541) 3.653 29.361 ( 3.001 0.000 3.450) 4.572 29.462 ( 1.756 0.000 -2.722) 3.239 29.556 ( 1.833 0.000 -0.335) 1.863 29.574 ( 2.385 0.000 0.098) 2.387 33.174 ( -7.264 0.000 0.243) 7.268 33.206 ( -6.559 0.000 -0.599) 6.586 33.447 ( -8.646 0.000 0.579) 8.666 33.496 ( -6.796 0.000 -2.504) 7.243 35.795 ( 1.701 0.000 1.728) 2.425 35.846 ( 5.160 0.000 -3.177) 6.060 36.863 ( 13.918 0.000 20.276) 24.594 37.385 ( 19.277 0.000 -10.925) 22.158 37.965 ( 4.295 0.000 -3.754) 5.704 38.019 ( 11.433 0.000 4.978) 12.470 38.936 ( 3.256 0.000 -8.115) 8.744 39.088 ( 5.933 0.000 6.787) 9.015 39.255 ( 10.692 0.000 7.690) 13.170 39.347 ( 2.980 0.000 -6.521) 7.170 39.721 ( 8.671 0.000 4.280) 9.670 39.837 ( 4.746 0.000 -0.401) 4.763 40.576 ( 6.017 0.000 13.254) 14.556 40.947 ( 18.569 0.000 -21.768) 28.612 41.960 ( 19.451 0.000 13.458) 23.653 42.303 ( 30.302 0.000 -5.664) 30.827 43.353 ( 8.140 0.000 9.715) 12.674 44.178 ( 13.820 0.000 -9.054) 16.522 44.555 ( 23.483 0.000 4.602) 23.930 44.765 ( 15.592 0.000 -0.920) 15.619 69.777 ( 10.083 0.000 2.676) 10.432 70.202 ( 15.014 0.000 -4.958) 15.811 71.058 ( 31.447 0.000 -6.565) 32.125 71.376 ( 37.443 0.000 13.858) 39.925 105.112 ( 2.881 0.000 -0.193) 2.887 105.201 ( 3.321 0.000 -0.816) 3.420 105.270 ( 4.133 0.000 0.073) 4.133 105.371 ( 7.794 0.000 1.274) 7.897 ======================= Grid point 99 (42/102) ======================= q-point: (-0.12 0.00 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 Number of triplets: 96 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.831 ( -34.162 0.000 32.578) 47.206 1.936 ( -25.692 0.000 52.360) 58.323 2.849 ( -56.213 0.000 19.822) 59.606 3.347 ( -39.563 0.000 -18.511) 43.679 3.612 ( -29.895 0.000 1.933) 29.958 3.665 ( -12.828 0.000 -36.885) 39.052 4.013 ( -20.879 0.000 -3.946) 21.248 4.094 ( -29.312 0.000 20.008) 35.490 4.469 ( -12.343 0.000 13.342) 18.176 4.578 ( -18.326 0.000 -4.628) 18.901 4.632 ( -31.387 0.000 9.417) 32.770 4.680 ( -9.740 0.000 -11.175) 14.824 5.078 ( -21.641 0.000 -6.249) 22.525 5.201 ( -7.874 0.000 2.081) 8.144 5.206 ( -30.563 0.000 -7.608) 31.496 5.480 ( -13.317 0.000 5.695) 14.483 5.817 ( -8.085 0.000 -26.286) 27.502 6.092 ( -17.004 0.000 11.672) 20.625 6.129 ( -15.935 0.000 -0.597) 15.946 6.204 ( -10.815 0.000 -3.046) 11.236 6.326 ( -19.715 0.000 -13.996) 24.178 6.369 ( 0.845 0.000 -10.106) 10.141 6.433 ( -8.303 0.000 0.392) 8.312 6.501 ( -12.055 0.000 -2.182) 12.250 6.701 ( -2.413 0.000 -13.343) 13.559 6.805 ( -8.694 0.000 -12.381) 15.129 7.022 ( -4.845 0.000 2.079) 5.272 7.197 ( -7.597 0.000 4.682) 8.924 7.241 ( -7.184 0.000 1.104) 7.269 7.445 ( -14.180 0.000 4.162) 14.778 7.514 ( -18.294 0.000 6.399) 19.381 7.573 ( -13.261 0.000 5.001) 14.173 7.719 ( -11.934 0.000 -7.356) 14.019 7.790 ( -8.210 0.000 -7.265) 10.963 7.962 ( -13.044 0.000 1.822) 13.171 8.032 ( -12.990 0.000 8.029) 15.271 8.111 ( -14.493 0.000 -1.575) 14.578 8.119 ( -13.265 0.000 1.398) 13.338 8.214 ( -9.275 0.000 8.006) 12.253 8.309 ( -8.518 0.000 3.403) 9.173 8.484 ( 2.700 0.000 17.422) 17.630 8.551 ( 3.342 0.000 -12.540) 12.977 8.779 ( -9.354 0.000 6.056) 11.144 8.929 ( 3.132 0.000 -3.175) 4.460 8.961 ( -1.458 0.000 -0.037) 1.458 9.154 ( 1.956 0.000 1.081) 2.235 9.355 ( -3.059 0.000 -9.301) 9.791 9.573 ( -5.148 0.000 3.816) 6.409 9.748 ( -17.344 0.000 0.024) 17.344 10.031 ( -4.901 0.000 0.982) 4.999 10.336 ( 2.233 0.000 6.890) 7.243 10.397 ( 6.505 0.000 -4.845) 8.111 10.579 ( -3.895 0.000 -1.992) 4.375 10.700 ( 6.374 0.000 -9.488) 11.431 10.810 ( 6.526 0.000 25.015) 25.852 11.315 ( 6.637 0.000 -7.224) 9.810 11.421 ( 8.181 0.000 -12.684) 15.094 11.763 ( 0.178 0.000 -10.687) 10.688 11.908 ( 2.933 0.000 13.131) 13.454 11.971 ( 2.537 0.000 14.739) 14.956 12.322 ( 0.640 0.000 -2.089) 2.185 12.381 ( -2.252 0.000 1.654) 2.794 12.570 ( -1.501 0.000 1.540) 2.150 12.886 ( -12.247 0.000 -2.481) 12.496 12.960 ( 8.245 0.000 -1.361) 8.356 12.980 ( -22.610 0.000 7.818) 23.923 13.244 ( 10.307 0.000 -0.925) 10.348 13.565 ( -1.819 0.000 1.190) 2.174 14.317 ( 2.865 0.000 -3.234) 4.321 14.331 ( 1.735 0.000 0.902) 1.955 14.445 ( 2.241 0.000 -6.548) 6.921 14.456 ( 0.340 0.000 -0.865) 0.930 14.667 ( 1.471 0.000 11.564) 11.657 14.901 ( -0.383 0.000 1.908) 1.946 14.988 ( 3.459 0.000 6.261) 7.153 15.318 ( 7.514 0.000 -2.314) 7.862 15.358 ( 3.575 0.000 14.037) 14.485 15.426 ( 8.784 0.000 -5.906) 10.585 15.596 ( 8.400 0.000 -10.945) 13.797 15.971 ( 14.530 0.000 -6.031) 15.732 17.770 ( -0.083 0.000 1.426) 1.428 18.263 ( 4.122 0.000 -1.701) 4.459 18.385 ( -6.575 0.000 1.180) 6.680 18.578 ( -1.056 0.000 -0.737) 1.288 18.724 ( 0.803 0.000 3.286) 3.383 18.959 ( 3.282 0.000 -1.920) 3.802 19.312 ( 2.696 0.000 -3.486) 4.406 19.349 ( -5.890 0.000 -2.017) 6.225 19.507 ( -3.869 0.000 0.759) 3.943 19.587 ( 1.173 0.000 3.123) 3.335 19.884 ( -4.467 0.000 -6.496) 7.884 19.938 ( -5.419 0.000 4.729) 7.192 20.416 ( -10.874 0.000 -2.866) 11.246 20.436 ( -12.635 0.000 3.863) 13.212 20.545 ( -10.943 0.000 -2.139) 11.150 20.634 ( -12.986 0.000 4.742) 13.824 20.884 ( -19.989 0.000 -6.512) 21.023 20.982 ( -21.295 0.000 4.068) 21.680 21.432 ( -27.033 0.000 13.413) 30.177 22.101 ( -21.140 0.000 -47.904) 52.361 24.415 ( 1.232 0.000 0.634) 1.385 24.497 ( 1.790 0.000 -1.754) 2.506 24.548 ( 0.222 0.000 -0.666) 0.702 24.562 ( 3.839 0.000 1.015) 3.971 28.538 ( -2.017 0.000 -0.498) 2.078 28.574 ( -2.317 0.000 0.850) 2.468 29.056 ( 0.759 0.000 5.315) 5.369 29.338 ( 2.697 0.000 -1.358) 3.020 29.433 ( 3.436 0.000 3.454) 4.872 29.494 ( 2.015 0.000 -2.287) 3.048 29.585 ( 1.055 0.000 -0.043) 1.055 29.616 ( 1.791 0.000 0.001) 1.791 33.042 ( -5.740 0.000 0.453) 5.758 33.085 ( -5.235 0.000 -1.082) 5.346 33.277 ( -8.081 0.000 0.417) 8.091 33.345 ( -7.738 0.000 -5.225) 9.337 35.833 ( 1.629 0.000 2.401) 2.902 35.951 ( 5.691 0.000 -3.498) 6.680 37.228 ( 17.836 0.000 30.026) 34.924 37.722 ( 15.655 0.000 -6.844) 17.085 38.041 ( 4.152 0.000 -3.003) 5.124 38.288 ( 14.445 0.000 1.133) 14.489 38.981 ( 2.946 0.000 -8.904) 9.379 39.238 ( 7.443 0.000 7.077) 10.270 39.377 ( 1.390 0.000 -5.532) 5.704 39.498 ( 11.401 0.000 9.547) 14.870 39.876 ( 5.726 0.000 4.034) 7.004 39.903 ( 2.154 0.000 -0.608) 2.238 40.712 ( 4.310 0.000 14.216) 14.854 41.257 ( 16.934 0.000 -25.361) 30.495 42.347 ( 15.286 0.000 17.845) 23.497 42.863 ( 25.836 0.000 -6.180) 26.565 43.585 ( 13.406 0.000 23.332) 26.909 44.423 ( 12.029 0.000 -3.357) 12.489 45.051 ( 12.682 0.000 -1.130) 12.732 45.056 ( 24.871 0.000 -0.502) 24.876 69.967 ( 7.850 0.000 4.463) 9.030 70.462 ( 11.886 0.000 -8.355) 14.529 71.684 ( 31.862 0.000 -6.127) 32.446 72.218 ( 42.839 0.000 23.060) 48.651 105.166 ( 2.489 0.000 0.554) 2.550 105.262 ( 2.852 0.000 1.206) 3.097 105.344 ( 3.117 0.000 -0.661) 3.187 105.527 ( 7.150 0.000 1.028) 7.223 ======================= Grid point 100 (43/102) ======================= q-point: (-0.06 0.00 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 Number of triplets: 96 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.332 ( -22.847 0.000 47.916) 53.084 1.339 ( -48.832 0.000 19.185) 52.465 2.025 ( -25.785 0.000 78.731) 82.846 2.463 ( -39.100 0.000 -19.746) 43.803 3.083 ( -21.778 0.000 4.138) 22.168 3.388 ( -7.491 0.000 -35.799) 36.574 3.627 ( -14.441 0.000 -13.654) 19.874 3.708 ( -13.914 0.000 18.560) 23.197 4.081 ( -20.956 0.000 11.825) 24.062 4.218 ( -12.707 0.000 4.085) 13.347 4.280 ( -10.956 0.000 -7.455) 13.252 4.551 ( -1.821 0.000 -8.490) 8.683 4.666 ( -16.541 0.000 -5.278) 17.362 4.683 ( -18.846 0.000 -4.578) 19.394 5.122 ( -1.904 0.000 3.541) 4.021 5.281 ( -6.428 0.000 7.801) 10.108 5.517 ( -14.890 0.000 -5.132) 15.750 5.557 ( -22.004 0.000 -1.640) 22.065 5.868 ( -12.038 0.000 2.866) 12.375 6.050 ( -3.164 0.000 -40.465) 40.588 6.214 ( 2.693 0.000 3.483) 4.403 6.297 ( -4.361 0.000 -4.774) 6.466 6.376 ( 0.381 0.000 -1.786) 1.826 6.420 ( 2.148 0.000 -10.163) 10.388 6.624 ( -6.955 0.000 -15.235) 16.748 6.672 ( 0.846 0.000 -9.327) 9.365 6.847 ( -12.203 0.000 -1.839) 12.341 6.886 ( -14.373 0.000 -2.657) 14.616 7.219 ( -11.145 0.000 6.787) 13.049 7.234 ( -7.210 0.000 2.327) 7.576 7.237 ( -0.542 0.000 19.932) 19.940 7.406 ( -6.732 0.000 -1.796) 6.968 7.500 ( -6.227 0.000 -7.290) 9.587 7.674 ( -2.779 0.000 -3.335) 4.341 7.761 ( -6.230 0.000 -0.213) 6.234 7.764 ( -12.246 0.000 -7.162) 14.187 7.848 ( -11.934 0.000 -4.201) 12.652 7.917 ( -5.199 0.000 12.263) 13.319 8.168 ( -0.236 0.000 15.126) 15.128 8.243 ( -0.523 0.000 5.902) 5.925 8.586 ( -1.267 0.000 20.865) 20.903 8.595 ( 3.408 0.000 -10.594) 11.128 8.676 ( 0.920 0.000 -0.057) 0.922 8.907 ( -4.677 0.000 -1.500) 4.912 8.929 ( -3.925 0.000 -5.437) 6.705 9.201 ( 2.118 0.000 -5.869) 6.239 9.270 ( -3.707 0.000 -5.969) 7.026 9.434 ( -11.491 0.000 11.137) 16.002 9.521 ( -1.593 0.000 -0.188) 1.604 9.854 ( -10.033 0.000 -5.370) 11.380 10.430 ( 3.691 0.000 12.616) 13.145 10.474 ( 3.345 0.000 -8.367) 9.011 10.499 ( -4.526 0.000 2.292) 5.073 10.820 ( 6.369 0.000 -8.772) 10.841 10.984 ( 4.997 0.000 -0.115) 4.999 11.378 ( 3.447 0.000 -17.965) 18.293 11.615 ( 9.739 0.000 0.484) 9.751 11.817 ( 7.267 0.000 3.396) 8.021 11.988 ( 2.030 0.000 13.031) 13.189 12.053 ( 3.054 0.000 11.194) 11.604 12.286 ( -4.398 0.000 1.673) 4.705 12.289 ( -3.238 0.000 -5.153) 6.086 12.525 ( -14.685 0.000 -1.451) 14.757 12.609 ( -13.258 0.000 -0.663) 13.275 12.666 ( -0.328 0.000 14.828) 14.831 13.128 ( 7.525 0.000 1.122) 7.608 13.407 ( 5.739 0.000 -2.195) 6.145 13.618 ( 5.718 0.000 -3.627) 6.772 14.366 ( 2.640 0.000 -3.521) 4.401 14.375 ( 2.236 0.000 -0.024) 2.236 14.471 ( 1.483 0.000 -4.822) 5.045 14.484 ( 3.042 0.000 -7.116) 7.739 14.781 ( 8.082 0.000 15.172) 17.191 14.884 ( -1.471 0.000 1.129) 1.855 15.140 ( 13.136 0.000 26.425) 29.509 15.420 ( -0.884 0.000 15.089) 15.115 15.450 ( 6.715 0.000 -0.237) 6.719 15.569 ( 5.959 0.000 -4.421) 7.420 15.734 ( 8.178 0.000 -6.980) 10.752 16.280 ( 16.271 0.000 -7.717) 18.008 17.755 ( -1.528 0.000 3.411) 3.737 18.250 ( -3.404 0.000 -2.664) 4.322 18.257 ( -5.525 0.000 0.876) 5.594 18.620 ( 2.955 0.000 -3.958) 4.939 18.744 ( 0.343 0.000 2.165) 2.192 18.989 ( -2.701 0.000 -11.235) 11.555 19.238 ( -2.758 0.000 0.786) 2.868 19.403 ( 5.069 0.000 -5.013) 7.129 19.403 ( -5.090 0.000 0.127) 5.091 19.623 ( -1.646 0.000 2.602) 3.079 19.823 ( 0.897 0.000 -7.983) 8.033 19.851 ( -4.272 0.000 5.890) 7.276 20.232 ( -8.410 0.000 2.563) 8.792 20.258 ( -4.334 0.000 -2.311) 4.912 20.384 ( -4.098 0.000 -2.062) 4.588 20.430 ( -7.743 0.000 3.882) 8.662 20.524 ( -13.116 0.000 -4.157) 13.759 20.607 ( -16.229 0.000 3.587) 16.620 20.921 ( -24.906 0.000 8.475) 26.308 21.222 ( -57.110 0.000 -61.598) 83.999 24.445 ( 1.433 0.000 0.768) 1.626 24.524 ( 1.120 0.000 -1.859) 2.170 24.560 ( 0.913 0.000 1.372) 1.648 24.628 ( 2.294 0.000 0.234) 2.306 28.509 ( -0.774 0.000 -0.127) 0.784 28.536 ( -1.605 0.000 0.288) 1.631 29.095 ( 2.024 0.000 6.705) 7.004 29.373 ( 1.200 0.000 -2.597) 2.861 29.510 ( 3.273 0.000 1.940) 3.804 29.529 ( 1.670 0.000 -1.475) 2.228 29.600 ( 0.529 0.000 0.365) 0.643 29.644 ( 0.948 0.000 -0.024) 0.948 32.952 ( -3.193 0.000 0.602) 3.250 32.998 ( -3.103 0.000 -1.680) 3.529 33.140 ( -5.231 0.000 -0.315) 5.241 33.156 ( -9.756 0.000 -5.255) 11.081 35.869 ( 1.215 0.000 3.574) 3.775 36.044 ( 3.970 0.000 -3.732) 5.449 37.726 ( 24.875 0.000 27.898) 37.377 37.954 ( 7.778 0.000 -0.910) 7.831 38.126 ( 5.122 0.000 1.488) 5.333 38.583 ( 14.097 0.000 -1.850) 14.218 39.011 ( 2.064 0.000 -10.605) 10.804 39.388 ( 4.499 0.000 0.494) 4.526 39.392 ( 1.325 0.000 -1.232) 1.809 39.700 ( 4.095 0.000 -1.301) 4.297 39.938 ( 1.757 0.000 1.673) 2.426 39.963 ( 2.187 0.000 3.067) 3.767 40.796 ( 0.832 0.000 14.437) 14.461 41.511 ( 14.038 0.000 -25.400) 29.021 42.632 ( 8.811 0.000 23.190) 24.808 43.267 ( 14.872 0.000 -7.392) 16.608 44.180 ( 46.711 0.000 50.127) 68.518 44.638 ( 8.933 0.000 2.988) 9.420 45.249 ( 7.111 0.000 -0.927) 7.171 45.490 ( 16.841 0.000 -1.821) 16.939 70.101 ( 4.338 0.000 6.160) 7.534 70.626 ( 6.297 0.000 -11.542) 13.148 72.276 ( 26.699 0.000 0.298) 26.700 73.168 ( 43.452 0.000 16.598) 46.514 105.213 ( 1.956 0.000 1.741) 2.619 105.351 ( 7.209 0.000 7.858) 10.664 105.387 ( 1.340 0.000 -1.665) 2.138 105.644 ( 3.819 0.000 0.665) 3.876 ======================= Grid point 101 (44/102) ======================= q-point: ( 0.00 0.20 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 Number of triplets: 160 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.989 ( 5.404 27.720 22.038) 35.823 1.565 ( 0.841 35.905 38.969) 52.995 2.065 ( -3.737 13.087 -21.582) 25.515 2.593 ( -2.664 42.274 47.590) 63.710 2.671 ( -0.438 -7.255 17.336) 18.798 3.196 ( -1.823 -7.739 -8.008) 11.284 3.449 ( 2.015 7.691 -29.319) 30.378 3.683 ( -0.363 5.165 11.078) 12.228 3.727 ( -2.367 -13.916 9.752) 17.157 4.034 ( -0.033 -2.649 4.557) 5.271 4.161 ( 3.545 -6.402 -9.431) 11.937 4.411 ( 4.807 -8.459 -10.400) 14.241 4.608 ( 1.160 12.680 3.224) 13.135 4.639 ( 0.898 9.104 -4.319) 10.117 5.029 ( -2.091 -9.423 -4.706) 10.738 5.247 ( -1.346 2.921 8.917) 9.480 5.290 ( 3.458 -5.651 -2.263) 7.000 5.404 ( 0.429 4.589 12.435) 13.262 5.723 ( -3.403 -0.305 -16.922) 17.264 5.931 ( -0.157 -3.516 -22.497) 22.771 6.072 ( -3.611 -8.753 -12.420) 15.618 6.291 ( 1.243 -0.503 4.081) 4.296 6.405 ( 2.389 6.272 -17.472) 18.717 6.447 ( 5.190 1.149 -3.259) 6.235 6.554 ( -0.378 1.510 -1.836) 2.407 6.650 ( -2.058 -1.771 1.872) 3.298 6.700 ( 1.256 0.783 -2.436) 2.851 6.820 ( -1.082 -16.983 5.627) 17.924 6.897 ( -0.540 1.854 -6.616) 6.892 7.152 ( 1.445 1.199 -0.471) 1.936 7.268 ( -3.321 -5.294 -1.897) 6.531 7.325 ( 0.984 1.539 4.710) 5.052 7.457 ( -2.011 2.846 0.384) 3.506 7.530 ( 1.496 0.040 3.068) 3.413 7.606 ( -2.432 -5.764 -6.353) 8.916 7.718 ( 2.426 6.055 2.782) 7.092 7.802 ( -2.972 3.787 6.701) 8.251 7.972 ( -0.598 7.017 -1.857) 7.283 8.087 ( 0.867 -8.062 -0.448) 8.121 8.211 ( -0.501 -2.303 9.744) 10.025 8.477 ( 2.692 -11.291 -2.547) 11.883 8.666 ( -3.330 6.030 4.997) 8.509 8.712 ( -7.089 -0.474 -0.801) 7.150 8.782 ( 4.510 1.850 2.859) 5.651 9.005 ( 1.107 12.379 0.247) 12.431 9.089 ( 1.547 -3.142 -0.941) 3.626 9.262 ( -0.774 -2.406 6.477) 6.953 9.387 ( -1.410 6.405 6.396) 9.161 9.536 ( 0.778 -0.716 -3.625) 3.776 9.780 ( -2.239 5.567 1.391) 6.159 9.962 ( -1.371 -20.776 4.083) 21.218 10.310 ( -2.324 -15.248 2.750) 15.668 10.462 ( -2.510 -17.242 0.393) 17.429 10.604 ( 0.720 -8.080 9.092) 12.185 11.200 ( 0.282 13.913 -23.219) 27.070 11.517 ( -1.051 5.862 -17.199) 18.201 11.700 ( 0.087 -2.708 9.093) 9.488 11.830 ( -1.802 6.637 3.850) 7.882 12.072 ( 0.576 3.638 4.833) 6.077 12.146 ( 3.156 0.551 0.918) 3.333 12.212 ( 4.909 -1.294 1.826) 5.395 12.234 ( -1.740 -1.665 2.257) 3.301 12.318 ( -1.270 4.148 6.100) 7.485 12.490 ( -0.956 4.407 10.172) 11.127 12.972 ( 2.195 5.192 2.989) 6.380 13.233 ( 0.741 -5.017 -0.011) 5.072 13.373 ( -0.518 -0.377 1.423) 1.560 13.855 ( -6.412 7.961 -11.291) 15.231 14.322 ( -1.427 -6.350 -3.787) 7.530 14.368 ( -0.132 -3.780 -8.729) 9.513 14.452 ( 2.191 2.557 -2.088) 3.962 14.588 ( -0.617 -1.319 -1.839) 2.346 14.784 ( 2.206 -3.636 8.156) 9.198 14.918 ( -0.146 6.386 -2.855) 6.997 15.195 ( -3.044 -1.021 16.334) 16.647 15.405 ( 0.500 -8.356 -0.226) 8.374 15.539 ( -0.364 3.718 4.064) 5.520 15.806 ( -2.921 4.369 7.254) 8.957 16.061 ( 8.337 -2.362 4.765) 9.889 16.629 ( 0.925 1.117 -23.090) 23.136 17.864 ( 4.045 7.333 4.486) 9.500 18.057 ( -11.669 1.861 -3.140) 12.226 18.204 ( 1.060 -1.120 1.300) 2.017 18.238 ( -2.356 -0.892 0.584) 2.586 18.730 ( -0.694 0.375 1.552) 1.741 18.815 ( -0.820 3.830 -1.749) 4.290 19.261 ( -0.375 -6.601 0.456) 6.628 19.332 ( 2.757 -8.200 -2.982) 9.151 19.415 ( -0.603 -0.266 -0.508) 0.832 19.533 ( -0.776 5.987 -7.554) 9.670 19.697 ( -3.787 -5.339 5.793) 8.740 19.906 ( 5.621 -6.140 -2.632) 8.731 20.180 ( 0.566 3.358 1.096) 3.577 20.275 ( 1.371 0.683 -2.791) 3.184 20.303 ( -2.541 -0.602 -0.146) 2.615 20.354 ( 2.736 -1.871 -2.050) 3.897 20.410 ( -5.078 1.267 0.386) 5.248 20.431 ( 4.739 0.291 0.186) 4.752 20.531 ( 13.563 0.208 2.447) 13.784 20.556 ( -4.623 -0.178 1.106) 4.757 24.471 ( -0.077 1.798 1.964) 2.663 24.558 ( -0.169 1.275 -0.926) 1.585 24.596 ( 0.247 1.103 1.849) 2.167 24.666 ( -0.146 -0.386 -1.775) 1.823 28.580 ( -0.069 6.263 0.829) 6.318 28.663 ( 0.018 10.343 -4.999) 11.488 29.071 ( 1.581 -7.508 6.046) 9.768 29.264 ( -1.094 -9.459 -1.656) 9.665 29.498 ( -1.259 1.904 1.216) 2.587 29.571 ( 0.769 1.221 -1.865) 2.358 29.650 ( -1.324 1.006 0.401) 1.711 29.672 ( 0.727 1.537 -0.840) 1.897 32.948 ( 0.075 1.755 -0.723) 1.900 32.964 ( 0.145 0.385 -1.155) 1.226 33.022 ( 0.335 -0.501 1.477) 1.595 33.070 ( -0.134 -1.288 -0.728) 1.485 36.058 ( -0.545 16.711 5.286) 17.536 36.469 ( 0.834 21.638 -17.527) 27.858 37.761 ( 4.972 -23.938 19.990) 31.581 38.182 ( -5.435 -29.054 -0.887) 29.571 38.247 ( -1.189 7.062 -0.976) 7.227 38.295 ( 1.791 16.335 -7.099) 17.901 39.042 ( -6.999 -0.449 7.732) 10.439 39.198 ( 5.854 -0.960 1.063) 6.026 39.564 ( -4.548 1.553 -0.265) 4.813 39.727 ( -0.811 1.454 -3.976) 4.310 39.979 ( -1.223 -0.333 3.042) 3.296 39.996 ( 1.506 3.209 0.785) 3.631 41.585 ( -11.681 46.206 -38.564) 61.308 41.745 ( 6.363 7.262 -24.471) 26.307 42.813 ( 0.247 4.853 14.575) 15.364 43.381 ( -0.339 -2.628 -9.849) 10.199 44.677 ( 2.483 -8.082 9.902) 13.020 44.835 ( 3.781 -23.433 17.779) 29.657 45.416 ( 2.298 0.886 5.324) 5.866 45.616 ( -1.772 -2.900 -2.461) 4.196 70.350 ( 0.208 18.208 7.934) 19.862 71.123 ( 5.067 20.041 -36.181) 41.670 72.687 ( 9.725 1.416 7.616) 12.433 73.061 ( -37.207 -9.130 -4.891) 38.622 105.259 ( 0.880 1.172 2.989) 3.329 105.366 ( 0.659 -1.864 1.439) 2.446 105.571 ( 4.279 -2.239 0.524) 4.857 105.646 ( -1.615 -2.051 -1.387) 2.956 ======================= Grid point 102 (45/102) ======================= q-point: ( 0.06 0.20 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 Number of triplets: 160 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.611 ( 33.806 17.275 25.020) 45.467 1.852 ( 23.070 31.082 31.454) 49.877 2.348 ( 32.682 9.235 -22.321) 40.640 2.805 ( 14.096 42.184 50.394) 67.214 2.940 ( 22.396 -10.681 10.929) 27.113 3.318 ( 13.727 1.093 -17.641) 22.379 3.552 ( 15.548 -0.048 -25.612) 29.962 3.817 ( 8.820 -17.503 3.685) 19.943 3.855 ( 14.060 3.130 16.690) 22.047 4.168 ( 13.005 -2.490 10.160) 16.690 4.329 ( 13.392 -10.015 -9.622) 19.293 4.576 ( 14.096 -3.176 -10.942) 18.125 4.735 ( 11.403 9.669 0.995) 14.984 4.856 ( 16.972 9.709 -5.853) 20.410 5.107 ( 12.042 -11.076 -3.219) 16.675 5.347 ( 4.342 4.857 17.276) 18.464 5.530 ( 18.899 -3.779 -1.341) 19.319 5.584 ( 18.482 -1.754 5.282) 19.302 5.705 ( 6.958 4.037 -20.486) 22.008 5.915 ( 3.840 -0.894 -24.929) 25.239 5.983 ( -2.253 -10.609 -6.792) 12.797 6.335 ( 2.882 0.696 0.387) 2.990 6.410 ( 1.299 9.111 -18.182) 20.379 6.529 ( 3.988 2.132 -1.800) 4.867 6.556 ( 0.928 2.399 -1.685) 3.075 6.791 ( 9.510 -15.344 2.141) 18.178 6.843 ( 12.613 -0.398 -1.461) 12.704 6.883 ( 6.562 -0.998 -5.123) 8.385 6.943 ( 8.471 -4.371 0.105) 9.533 7.245 ( 8.135 3.176 -1.590) 8.876 7.296 ( 5.966 -0.549 7.862) 9.884 7.415 ( 6.363 -1.256 5.120) 8.263 7.518 ( 7.587 3.380 -0.401) 8.316 7.555 ( 2.917 -2.995 -3.843) 5.679 7.657 ( 5.507 -0.158 4.429) 7.069 7.828 ( 7.801 3.755 -0.426) 8.668 7.844 ( 5.663 4.030 2.536) 7.399 7.983 ( 3.631 0.672 -1.682) 4.057 8.105 ( 1.869 -11.455 -3.786) 12.208 8.221 ( -0.184 -2.895 6.830) 7.421 8.479 ( -1.017 -3.766 10.751) 11.437 8.640 ( 0.039 1.305 -0.605) 1.439 8.762 ( 8.703 3.222 -1.239) 9.362 8.936 ( 7.925 2.556 -3.684) 9.106 9.008 ( -0.722 9.026 -2.958) 9.526 9.157 ( 4.982 2.590 -3.079) 6.403 9.278 ( 1.409 -5.210 10.479) 11.787 9.436 ( 3.616 5.409 4.934) 8.166 9.575 ( 5.331 -5.516 0.426) 7.683 9.766 ( 0.066 2.376 1.312) 2.715 9.988 ( 2.052 -17.440 13.339) 22.051 10.201 ( -4.558 -9.814 -11.838) 16.038 10.476 ( 1.250 -9.890 4.827) 11.076 10.601 ( -2.829 -9.376 13.629) 16.783 11.135 ( -1.762 10.901 -22.031) 24.644 11.388 ( -7.184 6.791 -20.366) 22.638 11.648 ( -6.298 6.360 7.547) 11.708 11.783 ( -3.848 4.627 7.828) 9.874 12.135 ( 5.399 -0.822 0.869) 5.530 12.193 ( -1.816 4.535 6.510) 8.139 12.254 ( 4.762 1.107 3.199) 5.843 12.320 ( 4.863 -3.374 0.684) 5.958 12.437 ( 7.789 0.842 6.538) 10.203 12.578 ( 8.978 -0.315 2.221) 9.254 12.971 ( -2.682 0.742 2.230) 3.566 13.189 ( -4.419 -3.639 0.798) 5.780 13.334 ( -3.320 1.630 2.984) 4.752 13.595 ( -13.016 12.175 -3.580) 18.178 14.277 ( -2.030 -5.244 -2.602) 6.197 14.337 ( -1.079 -3.119 -4.238) 5.372 14.486 ( 1.237 1.964 -1.231) 2.627 14.561 ( -1.052 -2.381 -3.478) 4.344 14.792 ( -2.466 -0.757 6.454) 6.951 14.905 ( -0.425 6.297 -3.015) 6.995 15.112 ( -6.365 1.538 10.345) 12.244 15.321 ( -9.125 0.860 6.178) 11.053 15.523 ( -1.719 -1.347 2.383) 3.232 15.676 ( -8.409 2.861 7.018) 11.320 16.028 ( -8.217 -1.724 -0.103) 8.397 16.205 ( -25.129 2.247 -15.673) 29.701 17.971 ( 6.401 5.916 6.428) 10.830 18.155 ( 4.686 2.645 -8.070) 9.700 18.311 ( 8.479 -0.891 1.940) 8.744 18.365 ( 9.540 0.127 -2.638) 9.899 18.731 ( -0.896 2.106 -0.210) 2.298 18.788 ( 0.375 0.745 -0.170) 0.851 19.287 ( 1.929 -7.519 -1.500) 7.906 19.380 ( 2.000 4.454 -0.229) 4.888 19.441 ( 2.458 -8.940 -2.392) 9.575 19.499 ( 0.166 -2.911 -0.781) 3.018 19.632 ( -2.016 -1.831 2.227) 3.518 19.923 ( 0.476 -7.016 -1.448) 7.179 20.244 ( 3.891 1.956 0.029) 4.355 20.319 ( 5.795 -1.043 -0.509) 5.910 20.382 ( 5.191 1.274 1.861) 5.659 20.423 ( 11.060 0.095 -1.593) 11.175 20.476 ( 10.524 0.391 0.149) 10.533 20.612 ( 15.443 -3.139 -3.517) 16.146 20.734 ( 18.093 4.253 0.215) 18.587 21.316 ( 47.044 -25.099 -17.404) 56.089 24.460 ( -1.416 1.991 2.111) 3.229 24.537 ( -1.600 1.497 -1.143) 2.471 24.591 ( -0.996 0.588 1.597) 1.972 24.627 ( -3.066 -0.006 -1.356) 3.353 28.586 ( 0.481 6.684 0.530) 6.722 28.651 ( -0.039 9.209 -2.636) 9.579 29.100 ( -0.025 -7.545 6.193) 9.761 29.230 ( -1.676 -8.616 -2.097) 9.024 29.461 ( -2.462 2.794 0.981) 3.851 29.571 ( -0.303 1.315 -1.680) 2.155 29.605 ( -2.741 1.138 0.653) 3.039 29.670 ( -0.804 1.528 -0.256) 1.745 32.972 ( 2.938 1.800 -0.034) 3.445 33.000 ( 3.222 0.374 -1.087) 3.421 33.114 ( 5.608 -2.540 -0.121) 6.158 33.120 ( 6.840 -3.138 -1.269) 7.632 36.033 ( -2.935 16.935 4.831) 17.853 36.388 ( -5.064 20.680 -14.426) 25.719 37.565 ( -25.236 -13.270 23.199) 36.758 38.062 ( -5.759 -22.268 -3.298) 23.236 38.163 ( -6.545 6.165 -1.233) 9.076 38.316 ( -0.495 13.269 -2.701) 13.550 38.870 ( -7.482 8.102 2.558) 11.321 39.294 ( 1.691 -5.430 2.372) 6.162 39.385 ( -9.642 0.160 2.033) 9.856 39.710 ( -2.375 6.053 -2.363) 6.918 39.946 ( -2.202 1.483 0.998) 2.837 40.006 ( -1.062 0.878 1.833) 2.293 41.144 ( -21.563 38.256 -12.618) 45.691 41.722 ( -3.216 4.299 -21.839) 22.489 42.708 ( -13.843 3.674 16.666) 21.974 43.209 ( -14.098 -4.311 -8.711) 17.124 44.475 ( -31.132 -5.510 26.554) 41.288 44.638 ( -8.121 -7.469 6.290) 12.701 45.284 ( -12.198 2.193 2.992) 12.750 45.395 ( -17.902 -0.728 -4.997) 18.600 70.316 ( -5.265 16.972 8.171) 19.559 70.974 ( -12.193 23.236 -34.192) 43.101 72.084 ( -43.446 7.896 17.730) 47.584 72.635 ( -17.527 -4.003 12.537) 21.918 105.269 ( -0.613 1.254 3.546) 3.810 105.347 ( -2.202 0.124 -1.819) 2.859 105.554 ( -5.128 -3.000 1.768) 6.199 105.560 ( -6.050 -2.144 -1.182) 6.526 ======================= Grid point 103 (46/102) ======================= q-point: ( 0.12 0.20 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 Number of triplets: 160 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.198 ( 25.303 22.731 29.136) 44.786 2.501 ( 26.119 18.354 35.387) 47.658 3.068 ( 38.727 2.170 -21.536) 44.366 3.401 ( 35.099 25.354 29.217) 52.234 3.466 ( 24.090 -3.104 -9.209) 25.976 3.632 ( 25.289 4.222 -16.562) 30.523 3.946 ( 22.492 -6.728 -0.609) 23.484 4.071 ( 17.323 -17.857 -1.293) 24.913 4.272 ( 23.009 0.938 12.125) 26.025 4.595 ( 22.593 -9.224 8.468) 25.831 4.613 ( 19.159 -7.293 -4.953) 21.090 4.906 ( 19.877 4.978 -6.273) 21.429 5.052 ( 19.764 4.034 -6.620) 21.230 5.196 ( 18.705 1.713 -1.129) 18.817 5.445 ( 9.133 6.230 9.382) 14.499 5.497 ( 19.374 -1.140 0.141) 19.408 5.813 ( 10.875 4.070 -27.646) 29.986 5.893 ( 4.669 -8.210 -11.962) 15.241 6.045 ( 19.008 -0.813 -5.327) 19.757 6.103 ( 20.719 -1.274 2.749) 20.939 6.150 ( 27.565 -4.262 1.611) 27.939 6.393 ( 1.966 10.444 -14.293) 17.811 6.446 ( 11.495 4.295 -3.915) 12.880 6.607 ( 5.678 3.670 -1.390) 6.902 6.629 ( 7.341 0.784 -0.591) 7.407 6.878 ( 0.767 -6.261 -6.030) 8.726 6.991 ( 8.986 -10.636 0.477) 13.931 7.117 ( 8.179 0.818 4.610) 9.425 7.269 ( 19.249 -2.708 0.920) 19.460 7.486 ( 14.804 2.539 -0.981) 15.053 7.511 ( 12.993 5.057 8.174) 16.162 7.559 ( 6.270 0.099 2.078) 6.606 7.702 ( 12.490 -3.461 2.433) 13.187 7.735 ( 13.002 3.808 1.218) 13.603 7.815 ( 12.265 0.422 -3.284) 12.705 7.920 ( 2.688 -0.131 -2.863) 3.929 8.046 ( 13.243 -5.328 -2.272) 14.454 8.157 ( 9.051 -3.061 3.969) 10.346 8.212 ( 11.574 -5.379 -3.423) 13.213 8.290 ( 9.216 -0.055 6.600) 11.336 8.543 ( 5.093 -1.449 12.561) 13.631 8.656 ( 1.480 1.534 -1.908) 2.861 8.866 ( 1.776 -1.109 -4.121) 4.623 8.981 ( 0.408 11.879 -0.324) 11.890 9.038 ( 2.988 2.666 -7.228) 8.263 9.257 ( 5.443 4.040 -0.994) 6.851 9.359 ( 2.996 -6.757 6.380) 9.764 9.496 ( 2.121 3.334 6.017) 7.199 9.734 ( 3.997 -3.532 -1.515) 5.544 9.811 ( 6.420 -9.413 8.015) 13.931 10.029 ( -0.856 -20.914 -1.960) 21.023 10.228 ( 10.545 6.665 2.350) 12.694 10.424 ( -6.472 -10.009 4.475) 12.731 10.644 ( 4.853 -7.263 9.724) 13.071 11.038 ( -4.241 8.569 -17.073) 19.568 11.182 ( -7.833 8.761 -18.516) 21.931 11.507 ( -8.309 10.885 4.099) 14.294 11.716 ( -4.169 3.307 5.978) 8.003 12.154 ( -2.944 3.362 7.355) 8.606 12.257 ( 4.618 -1.535 0.728) 4.920 12.301 ( -0.926 3.320 6.115) 7.019 12.419 ( 3.268 -1.406 -0.087) 3.559 12.569 ( 2.786 -1.917 2.914) 4.464 12.791 ( 9.531 0.488 -3.310) 10.101 12.942 ( 2.170 -4.113 -0.420) 4.669 13.085 ( -5.810 -3.121 3.730) 7.576 13.289 ( -1.605 1.577 5.969) 6.379 13.445 ( 0.353 6.194 -2.885) 6.842 14.234 ( -1.850 -4.094 -1.861) 4.863 14.314 ( -0.470 -3.215 -1.810) 3.720 14.470 ( -2.494 3.892 -0.729) 4.680 14.559 ( 1.622 -5.851 -4.222) 7.395 14.737 ( -3.831 0.199 4.914) 6.234 14.886 ( -0.961 4.926 -2.335) 5.535 15.013 ( -5.124 0.902 5.408) 7.505 15.119 ( -11.343 6.070 8.080) 15.192 15.471 ( -4.152 -3.342 3.877) 6.590 15.530 ( -7.710 -0.132 1.370) 7.832 15.729 ( -18.101 0.814 -14.157) 22.994 15.828 ( -10.574 -3.022 -3.191) 11.451 18.052 ( -0.177 6.952 3.453) 7.764 18.183 ( -0.680 9.325 -3.855) 10.114 18.457 ( 5.390 0.741 3.909) 6.699 18.495 ( 5.258 0.100 -3.836) 6.510 18.709 ( -0.593 0.387 2.410) 2.512 18.824 ( 1.953 0.671 -0.744) 2.195 19.278 ( -2.179 -9.465 -5.301) 11.065 19.433 ( 2.437 -0.748 -0.580) 2.615 19.465 ( -1.584 -4.961 1.921) 5.551 19.528 ( 6.731 4.350 2.013) 8.263 19.706 ( 7.658 -4.703 -1.407) 9.097 19.973 ( 4.195 -6.244 0.389) 7.532 20.374 ( 9.529 1.207 -0.236) 9.608 20.493 ( 11.166 -1.621 -0.765) 11.309 20.564 ( 12.034 1.568 1.127) 12.188 20.667 ( 13.273 -1.630 4.014) 13.962 20.816 ( 21.406 1.243 -3.052) 21.658 21.041 ( 26.296 -5.474 -0.216) 26.860 21.145 ( 21.846 6.376 -0.541) 22.764 22.027 ( 27.682 -25.853 -19.884) 42.779 24.430 ( -1.833 1.946 2.043) 3.365 24.493 ( -2.535 1.743 -1.301) 3.341 24.552 ( -3.226 -0.036 -0.270) 3.238 24.572 ( -1.488 0.156 0.224) 1.513 28.604 ( 1.301 6.483 -0.002) 6.612 28.659 ( 1.158 7.371 -0.258) 7.466 29.102 ( -0.968 -6.511 6.467) 9.228 29.190 ( -1.868 -7.738 -2.803) 8.439 29.408 ( -2.935 3.255 0.908) 4.476 29.547 ( -2.076 3.477 -0.757) 4.120 29.559 ( -1.615 -2.017 -0.215) 2.593 29.641 ( -1.985 1.229 -0.191) 2.342 33.062 ( 5.783 1.745 0.172) 6.042 33.086 ( 5.529 0.911 -0.838) 5.666 33.241 ( 7.571 -2.894 -0.077) 8.106 33.285 ( 8.542 -5.891 -1.706) 10.515 35.968 ( -4.276 16.044 3.460) 16.960 36.230 ( -7.622 19.119 -8.901) 22.425 37.107 ( -22.556 -3.454 20.064) 30.385 37.804 ( -18.542 -23.230 -4.842) 30.115 38.038 ( -5.222 12.750 -0.538) 13.788 38.270 ( -3.519 11.457 0.120) 11.986 38.796 ( -1.363 4.853 -1.373) 5.224 39.185 ( -8.261 -5.371 -1.104) 9.915 39.302 ( -3.885 -8.795 6.730) 11.736 39.609 ( -6.961 6.375 -0.708) 9.465 39.894 ( -3.403 1.054 -0.079) 3.563 39.951 ( -4.777 1.104 1.138) 5.034 40.752 ( -16.579 21.434 0.861) 27.111 41.543 ( -9.807 1.206 -19.244) 21.633 42.353 ( -24.201 3.530 18.095) 30.424 42.814 ( -23.033 -4.801 -5.979) 24.276 43.993 ( -21.291 4.530 21.945) 30.910 44.392 ( -15.837 -5.615 -4.499) 17.395 44.976 ( -21.104 0.804 -1.290) 21.159 45.007 ( -15.433 0.049 -1.295) 15.487 70.181 ( -9.645 13.769 7.325) 18.337 70.591 ( -18.177 19.964 -19.162) 33.108 71.436 ( -28.372 -1.196 8.292) 29.583 72.111 ( -34.833 -8.130 10.950) 37.408 105.250 ( -2.062 1.194 3.437) 4.183 105.281 ( -3.659 0.986 -3.068) 4.876 105.416 ( -7.040 -0.855 -3.881) 8.085 105.438 ( -6.612 -2.119 4.607) 8.333 ======================= Grid point 104 (47/102) ======================= q-point: ( 0.19 0.20 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 Number of triplets: 160 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.809 ( 29.788 16.945 24.102) 41.897 3.039 ( 21.427 16.962 38.873) 47.518 3.703 ( 29.219 -0.535 -19.428) 35.092 3.865 ( 22.903 4.249 -26.420) 35.222 4.137 ( 30.459 1.578 5.074) 30.919 4.188 ( 26.965 -2.521 -1.424) 27.120 4.328 ( 16.964 -17.243 8.850) 25.757 4.522 ( 22.167 -5.744 3.732) 23.201 4.739 ( 21.300 -2.614 -0.540) 21.467 5.007 ( 24.737 -4.502 5.177) 25.671 5.120 ( 21.541 7.021 -1.914) 22.737 5.236 ( 14.881 -0.407 2.137) 15.039 5.513 ( 16.867 5.150 8.412) 19.539 5.580 ( 27.352 -1.690 -5.378) 27.927 5.729 ( 17.396 -4.212 7.393) 19.365 5.876 ( 14.602 2.464 -17.595) 22.997 5.950 ( 16.204 1.720 -25.076) 29.905 6.071 ( 13.190 -1.264 -0.677) 13.267 6.291 ( 6.730 1.276 -9.942) 12.073 6.356 ( 7.722 4.446 -6.049) 10.770 6.526 ( 11.679 11.667 -5.201) 17.308 6.622 ( 11.818 0.787 6.166) 13.353 6.748 ( 19.772 2.703 2.556) 20.119 6.862 ( 4.470 0.539 -5.689) 7.255 6.926 ( 13.515 -0.087 2.759) 13.794 7.020 ( 29.918 -2.698 1.035) 30.057 7.171 ( 13.336 6.980 -0.698) 15.069 7.301 ( 12.012 -6.088 1.395) 13.539 7.605 ( 7.196 -5.682 1.590) 9.306 7.646 ( 16.404 -0.535 -0.060) 16.413 7.741 ( 7.673 2.783 6.420) 10.384 7.797 ( 8.740 9.837 -6.320) 14.598 7.921 ( 11.329 -5.139 4.467) 13.218 7.976 ( 4.974 -7.544 -0.211) 9.038 8.149 ( 22.909 -1.528 5.591) 23.631 8.155 ( 19.474 -2.170 -3.583) 19.919 8.274 ( 9.802 -7.006 2.028) 12.218 8.430 ( 21.037 8.639 1.050) 22.766 8.487 ( 10.999 -1.551 2.615) 11.412 8.568 ( 11.518 0.740 2.004) 11.714 8.707 ( 8.723 -7.091 -1.109) 11.296 8.752 ( 13.103 2.418 0.495) 13.334 8.889 ( 4.712 -1.034 -2.465) 5.418 9.061 ( 7.139 6.920 -4.536) 10.929 9.084 ( 4.852 3.033 0.233) 5.727 9.357 ( 4.732 4.054 -3.257) 7.031 9.413 ( 1.998 -9.582 7.432) 12.289 9.551 ( 1.742 2.443 11.417) 11.805 9.764 ( 0.576 -1.300 4.283) 4.513 9.826 ( -6.151 -13.267 -4.177) 15.209 10.112 ( 4.172 -5.659 6.859) 9.822 10.274 ( 0.556 -10.420 -0.562) 10.450 10.557 ( 13.277 3.125 0.595) 13.653 10.796 ( 8.743 -4.036 4.088) 10.461 10.871 ( -7.365 10.074 -14.805) 19.363 11.069 ( -0.639 4.649 -6.114) 7.708 11.362 ( -5.665 12.173 -0.020) 13.427 11.647 ( -3.245 2.272 1.467) 4.224 12.101 ( -3.630 1.446 5.794) 6.988 12.262 ( -3.368 4.451 3.306) 6.487 12.307 ( -0.276 -1.378 1.729) 2.228 12.398 ( -3.647 0.625 -0.070) 3.701 12.558 ( -3.681 -4.878 0.159) 6.113 12.823 ( -8.548 -4.758 -0.231) 9.786 12.994 ( 7.517 1.581 -2.419) 8.054 13.118 ( 5.133 1.035 1.252) 5.384 13.349 ( 7.599 0.479 6.015) 9.703 13.568 ( 9.787 -2.615 -2.965) 10.555 14.192 ( -2.010 -3.386 -1.618) 4.257 14.312 ( 0.355 -3.406 0.201) 3.430 14.411 ( -2.756 3.357 -0.382) 4.360 14.587 ( 1.682 -6.781 -3.200) 7.685 14.671 ( -3.193 -0.727 2.071) 3.875 14.851 ( -2.270 2.094 -2.723) 4.118 14.920 ( -7.497 4.799 4.944) 10.182 14.941 ( -5.241 2.384 6.968) 9.039 15.326 ( -10.865 0.789 -6.926) 12.909 15.380 ( -6.029 -2.151 5.662) 8.546 15.472 ( -6.480 -1.776 -6.110) 9.082 15.613 ( -9.599 -5.650 -4.334) 11.952 18.008 ( -3.558 8.582 -0.154) 9.291 18.119 ( -4.308 13.291 -0.388) 13.978 18.551 ( 3.227 -1.191 1.551) 3.773 18.566 ( 1.949 -0.791 -0.387) 2.139 18.715 ( 0.460 0.616 2.606) 2.717 18.846 ( 0.350 2.341 -0.799) 2.498 19.211 ( -3.037 -7.989 -5.136) 9.971 19.359 ( -5.178 -6.344 3.330) 8.840 19.596 ( 9.709 2.593 -2.873) 10.452 19.698 ( 9.270 3.637 2.108) 10.179 19.871 ( 8.523 -3.999 -0.472) 9.427 20.072 ( 5.122 -4.784 0.830) 7.058 20.615 ( 14.096 1.069 -0.262) 14.139 20.750 ( 14.328 -1.962 -0.953) 14.493 20.846 ( 15.435 1.398 0.826) 15.520 20.962 ( 14.938 -1.936 3.561) 15.478 21.269 ( 23.596 1.877 -2.978) 23.857 21.561 ( 21.122 4.169 2.940) 21.729 21.607 ( 26.474 -3.965 0.122) 26.769 22.401 ( 14.701 -17.345 -12.784) 26.085 24.402 ( -1.284 1.061 1.464) 2.217 24.432 ( -3.122 1.644 -0.111) 3.530 24.504 ( -1.366 0.208 -0.366) 1.430 24.548 ( -0.811 -0.234 -1.218) 1.482 28.639 ( 2.221 5.667 -0.150) 6.088 28.694 ( 2.203 5.563 0.595) 6.013 29.091 ( -1.326 -5.728 5.586) 8.110 29.143 ( -2.253 -6.602 -2.824) 7.525 29.351 ( -2.914 3.398 1.254) 4.649 29.500 ( -2.312 1.335 -0.240) 2.681 29.526 ( -1.731 -0.910 -1.052) 2.221 29.593 ( -2.622 0.851 -0.313) 2.775 33.196 ( 7.317 1.774 0.147) 7.531 33.212 ( 6.957 1.494 -0.514) 7.135 33.405 ( 8.477 -3.624 0.101) 9.220 33.446 ( 7.820 -5.416 -1.049) 9.570 35.885 ( -4.389 13.869 1.896) 14.670 36.067 ( -6.868 15.420 -4.416) 17.448 36.757 ( -16.338 -3.584 13.705) 21.624 37.378 ( -21.524 -17.013 -6.110) 28.108 37.943 ( -4.256 11.976 0.259) 12.713 38.174 ( -6.051 10.476 0.214) 12.100 38.769 ( -1.292 0.473 -2.006) 2.432 39.036 ( -6.448 -6.673 1.076) 9.342 39.198 ( -7.190 -11.294 3.404) 13.815 39.446 ( -8.858 5.678 -0.068) 10.522 39.791 ( -7.259 -3.190 -2.078) 8.197 39.837 ( -6.131 4.714 1.887) 7.961 40.463 ( -13.030 11.543 3.155) 17.692 41.273 ( -12.873 -2.389 -15.835) 20.546 41.863 ( -27.275 4.166 15.575) 31.684 42.292 ( -27.287 -4.177 -3.735) 27.856 43.684 ( -14.366 6.226 14.649) 21.441 44.033 ( -17.016 -0.854 -12.877) 21.357 44.581 ( -18.681 -1.209 5.380) 19.478 44.676 ( -16.667 -2.215 -3.101) 17.097 69.973 ( -12.217 9.968 6.006) 16.873 70.198 ( -17.820 13.085 -10.871) 24.636 70.899 ( -26.602 -3.988 1.684) 26.952 71.381 ( -37.993 -8.518 6.740) 39.516 105.194 ( -4.187 0.941 -3.078) 5.281 105.203 ( -3.167 1.036 2.999) 4.483 105.271 ( -6.527 -0.565 -2.985) 7.199 105.319 ( -6.056 -1.405 3.302) 7.040 ======================= Grid point 105 (48/102) ======================= q-point: ( 0.25 0.20 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 Number of triplets: 160 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.471 ( 31.126 10.746 19.101) 38.068 3.551 ( 22.343 12.716 32.524) 41.457 4.186 ( 22.230 0.500 -15.781) 27.266 4.289 ( 25.919 2.500 -27.484) 37.861 4.597 ( 15.794 -12.691 2.584) 20.425 4.654 ( 20.882 -9.435 2.122) 23.013 4.713 ( 18.598 -8.303 2.166) 20.482 4.876 ( 14.738 -10.145 -0.685) 17.906 5.139 ( 17.276 4.264 5.150) 18.524 5.388 ( 9.980 5.799 -3.308) 12.007 5.475 ( 18.742 -2.554 -4.251) 19.386 5.564 ( 14.773 0.163 5.225) 15.670 5.846 ( 13.097 1.341 -0.399) 13.172 5.960 ( 11.723 -1.545 -4.159) 12.535 6.089 ( 15.167 -3.328 3.121) 15.838 6.147 ( 12.719 0.734 -1.265) 12.803 6.235 ( 4.092 2.649 -0.324) 4.886 6.343 ( 23.601 10.997 -18.049) 31.681 6.447 ( 12.680 3.428 -12.185) 17.917 6.625 ( 17.532 1.563 -2.673) 17.803 6.755 ( 12.556 -3.644 2.298) 13.275 6.860 ( 16.093 3.910 2.013) 16.683 6.892 ( 3.197 14.729 2.872) 15.343 7.047 ( 5.651 9.696 -5.437) 12.470 7.177 ( 13.151 6.647 6.060) 15.933 7.347 ( 8.518 -2.864 2.120) 9.233 7.419 ( 1.675 1.673 -1.741) 2.939 7.696 ( 14.540 -1.689 -0.233) 14.639 7.848 ( 6.900 -4.736 8.525) 11.947 7.912 ( 19.180 0.951 -5.722) 20.038 7.958 ( 13.324 0.471 -2.549) 13.573 8.062 ( 23.432 -4.184 -3.600) 24.073 8.084 ( 8.889 -2.843 2.334) 9.620 8.135 ( 8.632 -4.159 1.123) 9.647 8.440 ( 10.906 -0.978 6.465) 12.716 8.455 ( 0.993 -2.131 4.213) 4.824 8.577 ( 15.412 -5.027 -3.825) 16.656 8.674 ( 16.823 1.269 9.536) 19.379 8.733 ( 7.765 -1.579 -5.663) 9.740 8.891 ( 15.611 -2.071 -1.362) 15.807 8.938 ( 12.841 5.030 1.160) 13.840 9.010 ( 10.770 -1.709 -0.454) 10.914 9.128 ( 14.474 -0.714 -2.096) 14.642 9.230 ( 16.554 0.262 -4.706) 17.212 9.306 ( 12.865 -1.322 2.652) 13.202 9.439 ( 4.040 1.626 2.687) 5.117 9.467 ( 3.066 -8.563 2.166) 9.350 9.654 ( -5.606 -5.663 1.737) 8.156 9.689 ( 9.445 1.898 6.033) 11.367 9.831 ( 7.382 3.354 7.016) 10.723 10.118 ( -0.500 -1.476 7.828) 7.981 10.417 ( 6.818 -6.962 -1.145) 9.811 10.697 ( 4.215 5.609 -9.997) 12.213 10.778 ( 2.551 5.698 -11.633) 13.202 11.008 ( 9.045 -1.066 1.760) 9.276 11.103 ( 3.122 0.955 1.809) 3.732 11.336 ( 4.551 7.872 2.226) 9.361 11.601 ( -1.082 1.480 -2.534) 3.128 12.039 ( -3.128 -0.027 2.659) 4.106 12.184 ( -4.634 4.378 1.517) 6.553 12.265 ( -2.986 -1.217 0.974) 3.368 12.363 ( 0.675 0.286 -0.166) 0.752 12.453 ( -5.313 -2.771 -0.975) 6.071 12.639 ( -7.761 -8.582 0.493) 11.581 13.145 ( 5.961 4.983 -0.201) 7.771 13.209 ( 4.261 5.286 0.546) 6.812 13.542 ( 8.862 -1.925 1.199) 9.148 13.746 ( 7.165 -5.234 -0.929) 8.922 14.148 ( -1.914 -2.711 -1.575) 3.673 14.318 ( -0.634 -1.831 3.640) 4.123 14.372 ( -0.673 -0.244 -1.210) 1.406 14.605 ( 0.242 -7.097 0.372) 7.111 14.630 ( -0.623 0.657 -3.408) 3.526 14.780 ( -4.574 3.830 1.122) 6.070 14.792 ( -4.532 -1.221 1.625) 4.967 14.895 ( -1.872 1.220 5.590) 6.020 15.130 ( -7.282 1.343 -5.525) 9.239 15.270 ( -5.765 -0.420 4.790) 7.507 15.354 ( -5.419 -5.873 -2.693) 8.433 15.448 ( -5.311 -4.322 -5.672) 8.891 17.934 ( -3.316 9.970 -1.516) 10.615 18.034 ( -3.980 14.116 1.152) 14.712 18.570 ( -0.486 -4.833 -0.867) 4.934 18.598 ( 0.564 0.181 2.937) 2.996 18.730 ( 0.459 1.681 0.940) 1.980 18.839 ( -0.651 2.382 -0.873) 2.619 19.139 ( -3.229 -6.839 -4.307) 8.704 19.263 ( -5.064 -5.327 3.045) 7.955 19.800 ( 10.570 2.390 -2.270) 11.072 19.889 ( 8.965 2.705 1.288) 9.452 20.036 ( 7.844 -2.480 0.113) 8.227 20.169 ( 4.283 -3.201 0.875) 5.419 20.920 ( 15.956 0.998 0.077) 15.987 21.049 ( 15.393 -1.955 -0.683) 15.532 21.167 ( 16.016 1.109 0.408) 16.060 21.267 ( 14.576 -1.606 2.523) 14.879 21.721 ( 21.625 2.770 -2.800) 21.981 21.939 ( 16.539 6.402 1.516) 17.799 22.114 ( 22.880 -6.476 1.557) 23.830 22.607 ( 8.586 -10.776 -6.156) 15.091 24.365 ( -2.409 0.823 0.958) 2.720 24.402 ( -0.003 0.298 1.362) 1.394 24.492 ( 0.117 0.595 -0.263) 0.661 24.538 ( 0.336 -0.266 -2.827) 2.859 28.691 ( 2.986 4.581 0.041) 5.468 28.746 ( 2.859 3.938 0.560) 4.898 29.071 ( -1.780 -4.896 3.789) 6.442 29.090 ( -2.421 -5.101 -2.099) 6.025 29.300 ( -2.397 3.280 1.933) 4.499 29.455 ( -2.141 -0.242 -0.384) 2.189 29.485 ( -1.996 -0.124 -1.341) 2.408 29.538 ( -2.725 0.533 -0.387) 2.804 33.346 ( 7.432 1.831 -0.052) 7.654 33.355 ( 7.190 2.041 -0.113) 7.475 33.571 ( 7.975 -3.825 0.120) 8.845 33.593 ( 6.968 -4.308 -0.507) 8.208 35.807 ( -3.497 10.913 0.798) 11.487 35.944 ( -4.722 11.238 -1.931) 12.342 36.494 ( -12.573 -4.467 9.060) 16.129 36.951 ( -19.353 -12.531 -5.816) 23.778 37.869 ( -3.301 11.153 0.823) 11.661 38.036 ( -7.405 11.060 -0.541) 13.321 38.736 ( -1.548 -2.401 -1.610) 3.280 38.929 ( -4.826 -8.408 1.872) 9.873 39.051 ( -7.260 -10.354 0.983) 12.684 39.266 ( -8.960 4.153 0.394) 9.883 39.608 ( -9.709 -3.283 -3.451) 10.814 39.713 ( -7.016 4.761 2.580) 8.863 40.238 ( -10.006 6.076 2.411) 11.952 40.982 ( -12.833 -5.015 -11.879) 18.192 41.358 ( -25.502 5.164 11.650) 28.509 41.736 ( -26.956 -3.331 -2.178) 27.249 43.456 ( -11.281 6.636 10.355) 16.689 43.688 ( -14.371 3.197 -12.867) 19.552 44.247 ( -16.029 -3.456 7.108) 17.871 44.343 ( -15.567 -3.783 -3.791) 16.462 69.730 ( -12.809 6.694 4.551) 15.152 69.837 ( -16.119 8.328 -6.602) 19.307 70.390 ( -23.876 -4.011 -0.374) 24.213 70.671 ( -33.123 -6.875 3.700) 34.031 105.104 ( -4.187 0.588 -2.430) 4.877 105.139 ( -3.873 0.816 2.197) 4.527 105.147 ( -5.221 -0.417 -1.636) 5.487 105.211 ( -5.247 -0.879 1.876) 5.641 ======================= Grid point 106 (49/102) ======================= q-point: ( 0.31 0.20 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 Number of triplets: 160 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 4.065 ( 22.754 8.072 24.916) 34.695 4.109 ( 28.348 6.137 12.090) 31.423 4.536 ( 17.308 1.879 -14.735) 22.808 4.775 ( 25.557 0.076 -20.311) 32.645 4.859 ( 10.268 -12.330 4.057) 16.551 5.005 ( 10.803 -10.557 -1.307) 15.161 5.046 ( 17.388 -8.576 3.772) 19.751 5.176 ( 16.132 -6.472 -0.966) 17.409 5.454 ( 13.696 3.730 4.254) 14.819 5.562 ( 7.985 3.685 -0.942) 8.845 5.739 ( 11.350 -4.259 -8.607) 14.867 5.877 ( 14.728 0.370 -3.025) 15.040 5.976 ( 3.480 -0.327 -4.905) 6.023 6.128 ( 4.234 -0.751 -1.593) 4.586 6.229 ( 4.321 9.009 -1.577) 10.116 6.337 ( 8.066 1.512 -4.367) 9.296 6.422 ( 5.401 -0.432 4.041) 6.759 6.556 ( 11.359 1.682 -2.261) 11.703 6.728 ( 8.676 7.913 1.556) 11.846 6.857 ( 1.283 11.098 -0.388) 11.178 6.955 ( 1.580 8.471 -5.146) 10.037 7.029 ( 18.213 2.024 1.002) 18.352 7.212 ( 12.195 5.604 -1.297) 13.483 7.303 ( 9.431 4.641 7.580) 12.959 7.343 ( 9.102 5.916 -4.578) 11.782 7.443 ( 5.556 0.695 -2.428) 6.103 7.497 ( 10.182 -0.925 1.325) 10.310 7.740 ( -1.858 -4.065 0.450) 4.492 7.861 ( -4.287 -0.994 9.155) 10.158 8.145 ( 0.123 -3.612 -6.749) 7.655 8.216 ( 11.383 -4.150 -5.889) 13.471 8.347 ( 12.543 -1.328 4.486) 13.387 8.367 ( 10.653 -4.523 -4.097) 12.277 8.396 ( 8.417 -2.054 3.628) 9.393 8.553 ( 3.344 1.454 1.979) 4.149 8.702 ( 15.567 -5.886 2.994) 16.910 8.750 ( 2.802 -2.301 -2.233) 4.258 8.814 ( 1.350 -2.510 -4.532) 5.354 9.003 ( 11.207 -0.008 8.494) 14.063 9.014 ( 1.069 -10.033 4.743) 11.149 9.076 ( 6.265 7.310 7.171) 12.004 9.246 ( 6.865 -1.997 -1.587) 7.324 9.357 ( 13.718 1.041 -10.147) 17.095 9.462 ( 5.472 -0.176 0.011) 5.475 9.566 ( 12.102 1.798 1.920) 12.384 9.602 ( 10.038 -0.319 2.380) 10.321 9.699 ( 23.415 -2.178 1.736) 23.580 9.793 ( 16.911 -1.639 4.942) 17.695 9.978 ( 15.044 2.462 4.906) 16.015 10.087 ( 13.732 2.789 7.533) 15.909 10.153 ( 2.539 2.742 7.261) 8.167 10.491 ( 4.543 1.361 -5.606) 7.343 10.811 ( 7.498 0.660 -13.835) 15.751 10.870 ( 7.081 2.711 -2.811) 8.087 11.136 ( 5.207 -0.490 -5.524) 7.607 11.201 ( 7.757 -2.310 0.299) 8.099 11.512 ( 9.123 0.709 5.233) 10.541 11.600 ( 1.555 0.527 -0.851) 1.849 11.998 ( -1.415 0.180 0.983) 1.733 12.113 ( -1.085 1.451 -1.351) 2.261 12.237 ( 0.618 -1.010 -0.062) 1.186 12.393 ( 0.463 -2.032 -2.251) 3.068 12.423 ( 5.441 0.730 1.345) 5.652 12.560 ( 0.677 -6.186 -0.357) 6.233 13.199 ( -0.645 8.781 5.363) 10.310 13.287 ( 3.074 4.918 -4.481) 7.329 13.669 ( 3.366 -2.234 -0.825) 4.123 13.826 ( 0.545 -4.095 1.466) 4.383 14.111 ( -1.586 -1.907 -1.260) 2.782 14.295 ( -2.171 1.390 4.833) 5.477 14.375 ( 0.829 -5.658 -1.877) 6.019 14.613 ( 0.739 -0.812 -3.076) 3.266 14.619 ( -0.152 -0.182 1.720) 1.736 14.712 ( -2.145 -0.387 0.949) 2.378 14.732 ( -1.574 -3.537 -0.899) 3.974 14.877 ( -1.249 0.001 6.262) 6.385 14.999 ( -5.121 -0.658 -2.943) 5.943 15.179 ( -4.038 2.015 2.685) 5.251 15.240 ( -5.020 -9.215 -2.502) 10.787 15.369 ( -2.288 -2.317 -4.589) 5.627 17.878 ( -1.849 10.642 -1.553) 10.913 17.968 ( -2.859 14.254 1.298) 14.595 18.553 ( -0.855 -4.884 -0.162) 4.960 18.598 ( -0.772 -0.331 1.900) 2.078 18.734 ( -0.128 2.344 0.199) 2.356 18.825 ( -0.311 0.331 -0.836) 0.952 19.061 ( -3.720 -5.947 -3.729) 7.944 19.170 ( -4.849 -4.863 3.072) 7.523 19.991 ( 8.613 2.136 -1.673) 9.030 20.051 ( 6.912 1.916 0.788) 7.216 20.177 ( 6.106 -1.504 0.079) 6.289 20.244 ( 2.943 -1.903 1.023) 3.651 21.236 ( 15.116 0.955 0.545) 15.156 21.350 ( 14.437 -1.740 -0.003) 14.542 21.473 ( 14.240 0.784 -0.097) 14.262 21.546 ( 12.647 -1.094 1.441) 12.776 22.105 ( 17.037 3.485 -2.695) 17.597 22.227 ( 11.882 5.612 1.713) 13.252 22.516 ( 17.076 -5.919 -0.736) 18.087 22.736 ( 5.236 -6.728 -1.393) 8.639 24.330 ( -1.364 0.967 2.232) 2.789 24.418 ( 1.242 -1.240 1.082) 2.062 24.504 ( 1.024 0.862 -0.375) 1.390 24.549 ( 1.440 -0.057 -3.655) 3.929 28.756 ( 3.334 3.381 0.353) 4.761 28.808 ( 3.202 2.474 0.181) 4.051 29.036 ( -2.028 -3.521 0.725) 4.128 29.039 ( -2.377 -3.491 0.002) 4.223 29.265 ( -1.589 2.620 2.617) 4.029 29.412 ( -2.151 -1.462 -0.290) 2.617 29.442 ( -1.949 0.664 -1.772) 2.716 29.486 ( -2.300 0.269 -0.416) 2.353 33.484 ( 6.195 2.117 -0.093) 6.547 33.492 ( 6.330 2.373 0.037) 6.760 33.715 ( 5.972 -3.638 0.386) 7.003 33.724 ( 6.460 -3.304 -0.549) 7.276 35.754 ( -1.814 7.812 0.325) 8.027 35.871 ( -2.226 7.488 -0.802) 7.853 36.287 ( -9.789 -4.573 6.197) 12.455 36.591 ( -15.384 -8.941 -4.848) 18.442 37.809 ( -3.021 10.297 0.078) 10.731 37.893 ( -6.285 12.268 0.068) 13.785 38.706 ( -1.070 -4.191 -1.182) 4.484 38.831 ( -5.410 -12.464 0.121) 13.588 38.943 ( -3.246 -6.195 1.433) 7.139 39.098 ( -7.790 2.801 1.203) 8.365 39.404 ( -9.635 -2.831 -4.129) 10.858 39.568 ( -7.813 4.050 2.636) 9.187 40.075 ( -6.599 2.799 1.040) 7.243 40.722 ( -10.839 -6.419 -8.158) 15.008 40.905 ( -21.524 6.142 7.974) 23.761 41.225 ( -23.344 -2.241 -0.878) 23.468 43.270 ( -9.198 6.956 7.507) 13.760 43.410 ( -10.957 5.602 -9.759) 15.706 43.970 ( -12.892 -4.762 6.124) 15.045 44.050 ( -12.607 -4.814 -3.747) 14.005 69.491 ( -11.586 4.407 3.233) 12.811 69.532 ( -13.036 5.229 -4.143) 14.644 69.957 ( -18.890 -3.337 -0.906) 19.203 70.089 ( -25.384 -4.791 2.205) 25.926 105.020 ( -3.641 0.332 -1.504) 3.953 105.048 ( -4.115 -0.407 -0.623) 4.181 105.071 ( -3.497 0.682 1.188) 3.756 105.118 ( -4.294 -0.529 0.920) 4.423 ======================= Grid point 107 (50/102) ======================= q-point: ( 0.38 0.20 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 Number of triplets: 160 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 4.541 ( 19.481 2.705 10.220) 22.165 4.614 ( 20.096 6.138 6.717) 22.060 4.862 ( 17.696 0.112 -4.382) 18.231 5.028 ( 5.986 -6.554 1.743) 9.045 5.127 ( 10.351 -4.888 -1.648) 11.565 5.189 ( 9.201 -8.670 -8.058) 14.992 5.369 ( 14.066 -2.850 3.165) 14.696 5.516 ( 17.255 -3.605 -6.462) 18.774 5.700 ( 7.003 1.392 -0.817) 7.187 5.728 ( 12.556 3.286 3.497) 13.442 5.925 ( 8.798 -5.368 -10.316) 14.582 6.013 ( 4.902 -3.312 -9.783) 11.433 6.128 ( 5.171 6.996 2.249) 8.985 6.162 ( 4.155 -1.796 0.182) 4.530 6.324 ( 5.040 7.161 -2.093) 9.003 6.424 ( -0.528 4.474 2.136) 4.986 6.512 ( 6.351 -2.435 -4.613) 8.219 6.762 ( 6.036 8.441 6.179) 12.077 6.794 ( 0.498 7.043 1.103) 7.147 6.900 ( 2.203 8.407 -2.561) 9.061 6.963 ( 1.930 5.306 -5.894) 8.162 7.201 ( 1.809 2.466 3.887) 4.946 7.294 ( 1.542 4.639 2.493) 5.488 7.392 ( -1.162 -0.429 4.727) 4.886 7.516 ( 0.141 1.403 3.172) 3.472 7.567 ( 11.896 4.785 -2.413) 13.047 7.679 ( 0.481 -4.280 3.376) 5.472 7.798 ( 1.445 -1.310 -2.806) 3.417 7.841 ( 7.752 -9.222 -2.855) 12.381 8.137 ( 1.135 -2.368 -4.105) 4.873 8.274 ( -3.453 -7.864 -2.555) 8.960 8.325 ( -7.644 -7.803 -2.813) 11.279 8.430 ( -7.000 3.173 -3.875) 8.607 8.552 ( 2.467 0.230 5.106) 5.675 8.674 ( 0.194 -3.740 1.054) 3.890 8.697 ( 6.157 0.426 -0.525) 6.194 8.735 ( -2.817 -1.707 3.189) 4.584 8.920 ( -3.551 -3.724 2.706) 5.814 9.012 ( 9.717 4.295 2.431) 10.898 9.167 ( 0.218 6.283 4.265) 7.597 9.295 ( 9.103 1.432 11.147) 14.463 9.483 ( 17.921 -0.361 -1.586) 17.995 9.637 ( 14.411 -1.483 -2.946) 14.784 9.665 ( 13.120 0.547 -2.042) 13.290 9.768 ( 8.229 1.804 4.745) 9.669 9.882 ( 11.859 4.845 3.126) 13.187 9.972 ( 5.777 -1.018 8.134) 10.029 10.115 ( 10.817 -2.615 -0.101) 11.129 10.262 ( 7.437 -0.869 6.726) 10.065 10.295 ( 12.217 4.231 0.896) 12.960 10.384 ( 17.221 0.570 2.289) 17.382 10.629 ( 9.912 0.786 -6.967) 12.141 10.935 ( 5.988 2.570 -9.652) 11.645 10.969 ( 4.978 3.867 -7.461) 9.768 11.216 ( 3.331 -1.212 -3.236) 4.799 11.375 ( 7.338 -9.096 -7.742) 14.018 11.643 ( 5.520 -0.164 -3.517) 6.547 11.683 ( 3.353 -3.965 14.598) 15.494 11.982 ( 0.446 0.755 -0.428) 0.976 12.169 ( 5.994 -1.027 -6.274) 8.737 12.313 ( 7.820 -2.662 -0.390) 8.270 12.450 ( 5.853 -7.730 -1.368) 9.792 12.600 ( 11.716 4.392 1.771) 12.637 12.690 ( 11.890 1.457 0.507) 11.989 13.164 ( -3.463 10.893 4.584) 12.316 13.291 ( -1.976 4.525 -3.935) 6.314 13.661 ( -4.160 -2.037 -0.899) 4.719 13.778 ( -5.460 -0.719 2.924) 6.235 14.072 ( -2.266 -1.317 -0.035) 2.621 14.262 ( -1.689 4.387 1.531) 4.944 14.393 ( 1.413 -7.473 -1.183) 7.697 14.608 ( -0.363 1.232 0.409) 1.348 14.630 ( -0.313 -1.504 3.213) 3.561 14.685 ( -0.765 0.656 -1.720) 1.993 14.736 ( 1.901 -7.206 0.273) 7.458 14.868 ( -1.027 -1.868 5.818) 6.196 14.917 ( -1.974 -1.795 -3.359) 4.290 15.116 ( -3.015 3.581 2.594) 5.352 15.147 ( -3.605 -10.439 -3.901) 11.713 15.315 ( -2.562 -2.418 -3.117) 4.704 17.854 ( -0.371 10.834 -0.933) 10.880 17.924 ( -1.751 14.204 0.646) 14.326 18.535 ( -1.165 -3.103 1.368) 3.585 18.584 ( -0.539 -1.091 -0.335) 1.263 18.729 ( -0.173 2.309 -0.427) 2.355 18.832 ( 1.147 -2.697 -0.277) 2.943 18.975 ( -4.039 -5.154 -3.359) 7.359 19.082 ( -4.627 -4.589 3.151) 7.239 20.130 ( 5.590 1.827 -1.129) 5.988 20.166 ( 4.391 1.450 0.509) 4.652 20.278 ( 3.931 -0.978 -0.246) 4.058 20.292 ( 1.696 -0.986 1.268) 2.336 21.513 ( 12.042 0.935 1.008) 12.120 21.613 ( 11.381 -1.471 0.849) 11.507 21.725 ( 10.690 0.509 -0.528) 10.715 21.769 ( 9.207 -0.576 0.281) 9.229 22.383 ( 10.989 3.700 -2.112) 11.786 22.424 ( 7.671 4.893 1.261) 9.186 22.785 ( 8.392 -5.678 -1.474) 10.239 22.824 ( 5.450 -4.103 0.003) 6.822 24.319 ( -0.454 1.169 3.273) 3.505 24.451 ( 1.730 -2.291 0.990) 3.037 24.526 ( 1.233 0.986 -1.181) 1.971 24.576 ( 1.832 0.110 -3.389) 3.854 28.821 ( 2.934 2.159 0.612) 3.694 28.873 ( 3.155 1.224 -0.194) 3.389 28.995 ( -2.121 -2.068 1.395) 3.274 28.999 ( -1.543 -1.967 -1.214) 2.779 29.246 ( -0.993 1.774 2.812) 3.470 29.369 ( -2.018 -1.571 0.147) 2.561 29.400 ( -1.852 0.889 -1.976) 2.851 29.448 ( -1.376 -0.070 -0.689) 1.540 33.589 ( 4.170 2.486 0.217) 4.860 33.602 ( 4.593 2.683 -0.233) 5.324 33.816 ( 4.084 -2.931 0.453) 5.047 33.839 ( 4.854 -2.997 -0.526) 5.729 35.738 ( 0.262 4.923 0.281) 4.938 35.850 ( 0.157 4.171 -0.428) 4.196 36.126 ( -7.477 -3.833 4.495) 9.529 36.316 ( -11.188 -6.020 -3.975) 13.312 37.734 ( -3.967 10.504 -1.314) 11.305 37.806 ( -2.781 12.542 1.414) 12.924 38.688 ( -0.596 -5.683 -1.298) 5.860 38.730 ( -3.935 -13.291 -0.482) 13.870 38.917 ( -0.291 -4.273 0.865) 4.369 38.967 ( -5.373 1.897 3.164) 6.518 39.215 ( -8.023 -2.486 -4.349) 9.458 39.418 ( -7.455 1.920 1.949) 7.941 39.983 ( -2.528 1.320 -0.063) 2.853 40.517 ( -9.358 -4.358 -6.472) 12.184 40.540 ( -14.871 4.206 6.449) 16.746 40.811 ( -17.612 -0.813 0.073) 17.631 43.121 ( -6.999 7.260 5.197) 11.345 43.211 ( -7.105 6.887 -6.635) 11.913 43.759 ( -9.259 -5.432 4.622) 11.688 43.830 ( -8.498 -5.448 -3.185) 10.585 69.288 ( -9.208 3.088 2.857) 10.124 69.306 ( -8.507 3.186 -3.504) 9.737 69.638 ( -12.844 -2.776 -0.709) 13.160 69.669 ( -16.906 -2.976 1.459) 17.228 104.956 ( -2.548 0.226 -0.477) 2.602 104.978 ( -2.706 -0.414 -0.286) 2.752 105.010 ( -2.706 0.574 0.393) 2.793 105.044 ( -3.247 -0.344 0.359) 3.285 ======================= Grid point 108 (51/102) ======================= q-point: ( 0.44 0.20 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 Number of triplets: 160 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 4.828 ( 9.874 1.758 -3.440) 10.603 4.991 ( 14.064 0.430 7.600) 15.992 5.107 ( 1.834 -2.836 1.378) 3.648 5.157 ( 8.702 0.426 0.964) 8.765 5.259 ( 3.788 -7.032 -1.975) 8.228 5.306 ( 6.118 1.108 -3.967) 7.375 5.572 ( 4.901 2.257 1.688) 5.654 5.729 ( 5.965 1.271 -8.714) 10.636 5.827 ( 4.212 -2.935 -5.301) 7.380 5.985 ( 9.912 -0.433 1.803) 10.084 6.050 ( 5.293 -2.347 -4.245) 7.179 6.093 ( 3.066 -1.899 -2.496) 4.386 6.222 ( 6.106 1.125 -4.450) 7.639 6.260 ( 6.315 5.223 6.977) 10.763 6.385 ( -0.775 3.417 -1.987) 4.028 6.416 ( 1.616 6.900 1.925) 7.343 6.606 ( 3.295 -3.617 -2.193) 5.362 6.774 ( 1.636 6.934 1.820) 7.353 6.869 ( -1.155 3.836 2.348) 4.643 6.940 ( 6.409 5.414 0.179) 8.392 7.058 ( 7.610 3.676 -0.966) 8.506 7.244 ( 2.279 1.611 2.079) 3.480 7.287 ( -7.221 -1.721 3.890) 8.381 7.357 ( 2.136 -0.646 2.798) 3.579 7.504 ( -0.982 -0.238 4.067) 4.191 7.645 ( -3.222 0.634 -9.591) 10.138 7.685 ( 0.615 -3.590 2.479) 4.405 7.834 ( 1.623 -2.930 -4.426) 5.550 7.948 ( 0.355 -11.509 -9.386) 14.855 7.990 ( -11.612 -6.252 0.690) 13.207 8.074 ( -9.169 -7.293 1.191) 11.776 8.234 ( -4.346 -3.589 -3.665) 6.723 8.361 ( 3.521 5.916 2.138) 7.209 8.528 ( -5.529 7.730 0.109) 9.504 8.590 ( -3.271 0.361 1.600) 3.659 8.684 ( -3.991 0.260 2.236) 4.582 8.855 ( 3.683 -0.796 -0.464) 3.796 8.912 ( 4.548 -0.152 1.673) 4.849 9.144 ( 0.842 3.707 4.312) 5.748 9.247 ( 6.343 4.976 5.455) 9.733 9.435 ( 3.997 3.999 15.073) 16.098 9.749 ( 6.994 -2.849 -0.403) 7.562 9.808 ( 3.070 -1.150 8.886) 9.471 9.915 ( 8.094 -2.843 -2.093) 8.831 9.939 ( 8.626 4.417 5.246) 11.020 10.037 ( 6.169 5.152 6.031) 10.049 10.147 ( 7.185 2.259 0.415) 7.544 10.238 ( 5.226 -1.073 -7.810) 9.459 10.370 ( 3.131 0.417 4.189) 5.246 10.500 ( 7.811 3.744 -2.079) 8.908 10.724 ( 13.963 -1.674 -0.340) 14.067 10.797 ( 6.892 -1.396 -6.301) 9.442 10.940 ( -1.975 4.789 -5.634) 7.653 11.094 ( 6.887 1.774 -9.993) 12.265 11.239 ( -0.909 -1.553 -0.632) 1.908 11.407 ( -0.785 -8.078 -11.369) 13.968 11.733 ( 1.003 -4.221 8.221) 9.296 11.768 ( 4.331 -6.096 3.884) 8.426 12.012 ( 1.684 -0.957 -0.298) 1.959 12.243 ( 3.026 -3.861 -9.831) 10.987 12.558 ( 15.437 -2.186 -0.352) 15.595 12.632 ( 10.528 -4.001 1.620) 11.379 12.859 ( 11.909 2.050 1.699) 12.203 12.971 ( 12.128 1.368 1.810) 12.338 13.108 ( -0.973 11.053 0.298) 11.099 13.203 ( -4.259 4.785 -0.930) 6.473 13.504 ( -11.043 -0.004 0.606) 11.059 13.628 ( -9.952 3.310 2.168) 10.710 14.026 ( -2.184 -0.302 1.694) 2.780 14.232 ( -1.285 7.250 -3.020) 7.958 14.432 ( 2.566 -7.405 0.993) 7.900 14.591 ( -2.151 -3.378 1.392) 4.240 14.613 ( -1.704 -1.748 5.392) 5.919 14.687 ( 1.823 3.345 -3.121) 4.925 14.780 ( 1.232 -8.095 3.283) 8.822 14.859 ( -0.381 -3.026 2.790) 4.134 14.916 ( 2.188 -1.445 -4.217) 4.966 15.062 ( -2.739 0.089 0.582) 2.802 15.082 ( -2.100 -7.920 -2.143) 8.470 15.251 ( -3.013 -2.486 -2.329) 4.547 17.853 ( 0.045 11.290 0.376) 11.296 17.901 ( -0.550 13.652 -0.766) 13.685 18.511 ( -1.534 -0.891 2.693) 3.225 18.582 ( 0.550 -1.321 -2.000) 2.459 18.734 ( 0.978 0.312 -1.218) 1.593 18.860 ( 0.273 -5.740 -1.538) 5.949 18.899 ( -1.390 -3.327 -1.036) 3.752 18.998 ( -4.379 -4.241 3.059) 6.821 20.211 ( 2.705 1.483 -0.485) 3.123 20.230 ( 2.009 1.331 0.085) 2.411 20.317 ( 0.591 -0.471 1.417) 1.606 20.336 ( 1.993 -0.642 -0.462) 2.144 21.711 ( 7.250 0.852 1.579) 7.469 21.796 ( 6.371 -1.223 1.631) 6.689 21.890 ( 5.653 0.272 -1.186) 5.782 21.907 ( 4.484 -0.041 -0.593) 4.523 22.520 ( 3.397 3.449 1.194) 4.986 22.561 ( 5.663 4.566 -2.174) 7.592 22.840 ( 0.295 -3.622 3.070) 4.758 22.965 ( 5.883 -4.627 -4.336) 8.650 24.322 ( -0.110 1.430 3.984) 4.234 24.485 ( 1.251 -2.803 1.166) 3.283 24.543 ( 0.730 1.056 -2.356) 2.683 24.603 ( 1.387 0.015 -2.696) 3.032 28.869 ( 1.526 1.141 0.783) 2.060 28.929 ( 2.292 0.213 -0.406) 2.338 28.964 ( -1.180 -1.136 1.207) 2.034 28.972 ( -0.776 -0.777 -1.256) 1.668 29.235 ( -0.683 1.327 2.426) 2.848 29.337 ( -1.105 -1.185 0.840) 1.825 29.363 ( -1.368 1.000 -1.829) 2.493 29.427 ( -0.560 -0.462 -1.156) 1.365 33.651 ( 1.981 2.692 0.425) 3.369 33.672 ( 2.402 3.095 -0.440) 3.942 33.879 ( 2.114 -2.629 0.616) 3.429 33.913 ( 2.569 -2.690 -0.637) 3.773 35.764 ( 2.100 2.321 0.490) 3.169 35.869 ( 1.488 1.199 -0.437) 1.960 36.005 ( -5.397 -2.229 3.521) 6.819 36.126 ( -6.731 -3.653 -3.456) 8.402 37.672 ( -1.813 11.284 -0.085) 11.429 37.764 ( -1.826 12.076 0.012) 12.213 38.660 ( -1.345 -11.671 -0.346) 11.753 38.696 ( -0.073 -8.616 -0.512) 8.631 38.872 ( -2.935 2.004 0.762) 3.635 38.946 ( 0.662 -2.259 2.187) 3.213 39.081 ( -3.780 -2.971 -2.676) 5.503 39.285 ( -5.954 -1.098 0.551) 6.079 39.978 ( 2.133 0.928 -0.516) 2.382 40.263 ( -10.747 6.015 -0.184) 12.317 40.398 ( -4.934 -5.592 1.544) 7.616 40.533 ( -9.455 0.303 -0.763) 9.491 43.015 ( -4.373 7.519 3.326) 9.312 43.100 ( -2.779 7.478 -4.348) 9.085 43.621 ( -5.343 -5.780 3.407) 8.577 43.700 ( -3.879 -5.770 -2.415) 7.360 69.143 ( -5.493 2.303 1.856) 6.238 69.181 ( -3.367 2.204 -2.809) 4.908 69.408 ( -9.111 -2.058 2.416) 9.648 69.450 ( -6.101 -2.261 -1.441) 6.664 104.918 ( -1.193 0.208 0.286) 1.245 104.939 ( -1.133 -0.388 0.043) 1.198 104.967 ( -1.475 0.423 -0.276) 1.559 104.991 ( -2.066 -0.220 -0.058) 2.079 ======================= Grid point 109 (52/102) ======================= q-point: (-0.50 0.20 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 Number of triplets: 160 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 4.956 ( 2.018 -1.103 -0.650) 2.390 5.052 ( -9.892 2.710 -5.088) 11.449 5.110 ( -1.573 -2.911 2.401) 4.088 5.157 ( -1.347 -3.802 -1.193) 4.206 5.375 ( 5.388 1.426 -0.101) 5.574 5.439 ( 3.136 -0.898 3.391) 4.705 5.604 ( -0.311 5.796 0.574) 5.832 5.747 ( -2.005 -1.513 -13.958) 14.182 5.856 ( 0.520 1.571 1.642) 2.331 6.006 ( -4.468 -2.726 -3.525) 6.311 6.102 ( 0.501 3.959 -2.096) 4.508 6.150 ( 2.353 0.963 2.500) 3.565 6.258 ( -1.887 2.549 -3.451) 4.687 6.370 ( 0.958 0.150 -1.617) 1.885 6.440 ( 3.791 6.735 5.708) 9.608 6.501 ( 4.636 6.064 3.375) 8.346 6.653 ( 2.327 -1.134 2.416) 3.541 6.787 ( -4.548 0.282 -6.565) 7.992 6.882 ( 6.735 -2.022 11.105) 13.145 7.076 ( 5.144 -0.195 2.026) 5.532 7.106 ( -1.034 -0.154 -3.899) 4.037 7.251 ( -2.745 1.821 0.128) 3.297 7.306 ( -1.274 -5.270 2.100) 5.814 7.365 ( 3.935 2.868 1.761) 5.178 7.450 ( -9.049 -1.480 5.750) 10.823 7.596 ( 3.387 1.959 -5.972) 7.139 7.652 ( -2.256 -10.448 -4.448) 11.578 7.716 ( -2.406 -2.975 -4.700) 6.061 7.831 ( -2.718 -5.200 -6.873) 9.037 7.868 ( -0.917 -5.295 -8.065) 9.691 8.093 ( 2.141 -2.487 7.346) 8.045 8.257 ( 6.104 -0.523 -1.092) 6.223 8.392 ( -4.070 5.125 0.602) 6.573 8.461 ( 2.178 3.864 5.305) 6.915 8.542 ( -1.061 1.638 -2.224) 2.958 8.592 ( -3.240 2.656 -1.509) 4.453 8.892 ( -1.447 1.589 2.050) 2.970 8.982 ( 1.411 2.062 0.134) 2.502 9.148 ( -1.882 0.891 5.876) 6.234 9.313 ( -0.604 -1.508 7.462) 7.637 9.552 ( 3.803 8.871 12.536) 15.822 9.801 ( -0.396 -1.605 6.078) 6.299 9.851 ( -0.536 -0.466 10.280) 10.305 9.983 ( -0.519 -5.171 3.111) 6.057 10.070 ( 2.746 4.363 2.910) 5.920 10.122 ( -0.076 1.315 0.587) 1.442 10.188 ( -0.620 1.556 -0.877) 1.891 10.312 ( -1.085 8.061 -3.711) 8.940 10.437 ( 4.268 -1.033 -0.568) 4.428 10.587 ( 1.669 5.598 -10.371) 11.903 10.787 ( -4.797 -0.029 -1.681) 5.084 10.874 ( -1.584 -1.885 -2.909) 3.811 10.966 ( 6.769 -1.207 -5.131) 8.579 11.119 ( -3.575 0.535 -10.992) 11.571 11.182 ( -4.328 -0.611 1.263) 4.549 11.378 ( 1.418 -7.650 -7.054) 10.502 11.753 ( -0.438 -3.028 5.561) 6.347 11.814 ( -0.383 -7.571 1.592) 7.746 12.024 ( -0.701 -2.064 0.152) 2.185 12.275 ( 2.245 -5.656 -9.213) 11.041 12.733 ( -3.539 2.429 3.679) 5.653 12.868 ( 8.656 -1.567 -1.668) 8.953 12.939 ( -2.870 0.572 -0.082) 2.928 12.973 ( -0.972 -0.496 -0.896) 1.412 13.180 ( -2.422 0.220 2.134) 3.236 13.284 ( 1.471 7.605 -1.789) 7.950 13.306 ( -3.470 2.803 6.404) 7.804 13.459 ( 3.004 7.026 -0.456) 7.654 14.007 ( 0.096 1.433 2.889) 3.226 14.199 ( -1.029 7.092 -4.681) 8.560 14.491 ( 1.999 -6.574 3.320) 7.632 14.540 ( -1.785 -3.644 -0.417) 4.079 14.598 ( -1.139 -2.228 4.024) 4.739 14.734 ( 2.763 4.194 -1.634) 5.281 14.780 ( -1.560 -7.792 5.549) 9.692 14.861 ( -0.915 -3.848 -0.258) 3.963 14.963 ( 3.140 -2.971 -4.094) 5.954 15.026 ( -0.635 0.437 -0.603) 0.979 15.059 ( 0.446 -7.654 -0.059) 7.667 15.198 ( -1.378 -2.774 -2.292) 3.853 17.846 ( -0.912 12.763 0.917) 12.828 17.903 ( 0.911 12.076 -1.366) 12.187 18.492 ( -0.798 -0.322 2.536) 2.678 18.596 ( 1.174 -0.110 -1.770) 2.127 18.764 ( 2.025 -3.218 -1.891) 4.246 18.810 ( -2.013 -3.900 -3.300) 5.491 18.918 ( -3.448 -3.862 2.813) 5.892 18.948 ( 3.147 -4.155 1.536) 5.434 20.238 ( -0.035 1.083 0.141) 1.093 20.250 ( 0.103 1.554 -0.492) 1.633 20.322 ( -0.404 -0.226 1.375) 1.451 20.358 ( 0.328 -0.563 -0.409) 0.770 21.801 ( 1.148 0.665 2.484) 2.816 21.868 ( 0.361 -1.038 2.088) 2.359 21.927 ( -1.330 0.571 -2.241) 2.668 21.953 ( -0.077 -0.121 -0.958) 0.969 22.548 ( -0.771 3.160 0.957) 3.391 22.623 ( 0.924 4.604 -2.097) 5.142 22.833 ( -1.442 -3.127 3.270) 4.749 23.026 ( 1.107 -4.670 -4.411) 6.519 24.328 ( -0.195 1.615 4.326) 4.622 24.500 ( -0.164 -2.767 1.775) 3.291 24.543 ( -0.096 1.135 -3.622) 3.797 24.617 ( 0.525 -0.371 -2.225) 2.316 28.885 ( 0.035 0.588 1.044) 1.198 28.943 ( -0.942 0.146 -1.190) 1.525 28.948 ( -0.512 -0.822 0.645) 1.163 28.978 ( 1.226 -0.557 -0.229) 1.366 29.231 ( -0.151 1.325 2.149) 2.529 29.330 ( 0.215 -0.886 0.902) 1.282 29.345 ( 0.082 0.906 -1.308) 1.593 29.418 ( -0.058 -0.634 -1.491) 1.622 33.671 ( -0.078 2.732 0.479) 2.775 33.696 ( 0.082 3.320 -0.500) 3.358 33.902 ( -0.054 -2.597 0.709) 2.693 33.938 ( 0.047 -2.533 -0.708) 2.630 35.812 ( 1.558 0.123 1.011) 1.862 35.883 ( 0.009 0.238 -1.187) 1.211 35.924 ( -3.302 -0.747 2.670) 4.312 36.062 ( 1.722 -2.566 -2.470) 3.956 37.666 ( 1.066 11.546 1.194) 11.657 37.731 ( -1.226 11.868 -1.389) 12.011 38.654 ( 0.496 -11.671 0.800) 11.709 38.695 ( -0.117 -9.735 -0.873) 9.775 38.841 ( -0.229 1.209 1.494) 1.935 38.932 ( -1.254 1.887 -2.261) 3.201 39.091 ( 3.808 -4.480 2.561) 6.413 39.193 ( -2.703 -2.813 -1.631) 4.228 40.041 ( 0.964 1.990 0.920) 2.394 40.130 ( 0.904 2.704 -3.619) 4.608 40.312 ( -3.548 -0.270 4.833) 6.002 40.458 ( 1.842 -2.092 -2.002) 3.432 42.962 ( -1.425 7.772 1.995) 8.149 43.083 ( 1.930 7.582 -2.952) 8.362 43.560 ( -1.385 -5.991 2.620) 6.684 43.665 ( 0.862 -5.857 -1.699) 6.159 69.082 ( -0.861 2.258 1.050) 2.635 69.161 ( 1.978 1.784 -2.630) 3.743 69.307 ( -1.602 -1.666 2.739) 3.583 69.391 ( 0.487 -2.265 -1.152) 2.587 104.910 ( 0.297 0.233 0.691) 0.787 104.933 ( 0.412 -0.426 0.352) 0.690 104.950 ( -0.090 0.299 -0.606) 0.682 104.963 ( -0.622 -0.088 -0.440) 0.766 ======================= Grid point 110 (53/102) ======================= q-point: (-0.44 0.20 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 Number of triplets: 160 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 4.658 ( -22.674 4.707 -2.450) 23.287 4.969 ( -7.597 -1.038 5.654) 9.527 5.058 ( -3.578 -2.835 -0.193) 4.570 5.091 ( -4.117 -7.747 -0.784) 8.808 5.328 ( -12.043 -3.380 1.976) 12.663 5.419 ( -1.855 -0.019 -1.714) 2.525 5.584 ( -3.931 4.734 2.032) 6.480 5.628 ( -6.068 0.371 -12.571) 13.964 5.823 ( -4.932 0.332 2.569) 5.571 5.898 ( -6.471 1.063 0.453) 6.574 6.030 ( -5.653 1.757 -8.353) 10.238 6.202 ( 1.378 0.149 3.392) 3.664 6.233 ( 0.827 1.837 -3.431) 3.979 6.327 ( -7.087 -1.327 -2.601) 7.665 6.418 ( -5.989 6.166 3.889) 9.434 6.500 ( -0.661 8.505 3.275) 9.138 6.628 ( -0.668 4.019 -5.606) 6.930 6.730 ( -8.595 7.590 -6.367) 13.116 7.015 ( -7.368 1.761 -5.451) 9.333 7.063 ( 3.817 -3.186 11.142) 12.201 7.120 ( 3.640 -8.942 6.248) 11.500 7.152 ( -2.933 2.944 -1.245) 4.338 7.283 ( -3.825 -0.400 3.447) 5.165 7.362 ( 8.474 -1.882 5.379) 10.212 7.417 ( -1.286 -5.896 1.432) 6.202 7.578 ( -4.165 -4.503 1.505) 6.315 7.710 ( 0.334 2.834 -4.797) 5.582 7.725 ( 3.389 -6.057 -11.500) 13.432 7.847 ( 4.703 2.422 -6.031) 8.023 7.970 ( 10.701 -4.637 2.565) 11.941 8.139 ( 3.567 -1.294 -1.363) 4.031 8.323 ( 1.513 -0.179 0.154) 1.531 8.392 ( 1.752 1.761 -0.370) 2.512 8.482 ( -0.919 -2.497 -3.776) 4.619 8.573 ( 3.103 0.181 5.536) 6.349 8.601 ( 4.288 3.982 0.133) 5.853 8.815 ( -4.959 2.499 2.601) 6.132 8.953 ( -4.458 1.954 0.809) 4.934 9.058 ( -8.586 1.625 5.769) 10.471 9.287 ( -3.257 -3.264 6.844) 8.253 9.585 ( -3.026 6.999 1.766) 7.827 9.762 ( -6.739 2.975 12.365) 14.393 9.861 ( -1.118 -2.414 8.531) 8.936 9.922 ( -5.036 -7.125 5.177) 10.145 9.999 ( -10.118 2.452 0.560) 10.426 10.110 ( -0.601 2.568 0.884) 2.782 10.128 ( -9.156 4.325 2.335) 10.392 10.181 ( -5.675 5.866 -2.900) 8.661 10.464 ( -4.232 -2.728 3.881) 6.357 10.512 ( -6.439 6.259 -12.597) 15.470 10.664 ( -7.833 0.066 4.855) 9.215 10.798 ( -4.788 -2.450 -4.652) 7.111 10.937 ( -9.141 -0.472 -6.516) 11.236 10.967 ( -6.159 0.931 -10.997) 12.638 11.143 ( 0.835 -0.808 -5.420) 5.543 11.405 ( 1.305 -6.120 -4.227) 7.551 11.722 ( -3.351 -2.313 1.322) 4.281 11.795 ( -1.552 -4.134 5.946) 7.407 11.977 ( -4.163 -2.603 -0.705) 4.960 12.273 ( -1.427 -7.431 -8.642) 11.486 12.545 ( -12.021 -0.430 0.413) 12.036 12.661 ( -13.387 -3.697 0.476) 13.897 12.857 ( -14.229 3.735 1.983) 14.844 12.959 ( -14.009 4.102 2.198) 14.761 13.118 ( -2.180 10.180 1.221) 10.482 13.169 ( 10.438 3.204 -1.655) 11.043 13.513 ( 11.667 -1.026 0.452) 11.720 13.669 ( 10.347 -0.015 1.847) 10.511 14.038 ( 2.076 2.548 2.252) 3.984 14.177 ( -0.317 4.481 -2.505) 5.143 14.480 ( -1.059 -4.689 -1.448) 5.020 14.568 ( 1.974 -2.990 1.733) 3.980 14.578 ( -1.427 -2.502 2.971) 4.138 14.735 ( -2.153 -8.499 5.306) 10.248 14.789 ( -0.459 2.552 -0.798) 2.713 14.833 ( 1.023 -0.842 -1.416) 1.940 14.991 ( -0.944 0.600 1.724) 2.055 15.043 ( 3.090 -3.793 -2.751) 5.613 15.105 ( 3.773 -5.475 -0.620) 6.678 15.197 ( 1.750 -3.965 -3.060) 5.305 17.827 ( -0.961 13.207 0.092) 13.242 17.924 ( 1.377 11.556 -0.488) 11.648 18.492 ( 0.254 -0.406 1.845) 1.906 18.620 ( 1.416 -0.272 -1.035) 1.775 18.755 ( -1.060 -4.255 -1.989) 4.815 18.819 ( 0.319 -3.466 -1.336) 3.728 18.874 ( 0.717 -1.731 0.677) 1.992 19.028 ( 4.064 -5.049 1.806) 6.728 20.210 ( -2.687 1.304 -0.282) 3.000 20.233 ( -1.793 1.468 -0.235) 2.329 20.306 ( -1.483 -0.350 1.099) 1.879 20.348 ( -1.350 -0.704 -0.029) 1.523 21.763 ( -5.609 0.511 3.611) 6.690 21.822 ( -5.412 -0.790 1.067) 5.572 21.840 ( -6.480 0.608 -1.506) 6.680 21.888 ( -6.222 -0.439 -1.734) 6.474 22.491 ( -5.077 3.362 0.223) 6.093 22.589 ( -3.998 4.825 -1.226) 6.385 22.799 ( -2.514 -3.617 1.831) 4.770 22.990 ( -3.894 -4.821 -3.075) 6.918 24.332 ( -0.217 1.572 4.306) 4.589 24.485 ( -1.635 -2.186 1.960) 3.361 24.525 ( -0.836 1.162 -3.965) 4.216 24.615 ( -0.263 -0.895 -2.208) 2.397 28.875 ( -1.520 0.592 1.260) 2.061 28.909 ( -2.177 0.527 -0.810) 2.382 28.941 ( -0.052 -0.379 0.039) 0.385 29.002 ( 1.379 -1.225 -0.152) 1.851 29.239 ( 0.423 1.536 2.494) 2.959 29.349 ( 1.612 -0.620 -0.185) 1.737 29.361 ( 1.527 0.221 -0.357) 1.583 29.418 ( 0.392 -0.478 -1.680) 1.790 33.650 ( -2.094 2.591 0.389) 3.354 33.673 ( -2.284 3.208 -0.404) 3.959 33.880 ( -2.258 -2.728 0.644) 3.599 33.912 ( -2.445 -2.583 -0.665) 3.618 35.801 ( -1.682 0.915 1.307) 2.319 35.846 ( -2.303 3.400 -1.502) 4.373 35.959 ( 4.928 -2.688 2.491) 6.141 36.159 ( 7.628 -4.145 -2.178) 8.951 37.712 ( 1.100 11.598 -0.866) 11.683 37.718 ( 2.381 11.763 0.792) 12.028 38.668 ( 0.456 -9.247 -0.406) 9.267 38.695 ( 0.833 -11.069 -0.472) 11.110 38.861 ( 1.115 -1.653 0.903) 2.189 38.935 ( 2.556 1.882 1.357) 3.451 39.158 ( 2.040 -2.337 -3.866) 4.957 39.222 ( 6.204 -2.044 2.444) 6.974 40.025 ( 0.610 1.875 -0.700) 2.092 40.220 ( 3.204 0.333 0.127) 3.224 40.368 ( 10.651 1.533 1.090) 10.816 40.566 ( 8.838 -2.073 -0.429) 9.088 42.967 ( 1.553 8.047 1.280) 8.294 43.166 ( 6.864 7.322 -2.478) 10.338 43.576 ( 2.393 -6.177 2.349) 7.028 43.726 ( 5.513 -5.754 -1.181) 8.056 69.113 ( 3.754 2.803 0.418) 4.704 69.245 ( 6.706 2.153 -2.177) 7.372 69.357 ( 6.235 -2.311 2.280) 7.030 69.467 ( 7.386 -2.455 -0.498) 7.799 104.933 ( 1.918 0.183 0.834) 2.099 104.947 ( 0.779 -0.130 -0.617) 1.002 104.967 ( 1.782 -0.014 0.502) 1.851 104.968 ( 1.376 -0.016 -0.723) 1.555 ======================= Grid point 111 (54/102) ======================= q-point: (-0.38 0.20 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 Number of triplets: 160 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 4.151 ( -27.481 8.110 3.931) 28.921 4.659 ( -24.468 -0.800 8.438) 25.895 4.930 ( -9.079 -8.223 0.251) 12.252 4.993 ( -7.188 -11.235 -2.581) 13.585 5.069 ( -12.086 -0.210 -1.274) 12.155 5.295 ( -9.952 -3.380 0.360) 10.516 5.428 ( -9.386 -0.924 -8.481) 12.684 5.477 ( -9.310 3.806 1.058) 10.113 5.687 ( -9.399 -1.869 1.488) 9.698 5.724 ( -10.879 0.617 2.103) 11.098 5.866 ( -7.797 0.707 -11.555) 13.958 6.078 ( -10.724 0.635 -6.217) 12.412 6.158 ( -8.832 -3.058 1.613) 9.485 6.278 ( 0.678 5.430 -3.808) 6.667 6.343 ( -2.582 4.274 2.594) 5.627 6.449 ( -8.442 11.930 -4.681) 15.346 6.519 ( -2.425 9.231 4.619) 10.603 6.602 ( -4.747 4.129 -1.124) 6.391 6.856 ( -4.150 9.256 -5.874) 11.722 7.053 ( -4.628 -2.578 -2.464) 5.843 7.106 ( -3.603 -0.835 0.331) 3.713 7.212 ( -0.989 1.548 2.186) 2.855 7.305 ( 3.938 -10.298 13.448) 17.390 7.355 ( -4.440 -4.655 0.073) 6.433 7.451 ( -2.413 -2.897 1.097) 3.927 7.499 ( -6.727 0.825 -4.482) 8.125 7.708 ( 5.534 6.554 -1.662) 8.737 7.802 ( 6.308 -5.322 -3.296) 8.887 7.903 ( -1.731 3.805 4.783) 6.353 8.118 ( 3.453 -2.748 -5.928) 7.391 8.226 ( 2.162 1.072 0.119) 2.416 8.309 ( -6.485 -1.689 -0.749) 6.743 8.396 ( -3.612 -1.136 -0.936) 3.900 8.480 ( 7.739 -3.707 -5.986) 10.463 8.537 ( -8.155 0.667 4.657) 9.415 8.688 ( -0.361 -4.110 1.500) 4.390 8.800 ( -0.694 3.031 5.448) 6.273 8.839 ( -4.993 1.103 1.449) 5.315 8.932 ( 1.304 1.810 4.228) 4.780 9.203 ( -6.162 -4.432 2.712) 8.060 9.421 ( -13.274 2.605 -1.959) 13.668 9.538 ( -16.558 1.624 5.143) 17.414 9.668 ( -20.146 3.935 -5.880) 21.353 9.747 ( -10.396 -2.688 8.936) 13.970 9.886 ( -5.430 -4.477 4.654) 8.438 9.927 ( -7.973 0.062 -0.139) 7.974 10.031 ( -10.605 1.278 4.061) 11.428 10.105 ( -4.712 3.076 8.955) 10.576 10.251 ( -16.816 -2.482 5.338) 17.817 10.292 ( -13.005 6.134 -1.412) 14.448 10.475 ( -10.496 -0.930 6.612) 12.440 10.681 ( -5.611 -1.066 -3.566) 6.733 10.772 ( -4.604 3.852 -9.518) 11.253 10.829 ( -4.328 5.011 -14.216) 15.682 11.099 ( -4.632 -2.255 -7.910) 9.440 11.396 ( -1.427 -4.767 -3.483) 6.074 11.648 ( -3.700 -0.398 -1.856) 4.158 11.783 ( -1.211 -0.098 10.228) 10.299 11.850 ( -7.939 -2.431 0.563) 8.322 12.160 ( -6.979 -7.175 -6.975) 12.200 12.350 ( -7.035 -2.120 -1.176) 7.441 12.444 ( -7.022 -4.964 -1.785) 8.782 12.574 ( -12.652 5.769 2.948) 14.214 12.653 ( -13.508 3.276 0.460) 13.907 13.126 ( 0.521 10.428 2.645) 10.771 13.334 ( 5.705 3.368 -1.822) 6.871 13.701 ( 6.803 -3.599 -0.826) 7.740 13.824 ( 4.190 -3.191 2.503) 5.831 14.087 ( 2.454 1.893 -0.132) 3.102 14.177 ( 0.431 1.208 1.543) 2.006 14.474 ( 0.709 -3.617 -3.355) 4.984 14.543 ( -1.704 -0.514 0.966) 2.025 14.600 ( 0.370 -1.979 1.391) 2.447 14.698 ( -2.275 -11.216 2.394) 11.692 14.771 ( 0.298 0.047 2.214) 2.234 14.887 ( 3.074 4.695 -0.238) 5.617 14.978 ( -0.093 2.163 2.623) 3.401 15.091 ( 1.811 -5.336 -1.639) 5.868 15.193 ( 4.610 -4.773 -1.395) 6.781 15.248 ( 4.150 -3.387 -3.836) 6.589 17.813 ( -0.240 13.078 -0.503) 13.090 17.958 ( 2.150 11.548 0.199) 11.748 18.507 ( 0.871 -0.673 1.045) 1.517 18.639 ( 0.405 -3.373 0.102) 3.399 18.746 ( 0.447 -0.956 -0.283) 1.093 18.796 ( -0.808 -0.420 -0.798) 1.211 18.942 ( 4.570 -3.328 -1.748) 5.918 19.114 ( 4.153 -5.464 1.824) 7.101 20.129 ( -5.371 1.777 -0.890) 5.727 20.173 ( -4.330 1.482 0.129) 4.578 20.265 ( -2.774 -0.889 0.464) 2.949 20.304 ( -3.147 -1.054 0.693) 3.390 21.600 ( -11.135 0.564 4.328) 11.960 21.642 ( -11.370 0.789 -3.709) 11.986 21.685 ( -9.774 -1.294 3.416) 10.434 21.703 ( -11.519 -0.612 -2.420) 11.787 22.344 ( -9.515 4.135 -1.079) 10.431 22.454 ( -9.419 4.763 0.252) 10.558 22.737 ( -3.874 -4.972 -1.045) 6.389 22.854 ( -9.426 -5.091 -0.447) 10.723 24.340 ( 0.251 1.230 3.994) 4.187 24.450 ( -2.012 -1.546 1.296) 2.849 24.496 ( -1.203 1.394 -3.156) 3.654 24.599 ( -0.732 -1.274 -2.449) 2.856 28.828 ( -3.140 1.204 1.085) 3.533 28.855 ( -2.905 1.982 -0.612) 3.569 28.950 ( 0.726 -1.397 0.141) 1.581 29.037 ( 2.114 -2.217 0.012) 3.063 29.257 ( 0.923 2.048 2.926) 3.689 29.392 ( 2.602 -0.826 -0.479) 2.772 29.395 ( 1.710 -0.253 -0.729) 1.876 29.431 ( 1.385 -0.045 -1.449) 2.005 33.588 ( -4.155 2.317 0.191) 4.761 33.603 ( -4.582 2.877 -0.207) 5.414 33.814 ( -4.405 -3.098 0.422) 5.402 33.839 ( -4.593 -2.787 -0.494) 5.395 35.781 ( -0.404 3.318 1.063) 3.507 35.818 ( 0.057 6.288 -1.322) 6.425 36.087 ( 7.102 -4.572 3.573) 9.171 36.346 ( 11.571 -6.095 -2.940) 13.405 37.728 ( 1.852 11.480 -1.215) 11.692 37.805 ( 4.888 11.762 1.314) 12.805 38.680 ( 1.426 -8.885 -1.403) 9.108 38.730 ( 2.537 -9.570 -0.201) 9.903 38.878 ( 0.830 -1.646 1.098) 2.146 39.043 ( 6.972 -3.904 4.011) 8.941 39.221 ( 5.445 3.219 -6.860) 9.331 39.375 ( 7.994 -1.203 3.181) 8.687 40.085 ( 5.219 -0.627 0.106) 5.257 40.300 ( 5.892 3.423 -0.635) 6.843 40.675 ( 18.470 -1.356 0.501) 18.527 40.805 ( 15.013 -0.914 0.039) 15.041 43.028 ( 4.208 8.365 1.278) 9.450 43.346 ( 11.731 6.621 -3.461) 13.908 43.664 ( 5.898 -6.271 3.087) 9.145 43.879 ( 9.878 -5.452 -0.904) 11.319 69.229 ( 7.681 3.927 0.102) 8.627 69.416 ( 10.738 3.333 -1.141) 11.302 69.566 ( 14.066 -3.847 0.510) 14.591 69.690 ( 15.029 -2.883 0.633) 15.316 104.969 ( 1.652 0.239 -0.946) 1.918 104.989 ( 3.320 -0.236 0.335) 3.345 105.007 ( 2.896 0.189 -0.575) 2.959 105.022 ( 3.291 -0.147 1.175) 3.497 ======================= Grid point 112 (55/102) ======================= q-point: (-0.31 0.20 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 Number of triplets: 160 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.591 ( -29.744 10.714 11.783) 33.739 4.087 ( -32.920 5.024 10.243) 34.840 4.700 ( -13.990 -11.611 -0.932) 18.205 4.746 ( -15.507 -10.159 -3.588) 18.883 4.847 ( -10.784 -3.083 -7.704) 13.607 5.049 ( -14.245 -3.974 0.049) 14.789 5.173 ( -15.929 -0.900 -2.643) 16.172 5.237 ( -14.498 1.493 -2.020) 14.714 5.427 ( -14.734 -5.463 -3.993) 16.213 5.480 ( -14.150 -3.178 6.308) 15.815 5.720 ( -7.430 6.978 -1.131) 10.256 5.849 ( -8.226 4.892 -9.346) 13.378 5.994 ( -7.173 -4.084 -1.606) 8.409 6.141 ( -13.942 9.370 -3.037) 17.070 6.254 ( -6.877 0.197 -1.821) 7.116 6.342 ( -4.580 5.679 4.469) 8.556 6.426 ( -8.567 5.566 -0.950) 10.260 6.521 ( -1.086 2.764 1.722) 3.432 6.799 ( -8.931 -3.255 -4.369) 10.462 6.850 ( -9.995 12.688 -2.045) 16.281 6.954 ( -11.301 3.443 -1.149) 11.870 7.157 ( -5.814 4.125 5.138) 8.788 7.241 ( -4.354 4.911 -11.793) 13.496 7.290 ( -7.766 -1.426 -2.321) 8.230 7.339 ( -3.747 -0.119 1.591) 4.072 7.500 ( -3.927 -8.180 -0.629) 9.095 7.581 ( -10.315 -1.504 5.991) 12.023 7.866 ( -2.026 -0.370 7.972) 8.234 7.911 ( -3.984 1.175 -5.395) 6.809 8.010 ( -8.634 -5.736 2.828) 10.744 8.161 ( -5.059 2.884 -10.857) 12.320 8.252 ( -6.127 -0.049 9.867) 11.615 8.304 ( -3.971 2.686 1.610) 5.057 8.413 ( -0.901 -4.032 -3.829) 5.633 8.546 ( -6.820 -2.583 0.198) 7.296 8.574 ( -11.332 5.727 6.880) 14.441 8.672 ( -0.752 -1.804 -2.186) 2.932 8.797 ( -12.126 -2.577 3.832) 12.976 8.954 ( -6.913 3.237 0.277) 7.638 9.109 ( -10.821 -3.578 0.896) 11.432 9.136 ( -8.140 -6.526 -0.160) 10.434 9.236 ( -6.139 -1.630 -3.537) 7.270 9.307 ( -9.745 -1.790 -3.666) 10.565 9.478 ( -18.654 -3.930 3.226) 19.335 9.587 ( -22.019 -0.114 -1.515) 22.071 9.679 ( -17.689 3.488 0.505) 18.036 9.829 ( -11.002 -3.268 9.436) 14.858 9.862 ( -17.243 -1.455 5.398) 18.127 9.959 ( -12.754 -0.532 3.845) 13.331 10.069 ( -10.492 5.620 7.848) 14.257 10.351 ( -3.945 -1.193 9.886) 10.711 10.558 ( -6.491 -1.567 -2.420) 7.103 10.718 ( 0.221 5.056 -8.915) 10.252 10.734 ( -1.740 9.930 -8.358) 13.096 10.946 ( -7.598 -2.627 -7.095) 10.722 11.337 ( -3.391 -2.462 -4.965) 6.497 11.547 ( -5.644 4.248 -10.201) 12.408 11.717 ( -3.312 -0.443 6.523) 7.329 11.815 ( 0.961 2.373 15.469) 15.679 12.030 ( -4.299 -5.483 -8.028) 10.629 12.250 ( -2.674 -0.088 -0.056) 2.676 12.329 ( -5.040 0.626 -2.137) 5.510 12.453 ( 1.490 -3.012 1.674) 3.754 12.479 ( -3.526 -2.724 -0.923) 4.550 13.122 ( -1.727 9.527 1.664) 9.824 13.383 ( -0.661 2.859 -0.717) 3.020 13.766 ( -0.855 -5.453 -0.440) 5.537 13.842 ( -2.259 -3.473 0.971) 4.255 14.135 ( 2.508 -0.564 -2.285) 3.439 14.203 ( 1.560 0.041 4.281) 4.557 14.456 ( -2.134 -2.986 -1.488) 3.960 14.547 ( 1.315 2.432 -0.867) 2.898 14.594 ( -0.204 -1.034 0.208) 1.074 14.679 ( 0.748 -10.605 -1.089) 10.687 14.813 ( 2.761 -0.286 4.894) 5.626 14.942 ( 2.644 3.503 0.524) 4.420 15.016 ( 3.090 3.459 4.298) 6.323 15.113 ( 1.117 -5.820 -2.031) 6.265 15.268 ( 4.074 -3.334 -5.576) 7.669 15.356 ( 6.902 -3.238 -1.602) 7.790 17.817 ( 0.792 12.731 -0.725) 12.776 18.016 ( 3.653 11.479 0.448) 12.054 18.526 ( 0.691 -1.042 0.426) 1.321 18.636 ( -0.593 -5.614 1.567) 5.859 18.762 ( 0.482 3.150 1.174) 3.396 18.800 ( 1.572 0.590 -2.179) 2.751 19.030 ( 4.550 -4.303 -2.347) 6.688 19.202 ( 4.205 -5.944 1.838) 7.509 19.989 ( -8.308 2.383 -1.508) 8.773 20.059 ( -7.093 1.711 0.581) 7.320 20.194 ( -4.399 -1.861 -0.505) 4.803 20.226 ( -4.767 -1.617 1.638) 5.294 21.348 ( -14.738 0.773 4.621) 15.465 21.369 ( -14.836 0.774 -4.290) 15.463 21.429 ( -14.845 -0.710 -2.896) 15.142 21.461 ( -13.259 -1.784 4.415) 14.088 22.105 ( -14.030 5.024 -2.985) 15.198 22.211 ( -15.045 4.402 1.973) 15.799 22.609 ( -14.566 -5.863 2.313) 15.871 22.638 ( -6.149 -7.146 -4.365) 10.389 24.363 ( 1.255 0.661 3.464) 3.743 24.416 ( -1.455 -0.914 0.676) 1.847 24.471 ( -0.581 1.721 -2.283) 2.917 24.578 ( -0.800 -1.334 -2.599) 3.029 28.761 ( -3.584 1.984 0.435) 4.119 28.796 ( -2.879 3.809 0.165) 4.777 28.965 ( 0.637 -2.809 0.448) 2.915 29.086 ( 2.734 -3.553 0.220) 4.488 29.290 ( 1.691 2.695 3.029) 4.393 29.421 ( 1.307 0.117 -1.644) 2.103 29.447 ( 2.904 -0.997 -0.326) 3.088 29.470 ( 2.559 -0.073 -0.911) 2.717 33.485 ( -6.078 2.120 -0.116) 6.438 33.492 ( -6.351 2.431 0.060) 6.801 33.706 ( -6.402 -3.798 0.115) 7.444 33.730 ( -6.139 -3.062 -0.274) 6.865 35.793 ( 1.382 5.765 1.138) 6.036 35.846 ( 3.034 10.136 -1.773) 10.728 36.258 ( 8.925 -6.685 5.718) 12.532 36.612 ( 15.747 -7.671 -4.214) 18.016 37.784 ( 3.803 10.805 0.090) 11.455 37.910 ( 5.361 11.965 0.063) 13.111 38.726 ( 3.442 -7.288 -1.775) 8.253 38.799 ( 4.464 -9.982 0.595) 10.950 38.908 ( 1.963 -2.644 1.493) 3.615 39.211 ( 8.590 -6.688 3.917) 11.570 39.343 ( 8.060 8.068 -6.880) 13.319 39.546 ( 8.233 -0.549 2.691) 8.679 40.224 ( 8.087 -1.229 3.277) 8.811 40.465 ( 11.365 5.550 -5.559) 13.816 41.076 ( 20.224 -3.364 5.248) 21.163 41.177 ( 22.741 -0.358 -2.951) 22.934 43.137 ( 6.192 8.723 2.056) 10.893 43.611 ( 15.216 4.365 -7.263) 17.416 43.830 ( 10.062 -5.208 6.155) 12.894 44.114 ( 13.633 -4.862 -0.824) 14.498 69.414 ( 10.563 5.728 0.285) 12.020 69.670 ( 14.788 5.389 -1.477) 15.809 69.914 ( 20.601 -6.006 -0.551) 21.465 70.076 ( 23.191 -3.579 2.132) 23.563 105.009 ( 2.498 0.525 -0.957) 2.726 105.056 ( 3.477 -0.695 -1.155) 3.729 105.088 ( 4.951 0.342 0.501) 4.988 105.102 ( 4.452 -0.075 1.592) 4.728 ======================= Grid point 113 (56/102) ======================= q-point: (-0.25 0.20 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 Number of triplets: 160 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.017 ( -30.831 12.453 20.230) 38.922 3.434 ( -33.940 13.668 14.158) 39.233 4.361 ( -19.003 -9.792 -6.359) 22.303 4.394 ( -18.489 -8.503 -5.861) 21.178 4.577 ( -13.874 -4.274 -12.985) 19.477 4.713 ( -21.557 -2.520 0.530) 21.710 4.779 ( -21.817 1.983 4.091) 22.285 4.889 ( -19.184 -1.853 -1.977) 19.374 5.117 ( -14.849 -7.647 -6.916) 18.078 5.201 ( -15.877 -4.326 6.021) 17.523 5.502 ( -13.935 6.236 5.081) 16.090 5.660 ( -22.263 7.978 2.546) 23.786 5.781 ( -11.979 0.957 -4.006) 12.667 5.832 ( -11.383 4.386 5.070) 13.211 6.022 ( -14.513 -8.816 -3.498) 17.337 6.182 ( -16.216 2.529 -6.749) 17.746 6.244 ( -9.482 4.427 -2.217) 10.697 6.441 ( -10.672 5.624 -5.157) 13.120 6.475 ( -4.498 -0.486 -5.690) 7.269 6.707 ( -8.268 3.306 -1.890) 9.103 6.758 ( -11.243 7.754 0.738) 13.677 6.865 ( -21.332 5.067 -3.827) 22.258 7.070 ( -15.500 0.640 2.157) 15.663 7.114 ( -5.188 4.342 -1.529) 6.935 7.213 ( -3.596 2.241 -8.734) 9.708 7.365 ( -0.662 2.093 -5.904) 6.299 7.537 ( -13.472 -0.839 7.152) 15.276 7.610 ( -26.000 -8.138 3.510) 27.469 7.720 ( -3.393 -6.518 -3.495) 8.137 7.833 ( -19.996 4.521 2.596) 20.664 7.937 ( -13.012 0.186 11.210) 17.176 8.092 ( -11.459 -9.810 -5.839) 16.175 8.139 ( -6.365 2.017 -8.470) 10.786 8.289 ( -14.961 -2.761 7.969) 17.174 8.347 ( -9.555 1.091 6.880) 11.824 8.462 ( -1.930 -0.878 7.399) 7.697 8.567 ( -6.770 4.536 3.327) 8.802 8.629 ( -7.842 -0.103 -5.222) 9.422 8.735 ( -13.639 4.535 -1.969) 14.507 8.841 ( -12.890 -0.814 -5.838) 14.174 8.892 ( -10.436 -2.655 3.376) 11.285 8.994 ( -23.894 -4.967 0.674) 24.414 9.100 ( -16.388 3.790 -3.694) 17.221 9.123 ( -15.469 0.842 0.864) 15.516 9.280 ( -6.997 -2.796 -4.122) 8.588 9.401 ( -14.620 -2.073 0.581) 14.777 9.608 ( -6.647 -3.552 2.039) 7.808 9.645 ( -2.967 -3.035 5.820) 7.203 9.791 ( -2.631 -5.695 8.829) 10.830 9.895 ( -6.591 0.388 4.712) 8.112 10.335 ( -0.266 -5.527 7.618) 9.415 10.402 ( -8.449 -4.218 1.655) 9.587 10.591 ( -8.511 4.815 -8.546) 12.987 10.791 ( -4.561 -1.115 -9.116) 10.254 10.830 ( 5.168 13.147 5.610) 15.199 11.260 ( -2.135 4.623 -3.776) 6.340 11.438 ( -0.963 5.022 -17.524) 18.254 11.729 ( 1.528 0.843 10.117) 10.267 11.884 ( 2.197 5.627 17.380) 18.400 11.935 ( -3.204 -3.426 -10.728) 11.708 12.239 ( 0.842 1.780 1.475) 2.460 12.282 ( 1.165 -0.844 -1.523) 2.095 12.499 ( 4.695 -7.421 -0.860) 8.823 12.578 ( 9.246 -3.963 0.879) 10.098 13.063 ( -3.934 6.891 -0.206) 7.937 13.307 ( -6.665 1.483 0.524) 6.848 13.642 ( -11.281 -5.885 3.762) 13.268 13.772 ( -4.373 -2.526 -3.039) 5.894 14.181 ( 2.772 -2.508 -2.808) 4.676 14.252 ( 2.172 0.460 4.316) 4.854 14.408 ( -1.948 -1.575 -2.078) 3.254 14.541 ( -0.887 1.560 0.947) 2.029 14.621 ( 1.740 0.967 -0.590) 2.076 14.729 ( 4.298 -8.542 -2.347) 9.847 14.885 ( 3.081 2.089 4.303) 5.690 15.022 ( 5.481 0.252 2.706) 6.118 15.091 ( 2.632 0.567 4.312) 5.083 15.157 ( 4.677 -2.022 -2.642) 5.740 15.354 ( 6.312 -1.586 -8.262) 10.517 15.508 ( 8.645 -3.584 -1.025) 9.414 17.840 ( 1.567 12.271 -0.600) 12.385 18.108 ( 5.377 10.857 0.232) 12.118 18.527 ( -0.896 -1.641 0.261) 1.888 18.633 ( -0.101 -4.209 2.077) 4.695 18.759 ( -1.001 4.379 1.136) 4.634 18.842 ( 2.649 0.743 -1.389) 3.082 19.110 ( 3.937 -5.311 -3.110) 7.307 19.292 ( 4.412 -6.577 1.949) 8.156 19.794 ( -10.571 3.101 -2.004) 11.197 19.897 ( -9.012 2.024 1.060) 9.297 20.087 ( -6.069 -3.241 -1.396) 7.020 20.122 ( -5.936 -2.485 2.329) 6.843 21.038 ( -16.542 0.792 -2.080) 16.691 21.047 ( -16.365 1.070 2.337) 16.566 21.112 ( -15.814 -0.837 -2.958) 16.110 21.184 ( -15.099 -2.033 4.863) 15.992 21.772 ( -18.259 5.463 -5.080) 19.724 21.865 ( -19.866 3.870 3.557) 20.549 22.269 ( -20.016 -6.218 7.326) 22.203 22.481 ( -8.380 -11.803 -11.499) 18.487 24.398 ( -0.393 -0.122 0.670) 0.786 24.407 ( 2.467 0.032 2.636) 3.610 24.468 ( 0.729 1.867 -1.791) 2.688 24.559 ( -0.470 -0.992 -2.384) 2.625 28.692 ( -3.249 3.063 -0.009) 4.465 28.743 ( -2.390 5.583 0.650) 6.107 28.975 ( 0.248 -4.044 1.329) 4.264 29.144 ( 2.947 -5.038 0.231) 5.841 29.338 ( 2.520 3.083 2.850) 4.897 29.446 ( 1.637 0.787 -1.894) 2.625 29.504 ( 2.736 -0.838 -0.158) 2.866 29.522 ( 2.738 -0.208 -0.847) 2.873 33.347 ( -7.476 2.402 -0.053) 7.853 33.357 ( -6.992 1.584 -0.118) 7.170 33.562 ( -7.827 -4.352 -0.001) 8.956 33.595 ( -7.173 -3.669 -0.377) 8.065 35.838 ( 2.720 8.248 1.584) 8.828 35.934 ( 6.263 15.025 -3.065) 16.564 36.469 ( 10.677 -9.035 9.187) 16.734 36.958 ( 19.741 -8.568 -5.589) 22.234 37.877 ( 5.143 9.268 0.971) 10.644 38.019 ( 5.566 12.249 -0.671) 13.471 38.800 ( 4.270 -3.631 -3.573) 6.646 38.918 ( 7.125 -12.678 3.429) 14.942 38.962 ( 3.038 -3.756 1.513) 5.063 39.394 ( 8.997 -4.047 2.131) 10.093 39.507 ( 9.191 8.445 -4.445) 13.250 39.707 ( 7.220 -0.133 1.695) 7.418 40.417 ( 10.214 1.883 6.718) 12.370 40.726 ( 16.236 6.960 -11.670) 21.172 41.499 ( 20.531 -2.740 9.376) 22.737 41.689 ( 28.483 -2.378 -4.399) 28.919 43.280 ( 7.349 9.078 3.959) 12.332 43.886 ( 13.473 -2.300 -9.714) 16.768 44.124 ( 18.220 -0.252 7.434) 19.680 44.413 ( 16.174 -3.820 -0.874) 16.642 69.645 ( 12.055 8.217 1.058) 14.627 69.993 ( 17.796 8.678 -3.684) 20.139 70.382 ( 26.046 -8.346 -0.463) 27.355 70.627 ( 31.149 -4.415 4.366) 31.761 105.062 ( 2.955 0.766 -0.720) 3.136 105.125 ( 3.623 -0.746 -1.178) 3.882 105.187 ( 4.789 0.480 0.423) 4.831 105.217 ( 6.617 -0.282 1.484) 6.787 ======================= Grid point 114 (57/102) ======================= q-point: (-0.19 0.20 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 Number of triplets: 160 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.447 ( -30.721 14.448 26.948) 43.344 2.818 ( -30.903 21.710 21.551) 43.483 3.911 ( -25.512 -5.043 -6.905) 26.906 3.972 ( -22.901 -3.460 -9.241) 24.936 4.118 ( -35.938 9.423 5.883) 37.616 4.231 ( -17.681 3.081 -19.666) 26.624 4.372 ( -21.463 -7.246 2.065) 22.747 4.511 ( -16.941 -8.878 4.636) 19.680 4.789 ( -24.548 -1.230 0.646) 24.587 4.813 ( -19.528 -8.039 -2.728) 21.294 5.001 ( -28.085 1.599 5.930) 28.749 5.278 ( -26.777 7.209 6.912) 28.579 5.366 ( -20.272 -4.624 6.405) 21.757 5.538 ( -18.339 1.476 -1.271) 18.443 5.723 ( -14.926 -2.073 2.351) 15.252 5.896 ( -9.099 2.057 -13.440) 16.360 6.042 ( -10.584 6.634 -20.911) 24.358 6.227 ( -9.275 3.893 -1.844) 10.226 6.411 ( -9.263 -0.046 -1.807) 9.437 6.430 ( -8.572 2.834 -8.222) 12.211 6.476 ( -11.863 2.752 7.106) 14.100 6.632 ( -4.400 -0.728 -6.207) 7.643 6.794 ( -19.323 1.396 3.689) 19.722 6.909 ( -22.394 -1.577 -2.392) 22.576 6.919 ( -26.413 1.976 -0.908) 26.502 7.094 ( -12.426 0.199 -11.799) 17.137 7.198 ( -14.053 -5.691 6.263) 16.404 7.355 ( -7.666 1.221 0.061) 7.763 7.408 ( -8.794 13.316 -6.384) 17.187 7.513 ( -16.359 -20.489 3.904) 26.508 7.749 ( -9.171 -5.803 -6.568) 12.686 7.859 ( -11.423 0.141 3.104) 11.838 8.019 ( -9.017 -1.655 7.812) 12.045 8.094 ( -10.130 10.733 11.369) 18.629 8.164 ( -6.558 -4.299 3.600) 8.628 8.274 ( -22.635 -0.014 -4.396) 23.058 8.329 ( -13.262 4.455 5.154) 14.909 8.375 ( -10.311 -6.785 -1.361) 12.418 8.435 ( -19.456 2.702 0.312) 19.646 8.567 ( -7.411 1.388 -8.848) 11.625 8.593 ( -16.515 -3.744 0.005) 16.934 8.717 ( -9.685 6.536 9.060) 14.786 8.849 ( -10.090 1.894 2.068) 10.473 8.953 ( -2.337 -4.060 -2.851) 5.484 9.137 ( -2.107 -0.722 -3.971) 4.552 9.162 ( -6.087 10.050 2.812) 12.082 9.440 ( -6.282 -1.607 -4.199) 7.725 9.672 ( -3.218 -0.659 6.863) 7.608 9.838 ( 2.215 -14.241 7.351) 16.179 9.892 ( 2.288 -9.015 -2.777) 9.707 10.222 ( -5.697 -5.369 5.353) 9.484 10.381 ( 0.516 -8.994 3.803) 9.778 10.386 ( -8.609 1.117 -5.934) 10.515 10.626 ( -8.637 -9.212 2.714) 12.916 10.988 ( 7.764 20.919 1.038) 22.338 11.273 ( 3.778 8.553 -1.254) 9.434 11.437 ( 4.210 5.438 -18.913) 20.125 11.770 ( 0.730 -0.873 -5.093) 5.219 11.898 ( 1.739 2.787 3.783) 5.010 11.968 ( 2.353 7.464 16.668) 18.414 12.262 ( 0.681 -1.307 1.121) 1.852 12.358 ( 5.382 1.092 0.234) 5.497 12.582 ( 1.370 -5.811 0.280) 5.977 12.772 ( 8.709 -2.060 -0.142) 8.951 13.001 ( -1.784 -2.255 -1.619) 3.300 13.144 ( -7.989 0.259 0.959) 8.050 13.369 ( -15.531 -1.546 5.378) 16.508 13.670 ( -4.285 -1.096 -1.506) 4.672 14.234 ( 3.132 -3.231 -3.263) 5.558 14.297 ( 1.343 0.900 3.115) 3.509 14.377 ( -0.429 -0.651 -3.302) 3.392 14.538 ( 0.558 1.379 0.647) 1.622 14.649 ( 1.105 1.699 1.069) 2.291 14.816 ( 4.263 -4.746 -1.461) 6.544 14.954 ( 3.106 3.507 3.977) 6.146 15.147 ( 4.228 -6.431 0.867) 7.745 15.178 ( 7.827 2.396 4.814) 9.496 15.279 ( 7.388 1.424 -1.193) 7.618 15.491 ( 9.142 0.351 -9.333) 13.069 15.702 ( 11.235 -3.139 -2.062) 11.846 17.871 ( 1.296 11.722 -0.118) 11.794 18.226 ( 6.076 9.013 -0.360) 10.876 18.484 ( -3.626 -1.403 0.572) 3.930 18.626 ( -1.580 -1.597 0.745) 2.367 18.737 ( -0.942 3.645 2.494) 4.516 18.891 ( 2.305 -0.009 -0.809) 2.443 19.176 ( 3.435 -6.763 -3.968) 8.560 19.386 ( 4.450 -7.456 2.240) 8.967 19.575 ( -10.145 3.900 -2.147) 11.079 19.715 ( -9.009 2.191 1.327) 9.366 19.951 ( -6.899 -4.848 -2.432) 8.776 20.003 ( -6.413 -3.653 2.759) 7.879 20.704 ( -15.465 1.005 -3.769) 15.949 20.731 ( -15.549 1.417 4.223) 16.175 20.799 ( -14.454 -0.870 -2.619) 14.716 20.889 ( -15.044 -2.047 4.800) 15.923 21.361 ( -21.113 4.972 -6.696) 22.701 21.444 ( -22.639 3.029 4.615) 23.303 21.845 ( -24.075 -6.655 10.722) 27.182 22.229 ( -14.357 -18.832 -20.894) 31.580 24.402 ( 0.689 0.646 0.954) 1.343 24.471 ( 2.979 -0.258 1.094) 3.184 24.493 ( 2.276 1.674 -0.876) 2.958 24.552 ( 0.265 -0.175 -1.635) 1.666 28.635 ( -2.363 4.216 -0.104) 4.834 28.703 ( -1.730 7.426 0.434) 7.637 28.983 ( 0.130 -4.933 2.777) 5.663 29.202 ( 2.691 -6.482 -0.010) 7.019 29.400 ( 2.978 3.087 2.601) 5.016 29.478 ( 1.952 1.294 -2.009) 3.085 29.554 ( 2.333 -0.244 -0.037) 2.346 29.574 ( 2.552 -0.155 -0.710) 2.653 33.196 ( -7.330 2.302 0.114) 7.683 33.217 ( -6.798 1.086 -0.502) 6.902 33.398 ( -8.352 -4.376 -0.006) 9.428 33.443 ( -7.805 -4.491 -0.924) 9.052 35.904 ( 3.310 10.969 2.338) 11.694 36.081 ( 9.242 20.531 -5.759) 23.240 36.726 ( 12.534 -11.497 14.586) 22.406 37.371 ( 22.377 -8.664 -5.995) 24.733 37.984 ( 5.206 7.673 0.177) 9.274 38.134 ( 5.938 11.389 0.291) 12.848 38.874 ( 4.030 0.034 -5.586) 6.888 39.031 ( 3.273 -4.689 3.397) 6.651 39.096 ( 9.439 -15.141 4.595) 18.425 39.575 ( 8.511 0.744 0.820) 8.583 39.680 ( 8.499 6.531 -1.617) 10.840 39.835 ( 5.275 0.486 0.671) 5.340 40.669 ( 13.695 9.557 8.182) 18.597 41.051 ( 18.736 9.248 -17.589) 27.312 41.930 ( 19.759 -2.118 13.033) 23.764 42.273 ( 30.045 -3.572 -4.458) 30.583 43.447 ( 8.243 9.277 8.423) 14.998 44.121 ( 11.977 -6.254 -6.123) 14.834 44.565 ( 23.849 1.352 2.855) 24.058 44.744 ( 16.582 -2.160 -1.016) 16.753 69.890 ( 11.752 11.234 2.419) 16.437 70.352 ( 18.840 13.105 -8.110) 24.341 70.949 ( 30.334 -9.353 0.949) 31.757 71.335 ( 37.873 -5.050 8.284) 39.096 105.121 ( 2.932 0.919 -0.196) 3.079 105.193 ( 3.299 -0.798 -0.647) 3.455 105.283 ( 4.691 1.234 0.032) 4.851 105.363 ( 7.506 -0.830 1.082) 7.629 ======================= Grid point 115 (58/102) ======================= q-point: (-0.12 0.20 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 Number of triplets: 160 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.928 ( -26.417 20.441 31.737) 46.076 2.254 ( -32.723 19.843 24.173) 45.264 3.234 ( -39.016 32.632 20.242) 54.743 3.384 ( -36.160 3.728 -18.019) 40.573 3.439 ( -30.729 -11.697 5.209) 33.290 3.826 ( -16.751 12.268 -24.206) 31.891 3.914 ( -22.533 -8.291 -1.461) 24.054 4.176 ( -24.617 2.909 16.475) 29.764 4.281 ( -12.457 -17.343 0.668) 21.364 4.457 ( -22.128 -9.531 -0.978) 24.113 4.527 ( -22.291 -5.140 -2.631) 23.027 4.666 ( -20.852 -2.989 -3.809) 21.407 5.039 ( -17.210 1.974 2.292) 17.474 5.294 ( -14.980 5.647 -4.111) 16.528 5.316 ( -16.229 5.692 6.897) 18.529 5.567 ( -19.871 9.989 -1.000) 22.263 5.810 ( -11.305 -1.616 -17.753) 21.109 6.045 ( -18.680 -6.584 -5.051) 20.441 6.149 ( -10.886 1.151 -1.282) 11.021 6.195 ( -16.987 0.779 3.835) 17.431 6.340 ( -8.646 -6.744 -6.500) 12.748 6.364 ( -15.780 0.984 -10.157) 18.793 6.437 ( -8.724 1.722 -8.143) 12.057 6.447 ( -6.899 1.309 0.265) 7.027 6.633 ( -3.271 -0.621 -1.121) 3.513 6.917 ( -5.449 1.674 -13.434) 14.594 6.993 ( -10.167 -12.207 8.645) 18.086 7.198 ( -7.076 -11.309 1.583) 13.434 7.239 ( -11.000 4.211 -1.332) 11.854 7.273 ( -12.025 3.252 1.279) 12.523 7.509 ( -11.266 -1.417 -4.406) 12.180 7.582 ( -11.857 -0.852 -3.396) 12.363 7.792 ( -16.275 8.801 4.894) 19.138 7.863 ( -13.100 -0.178 0.568) 13.114 7.885 ( -11.674 -4.317 -1.394) 12.524 8.010 ( -11.720 2.198 -6.176) 13.429 8.095 ( -13.571 -6.340 5.070) 15.814 8.155 ( -8.149 7.797 14.685) 18.517 8.180 ( -7.012 0.121 7.225) 10.069 8.288 ( -10.644 -2.925 -2.319) 11.280 8.476 ( -3.304 -6.497 -8.432) 11.146 8.580 ( -0.824 3.062 4.586) 5.575 8.763 ( -1.302 8.339 11.829) 14.531 8.932 ( 0.179 -3.509 -3.695) 5.099 9.093 ( -2.208 8.735 -1.999) 9.229 9.161 ( 1.326 1.455 0.057) 1.970 9.335 ( -3.869 -1.103 -4.864) 6.312 9.592 ( -4.523 2.131 2.074) 5.413 9.715 ( -14.328 -2.906 -0.726) 14.637 9.884 ( -0.125 -15.447 4.013) 15.960 10.239 ( -3.824 -7.829 5.052) 10.072 10.268 ( -4.514 -7.325 -4.979) 9.941 10.343 ( 4.374 -11.757 1.203) 12.602 10.565 ( 0.657 -18.226 8.856) 20.274 11.126 ( 6.068 22.982 -3.443) 24.018 11.380 ( 6.962 5.094 -5.689) 10.334 11.506 ( 5.370 6.563 -10.223) 13.282 11.772 ( 2.363 1.041 -10.460) 10.774 11.987 ( 3.814 7.233 12.643) 15.056 12.044 ( 2.135 7.379 13.570) 15.593 12.245 ( -2.930 -3.089 0.757) 4.324 12.409 ( -3.268 -0.249 0.063) 3.278 12.574 ( 0.273 0.279 1.620) 1.667 12.814 ( -11.029 -3.980 0.259) 11.727 12.899 ( -4.079 -2.078 0.034) 4.578 13.058 ( -1.032 -4.764 3.705) 6.123 13.232 ( 4.389 3.189 1.599) 5.656 13.648 ( 3.308 3.034 2.121) 4.964 14.290 ( 3.185 -4.317 -4.359) 6.913 14.324 ( 1.312 1.605 0.992) 2.298 14.374 ( 0.584 -0.261 -3.383) 3.443 14.561 ( 1.360 0.790 0.087) 1.575 14.672 ( 0.830 2.546 3.454) 4.371 14.883 ( 2.519 -0.026 -0.044) 2.519 15.030 ( 3.581 4.149 5.936) 8.079 15.242 ( 5.566 -7.010 -2.590) 9.318 15.358 ( 7.225 1.595 12.943) 14.908 15.440 ( 9.203 3.125 -3.719) 10.406 15.668 ( 10.206 3.568 -9.910) 14.666 15.961 ( 15.689 -1.326 -4.991) 16.517 17.879 ( -0.809 10.696 0.912) 10.765 18.316 ( 1.569 5.380 -0.972) 5.688 18.382 ( -6.448 -0.776 0.821) 6.546 18.575 ( -2.182 -0.212 -0.543) 2.258 18.751 ( 1.629 2.885 2.678) 4.261 18.919 ( 0.213 -2.835 -1.201) 3.086 19.233 ( 2.971 -9.238 -4.544) 10.715 19.402 ( -4.801 4.436 -0.097) 6.537 19.476 ( 1.810 -9.194 1.608) 9.507 19.554 ( -6.678 3.285 0.869) 7.493 19.816 ( -5.280 -5.972 -3.165) 8.577 19.886 ( -5.457 -4.343 2.108) 7.286 20.428 ( -10.824 1.261 -2.415) 11.162 20.457 ( -12.207 1.672 3.021) 12.686 20.538 ( -10.726 -0.592 -2.046) 10.935 20.616 ( -12.757 -1.813 4.300) 13.584 20.919 ( -20.889 3.434 -6.949) 22.281 20.999 ( -22.121 1.654 4.640) 22.663 21.359 ( -26.327 -6.285 10.963) 29.202 21.763 ( -28.384 -25.922 -31.830) 49.907 24.426 ( 1.367 1.265 1.367) 2.311 24.515 ( 1.882 1.162 -1.039) 2.444 24.551 ( 1.905 0.509 0.782) 2.121 24.574 ( 2.980 0.319 -0.679) 3.073 28.599 ( -1.226 5.160 0.056) 5.304 28.677 ( -0.830 9.349 -0.812) 9.421 28.996 ( 0.484 -5.583 4.602) 7.252 29.249 ( 1.929 -7.823 -0.502) 8.073 29.463 ( 2.569 2.653 2.302) 4.351 29.514 ( 2.018 1.482 -2.150) 3.300 29.598 ( 2.116 0.775 0.116) 2.256 29.619 ( 2.043 0.124 -0.410) 2.088 33.063 ( -5.819 2.046 0.198) 6.172 33.091 ( -5.415 0.664 -0.930) 5.534 33.236 ( -7.636 -3.882 -0.271) 8.570 33.280 ( -8.147 -4.537 -1.470) 9.441 35.975 ( 3.061 13.667 3.465) 14.427 36.266 ( 10.405 24.662 -10.825) 28.873 37.043 ( 15.722 -13.700 21.120) 29.680 37.809 ( 21.564 -9.435 -4.002) 23.876 38.082 ( 4.812 8.469 -0.957) 9.788 38.246 ( 4.665 6.674 0.554) 8.162 38.940 ( 3.892 4.377 -6.361) 8.647 39.101 ( 2.697 -6.203 4.745) 8.262 39.304 ( 9.967 -15.331 5.011) 18.961 39.723 ( 5.561 0.708 0.810) 5.664 39.833 ( 6.821 6.890 -0.168) 9.697 39.921 ( 3.233 1.153 0.692) 3.501 41.026 ( 21.433 22.952 3.645) 31.614 41.379 ( 17.737 14.398 -23.389) 32.696 42.328 ( 16.372 -0.628 17.504) 23.976 42.838 ( 26.239 -3.200 -5.281) 26.956 43.671 ( 12.664 8.539 20.239) 25.355 44.345 ( 11.213 -7.834 -1.351) 13.745 45.050 ( 16.503 0.048 -0.894) 16.528 45.059 ( 21.411 0.154 -0.950) 21.433 70.113 ( 9.493 14.406 4.297) 17.779 70.697 ( 17.627 17.734 -15.194) 29.258 71.592 ( 33.146 -6.351 3.199) 33.900 72.163 ( 41.859 -6.317 14.291) 44.680 105.176 ( 2.519 0.999 0.648) 2.787 105.253 ( 2.757 -0.828 1.002) 3.048 105.373 ( 4.283 2.560 -0.832) 5.059 105.512 ( 6.869 -1.460 0.666) 7.054 ======================= Grid point 116 (59/102) ======================= q-point: (-0.06 0.20 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 Number of triplets: 160 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.446 ( -37.576 18.556 17.645) 45.471 1.645 ( -19.803 28.878 35.989) 50.213 2.558 ( -36.339 9.972 -17.907) 41.721 2.707 ( -19.646 51.362 46.278) 71.873 2.895 ( -22.933 -15.239 8.311) 28.761 3.438 ( -17.915 -3.535 -9.961) 20.801 3.570 ( -8.756 4.990 -20.998) 23.291 3.812 ( -13.708 7.222 7.980) 17.428 3.913 ( -18.760 -17.011 5.900) 26.003 4.137 ( -10.479 -5.400 10.401) 15.721 4.235 ( -7.833 -8.814 -9.197) 14.954 4.415 ( -4.065 -6.784 -12.447) 14.747 4.729 ( -12.917 8.139 0.526) 15.277 4.847 ( -18.236 9.455 -3.936) 20.915 5.165 ( -9.613 2.304 -3.106) 10.362 5.291 ( -5.618 3.089 11.696) 13.338 5.478 ( -17.505 -2.088 -0.768) 17.646 5.544 ( -18.512 -1.811 0.158) 18.601 5.896 ( -11.172 -2.794 -7.822) 13.921 6.013 ( -3.847 -3.886 -20.753) 21.461 6.167 ( -3.659 -7.295 -13.941) 16.154 6.260 ( 0.732 2.088 4.648) 5.147 6.381 ( 0.067 0.778 -4.809) 4.872 6.406 ( 1.646 2.413 -10.177) 10.588 6.591 ( -1.883 0.024 -0.946) 2.108 6.768 ( -7.243 0.564 -6.701) 9.883 6.835 ( -9.478 -7.736 2.401) 12.468 6.911 ( -12.046 -13.746 6.182) 19.294 6.997 ( -8.760 6.237 -8.605) 13.772 7.178 ( -2.927 -3.994 1.193) 5.093 7.351 ( -5.044 0.055 3.443) 6.108 7.394 ( -6.811 -3.118 -4.825) 8.910 7.548 ( -7.218 8.560 2.330) 11.437 7.600 ( -9.845 -1.693 -2.114) 10.210 7.739 ( -6.868 -7.388 0.833) 10.121 7.760 ( -8.971 5.492 -4.918) 11.611 7.895 ( -7.382 1.997 6.222) 9.859 8.018 ( -4.998 8.335 2.923) 10.149 8.097 ( -3.175 -2.199 5.990) 7.127 8.204 ( -0.951 -3.305 7.185) 7.966 8.435 ( 1.133 -11.695 -6.030) 13.206 8.651 ( 4.751 0.414 2.262) 5.278 8.756 ( -3.831 11.261 13.235) 17.795 8.910 ( -3.464 -1.634 -4.526) 5.929 9.024 ( -3.850 7.521 -1.562) 8.592 9.119 ( -3.884 -5.579 -6.288) 9.260 9.273 ( -1.818 -0.602 4.730) 5.103 9.472 ( -8.258 3.963 5.115) 10.491 9.541 ( -1.055 2.047 -3.259) 3.991 9.848 ( -3.592 -6.927 0.628) 7.828 10.050 ( -7.898 -14.063 -5.143) 16.930 10.282 ( 1.898 -11.832 7.776) 14.285 10.474 ( 3.382 -18.592 12.448) 22.628 10.584 ( -0.063 -14.996 -4.180) 15.568 11.206 ( 3.454 18.822 -14.797) 24.190 11.498 ( 5.828 4.518 -14.715) 16.459 11.609 ( 5.471 0.414 6.542) 8.538 11.819 ( 2.746 4.905 -2.690) 6.231 12.057 ( 0.445 7.272 8.894) 11.497 12.119 ( 2.697 5.253 8.660) 10.482 12.164 ( -3.757 -2.352 1.614) 4.717 12.295 ( -5.474 -0.434 0.302) 5.499 12.473 ( -10.913 -2.116 -0.363) 11.123 12.570 ( -9.658 0.888 8.461) 12.871 12.889 ( 4.200 5.932 2.402) 7.655 13.157 ( 6.010 -3.223 1.224) 6.929 13.337 ( 3.935 -1.475 0.586) 4.244 13.809 ( 10.093 5.157 -2.351) 11.575 14.334 ( 1.646 -7.599 -5.340) 9.432 14.361 ( 1.930 1.235 -5.226) 5.706 14.395 ( 3.094 0.887 -1.095) 3.400 14.586 ( 0.967 -0.908 -0.194) 1.341 14.706 ( 1.950 1.319 8.407) 8.730 14.916 ( 0.879 4.308 -0.868) 4.482 15.132 ( 4.418 2.624 13.641) 14.577 15.345 ( 4.801 -8.756 -2.776) 10.365 15.495 ( 3.502 4.270 10.839) 12.164 15.650 ( 12.239 3.778 7.583) 14.885 15.842 ( 9.184 9.755 -10.206) 16.842 16.315 ( 20.961 1.973 -10.049) 23.329 17.845 ( -2.241 8.850 2.560) 9.481 18.247 ( -5.468 -0.253 -0.743) 5.524 18.267 ( -5.449 0.854 -0.685) 5.558 18.536 ( -5.808 -6.745 -2.392) 9.216 18.796 ( 1.430 4.462 0.407) 4.703 18.845 ( -8.144 -6.971 -2.829) 11.087 19.263 ( 1.360 -10.290 -3.423) 10.929 19.375 ( -5.230 -8.870 1.193) 10.366 19.406 ( 1.142 5.261 -1.038) 5.483 19.520 ( 0.213 0.975 -1.847) 2.099 19.748 ( -2.343 -6.396 3.070) 7.471 19.820 ( 0.335 -2.026 -3.680) 4.214 20.260 ( -7.088 1.784 1.325) 7.429 20.281 ( -4.059 1.736 -1.372) 4.623 20.378 ( -4.518 -0.482 -1.737) 4.864 20.413 ( -7.916 -1.572 3.238) 8.696 20.539 ( -14.043 1.451 -4.245) 14.742 20.604 ( -17.387 -0.322 2.376) 17.552 20.869 ( -23.060 -4.308 6.209) 24.267 20.957 ( -40.474 -14.134 -24.646) 49.451 24.456 ( 1.090 1.647 1.728) 2.624 24.547 ( 1.375 1.299 -0.758) 2.038 24.578 ( 1.039 1.325 1.134) 2.030 24.640 ( 2.825 -0.284 -0.993) 3.008 28.584 ( -0.431 5.710 0.494) 5.747 28.667 ( 0.233 10.663 -3.483) 11.220 29.025 ( 1.360 -6.316 6.130) 8.906 29.273 ( 0.575 -9.035 -1.208) 9.133 29.501 ( 0.686 1.820 1.652) 2.552 29.549 ( 1.772 1.448 -2.128) 3.125 29.641 ( 1.990 1.482 0.139) 2.485 29.651 ( 1.175 0.572 -0.227) 1.327 32.973 ( -2.996 1.769 0.066) 3.479 33.002 ( -3.123 0.444 -1.394) 3.449 33.096 ( -6.315 -3.015 -0.524) 7.017 33.129 ( -5.694 -1.963 -0.591) 6.051 36.034 ( 1.775 15.679 4.672) 16.456 36.422 ( 7.242 24.183 -16.206) 29.999 37.441 ( 18.304 -17.751 22.166) 33.785 38.142 ( 8.380 -17.496 0.515) 19.406 38.188 ( 7.526 16.962 -2.583) 18.735 38.302 ( 0.814 -2.792 -2.482) 3.824 39.018 ( 5.216 8.863 -3.089) 10.738 39.147 ( 0.464 -8.884 5.832) 10.638 39.497 ( 7.935 -9.241 2.156) 12.370 39.777 ( -0.618 -1.422 -0.640) 1.677 39.943 ( 3.947 5.932 -0.057) 7.125 39.972 ( 1.398 0.434 2.614) 2.995 41.507 ( 23.599 23.891 -18.423) 38.303 41.631 ( 11.922 29.502 -32.356) 45.381 42.648 ( 11.351 3.472 19.554) 22.875 43.250 ( 15.121 -2.185 -7.772) 17.141 44.168 ( 33.817 -0.204 40.732) 52.941 44.556 ( 9.115 -8.111 5.185) 13.257 45.277 ( 8.678 2.841 -0.545) 9.147 45.470 ( 15.800 -1.996 -1.747) 16.021 70.277 ( 5.477 17.071 6.395) 19.034 70.978 ( 14.272 20.373 -25.262) 35.453 72.251 ( 29.822 0.383 3.834) 30.070 73.001 ( 33.859 -14.186 10.661) 38.228 105.224 ( 1.982 1.093 1.883) 2.944 105.315 ( 3.004 -1.721 3.936) 5.242 105.457 ( 4.916 4.002 -1.337) 6.479 105.624 ( 3.731 -1.958 0.039) 4.214 ======================= Grid point 117 (60/102) ======================= q-point: ( 0.00 0.40 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 Number of triplets: 160 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.575 ( 2.585 31.258 13.383) 34.100 2.120 ( 0.549 -15.925 7.457) 17.593 2.375 ( -0.788 17.099 -6.333) 18.251 2.431 ( 0.403 27.842 7.238) 28.770 2.851 ( -1.820 -14.113 -13.560) 19.657 3.238 ( 0.086 -33.097 9.665) 34.479 3.619 ( 1.876 22.662 7.760) 24.027 3.796 ( -1.989 6.967 -2.322) 7.609 3.846 ( -1.716 9.570 22.841) 24.825 3.942 ( -1.829 3.130 7.251) 8.106 4.008 ( 2.422 13.280 -11.556) 17.770 4.411 ( 4.062 5.674 -15.781) 17.255 4.706 ( 3.665 -4.230 -9.091) 10.676 4.791 ( -0.439 -11.037 -5.215) 12.215 4.975 ( -4.421 15.367 3.141) 16.296 5.161 ( 1.644 -3.018 -1.038) 3.591 5.232 ( -0.087 -2.996 0.889) 3.126 5.479 ( -2.111 -18.187 -1.785) 18.396 5.566 ( -1.303 6.739 20.397) 21.521 5.858 ( -2.633 -18.824 21.573) 28.751 6.015 ( -2.537 -1.615 -15.373) 15.665 6.027 ( -0.761 -6.328 -8.571) 10.681 6.457 ( 3.768 -0.091 -4.485) 5.858 6.460 ( 4.248 -0.658 -3.565) 5.584 6.579 ( 2.054 7.001 -8.260) 11.021 6.646 ( -0.636 3.398 0.090) 3.459 6.666 ( -0.868 -2.332 -0.873) 2.637 6.694 ( 0.450 -1.210 0.084) 1.293 6.989 ( 1.750 7.477 -9.906) 12.534 7.153 ( 2.853 -6.045 -3.136) 7.383 7.265 ( -1.720 6.345 -13.083) 14.642 7.385 ( -2.506 -0.448 3.083) 3.998 7.442 ( 0.553 0.148 -2.400) 2.467 7.507 ( -2.153 -1.459 0.509) 2.650 7.545 ( 0.136 1.167 0.393) 1.239 7.695 ( 0.284 -16.363 -7.514) 18.008 7.886 ( 0.029 8.885 3.308) 9.480 7.954 ( -1.445 8.261 0.999) 8.446 8.053 ( -1.985 -3.302 0.635) 3.905 8.179 ( 1.417 -17.003 1.668) 17.143 8.478 ( -0.910 20.136 2.820) 20.352 8.667 ( -3.574 -1.425 -4.140) 5.652 8.740 ( 3.080 1.313 -0.198) 3.355 8.845 ( 0.796 -0.599 3.996) 4.119 8.946 ( 0.580 -2.274 3.805) 4.471 9.118 ( -0.371 -11.336 -0.218) 11.344 9.315 ( -1.101 11.222 1.533) 11.380 9.508 ( -1.678 -7.813 -7.179) 10.743 9.586 ( -0.103 12.950 10.039) 16.386 9.668 ( -0.008 -0.859 8.580) 8.623 9.936 ( -4.035 5.288 1.841) 6.902 10.062 ( 2.031 -6.489 -2.004) 7.089 10.231 ( 3.301 -9.146 4.191) 10.588 10.286 ( 0.705 -18.497 8.708) 20.457 11.380 ( -1.088 5.280 -29.282) 29.774 11.450 ( -0.919 -3.557 -22.540) 22.837 11.892 ( 1.940 9.115 16.081) 18.586 11.943 ( -0.317 2.720 12.204) 12.507 12.154 ( 2.714 1.422 0.958) 3.210 12.183 ( 0.887 -1.594 1.326) 2.255 12.188 ( -3.218 4.636 -1.421) 5.820 12.229 ( -0.597 0.160 0.528) 0.813 12.463 ( -0.122 10.281 7.997) 13.025 12.588 ( 0.087 1.561 9.910) 10.033 12.975 ( 0.444 1.076 -0.968) 1.514 13.083 ( 2.769 -7.028 -3.008) 8.130 13.406 ( -1.540 3.540 8.232) 9.093 13.652 ( -3.242 -20.252 6.003) 21.370 14.281 ( 0.337 1.913 -3.939) 4.392 14.330 ( -0.777 -2.161 -5.460) 5.923 14.500 ( 0.850 4.124 -4.349) 6.054 14.564 ( -0.415 -1.114 -7.090) 7.189 14.879 ( 2.500 9.048 4.189) 10.279 15.021 ( 1.098 -0.416 -0.457) 1.260 15.196 ( -2.749 -0.699 4.012) 4.913 15.239 ( 1.278 -4.718 -0.804) 4.954 15.628 ( -1.409 5.198 11.756) 12.931 15.744 ( -1.435 -6.480 18.127) 19.304 16.254 ( 1.497 15.590 -11.884) 19.660 16.523 ( -0.219 -10.815 -18.033) 21.029 18.032 ( 2.126 9.337 1.993) 9.781 18.120 ( -4.063 3.700 -2.238) 5.933 18.169 ( 2.940 -3.240 0.421) 4.396 18.195 ( -2.330 -3.691 -0.392) 4.382 18.781 ( -0.276 5.865 2.024) 6.210 18.906 ( -2.083 3.517 -3.146) 5.158 19.019 ( 3.332 -12.199 1.606) 12.748 19.099 ( 0.551 -10.082 -1.097) 10.157 19.507 ( -1.352 5.541 1.649) 5.937 19.604 ( -1.699 -4.421 2.944) 5.577 19.688 ( -1.317 7.398 -7.513) 10.626 19.808 ( 0.766 -5.110 -5.679) 7.678 20.228 ( 0.490 1.766 0.468) 1.892 20.259 ( -0.182 -1.536 0.136) 1.552 20.308 ( 0.452 0.726 -1.961) 2.139 20.325 ( 1.412 -1.050 -1.866) 2.565 20.426 ( -1.350 0.550 0.677) 1.607 20.433 ( 1.293 -0.142 0.598) 1.431 20.539 ( 4.042 0.564 2.123) 4.601 20.549 ( -0.071 -0.488 1.607) 1.681 24.524 ( 0.091 3.299 1.755) 3.738 24.571 ( 0.184 -0.582 -0.322) 0.690 24.612 ( -0.230 0.484 1.266) 1.375 24.630 ( -0.510 -2.142 0.948) 2.397 28.725 ( 0.289 8.116 2.688) 8.555 28.832 ( -0.571 3.933 -1.109) 4.127 28.934 ( 0.906 -2.559 2.669) 3.807 29.073 ( -0.634 -10.050 -1.874) 10.243 29.546 ( -0.775 2.371 -0.618) 2.570 29.577 ( -0.040 -0.697 -1.986) 2.105 29.671 ( -0.196 1.079 0.669) 1.285 29.684 ( 0.615 -0.127 -0.119) 0.639 32.975 ( 0.270 0.829 -0.742) 1.145 32.978 ( 0.118 0.917 -0.788) 1.215 33.014 ( -0.144 0.083 0.898) 0.913 33.038 ( -0.214 -1.877 -0.257) 1.906 36.435 ( -0.142 19.692 6.069) 20.607 36.682 ( -0.881 -1.578 -2.836) 3.363 37.467 ( 2.981 -2.372 4.335) 5.771 37.681 ( -1.324 -21.150 -3.768) 21.523 38.506 ( -2.135 16.133 0.812) 16.294 38.641 ( 2.972 13.936 -5.802) 15.385 38.896 ( -3.926 -7.824 5.657) 10.423 39.071 ( 2.358 -13.520 -2.578) 13.964 39.608 ( 0.018 3.285 5.448) 6.362 39.680 ( 0.013 -3.876 3.475) 5.206 40.003 ( -0.100 2.286 0.217) 2.298 40.032 ( -0.205 -0.032 -0.453) 0.498 41.912 ( 2.743 11.125 -13.478) 17.690 42.048 ( -4.937 1.998 -17.871) 18.648 43.019 ( -0.944 15.312 -12.097) 19.537 43.274 ( -1.473 -9.337 -14.855) 17.607 44.519 ( 3.572 -5.579 21.245) 22.254 44.538 ( 1.836 -7.349 18.452) 19.946 45.470 ( -0.025 3.750 0.285) 3.761 45.547 ( -1.072 -4.036 -1.962) 4.614 70.775 ( 0.448 23.310 4.117) 23.675 71.152 ( 1.886 -12.977 -11.899) 17.707 72.764 ( 3.036 6.046 -3.386) 7.565 72.898 ( -11.743 -7.650 -6.175) 15.315 105.289 ( 1.006 1.831 3.344) 3.943 105.327 ( 1.189 -2.040 3.498) 4.221 105.564 ( 0.142 1.074 -2.295) 2.538 105.600 ( -1.101 -2.373 -2.342) 3.511 ======================= Grid point 118 (61/102) ======================= q-point: ( 0.06 0.40 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 Number of triplets: 160 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.018 ( 31.852 23.632 14.888) 42.364 2.400 ( 22.386 0.102 7.435) 23.588 2.627 ( 15.925 21.868 12.236) 29.691 2.655 ( 28.863 5.388 -9.918) 30.992 3.049 ( 22.634 -14.152 -14.440) 30.349 3.333 ( 7.126 -29.303 10.926) 32.076 3.753 ( 9.241 13.469 -22.771) 28.023 3.816 ( 6.773 22.886 11.108) 26.325 4.009 ( 11.056 19.343 31.322) 38.438 4.058 ( 12.129 -7.458 7.317) 16.008 4.136 ( 12.936 2.034 -8.036) 15.364 4.568 ( 15.292 -0.764 -13.641) 20.507 4.832 ( 9.644 -8.876 -12.143) 17.867 4.853 ( 8.437 -5.664 -1.557) 10.281 5.153 ( 19.865 15.438 3.908) 25.460 5.374 ( 14.724 -2.384 1.986) 15.048 5.442 ( 19.098 -3.244 -0.539) 19.379 5.556 ( 10.107 -2.729 6.974) 12.579 5.653 ( 8.598 -1.325 8.641) 12.262 5.868 ( 0.696 -14.314 9.427) 17.153 5.956 ( 1.581 2.941 -18.605) 18.903 6.053 ( 5.107 -17.357 2.008) 18.203 6.493 ( 1.000 1.785 -1.893) 2.788 6.512 ( 2.385 0.569 -3.458) 4.239 6.622 ( 1.737 3.163 -5.183) 6.316 6.679 ( 1.531 2.130 -0.753) 2.730 6.805 ( 14.759 2.700 -6.994) 16.554 6.857 ( 16.566 -0.479 -0.419) 16.578 7.058 ( 6.962 9.773 -14.811) 19.062 7.253 ( 6.305 -2.155 1.896) 6.928 7.303 ( 9.446 -2.093 -7.740) 12.390 7.402 ( 4.432 -5.701 -1.089) 7.303 7.503 ( 5.124 3.566 3.757) 7.286 7.551 ( 6.096 -2.365 -2.484) 6.995 7.648 ( 8.544 1.160 1.255) 8.714 7.762 ( 8.072 -11.638 -5.118) 15.060 7.892 ( 0.595 8.064 2.342) 8.419 7.993 ( 4.085 4.006 2.088) 6.091 8.036 ( 1.606 -1.453 0.041) 2.166 8.191 ( 1.245 -11.841 0.647) 11.924 8.479 ( -0.001 14.835 4.176) 15.411 8.684 ( 4.209 -1.276 -6.325) 7.703 8.805 ( 2.150 3.443 3.983) 5.686 8.936 ( 6.925 -3.865 -4.268) 9.007 9.041 ( 6.793 -0.405 5.272) 8.609 9.136 ( 2.336 -8.510 6.043) 10.695 9.306 ( 1.343 9.031 -2.971) 9.601 9.484 ( 1.257 -6.656 -7.495) 10.102 9.608 ( -0.116 5.756 8.700) 10.432 9.681 ( -0.445 -5.398 7.874) 9.557 9.854 ( -3.968 9.905 1.730) 10.810 10.122 ( 4.414 -5.483 -0.715) 7.075 10.274 ( -2.165 -10.195 7.834) 13.038 10.341 ( 5.169 -10.452 11.218) 16.180 11.279 ( -2.794 4.923 -28.447) 29.004 11.356 ( -3.326 -3.817 -25.399) 25.899 11.903 ( -5.039 10.084 13.949) 17.935 11.921 ( -3.707 5.953 11.412) 13.394 12.167 ( 2.360 4.302 -0.481) 4.930 12.245 ( 3.781 0.083 1.391) 4.030 12.261 ( 5.015 -2.098 3.140) 6.278 12.263 ( 2.725 -1.115 2.043) 3.584 12.520 ( 5.155 7.557 6.700) 11.339 12.631 ( 3.446 0.196 6.386) 7.259 12.931 ( -4.109 2.154 -1.555) 4.893 13.073 ( -3.116 -7.646 -2.102) 8.520 13.364 ( -3.854 2.563 8.351) 9.548 13.539 ( -7.773 -13.225 4.695) 16.043 14.266 ( -1.094 2.217 -3.330) 4.147 14.296 ( -1.392 -1.121 -3.625) 4.042 14.492 ( -0.523 0.947 -3.963) 4.108 14.526 ( -1.779 -1.296 -5.587) 6.005 14.901 ( -1.479 8.260 3.326) 9.026 15.009 ( -2.115 0.287 -1.072) 2.388 15.123 ( -4.588 2.357 2.366) 5.675 15.233 ( -2.202 -6.595 1.386) 7.090 15.566 ( -6.097 4.224 8.462) 11.253 15.658 ( -8.997 -4.371 15.222) 18.214 16.098 ( -12.838 7.218 -10.041) 17.825 16.207 ( -21.802 -2.848 -14.537) 26.358 18.128 ( 7.309 8.412 1.255) 11.214 18.199 ( 6.989 0.981 -2.120) 7.369 18.303 ( 10.172 0.226 1.261) 10.252 18.341 ( 10.572 -2.757 -0.924) 10.965 18.792 ( 1.102 4.937 1.881) 5.397 18.840 ( -3.436 3.429 -1.720) 5.150 19.082 ( 1.548 -10.454 -0.616) 10.586 19.118 ( 2.369 -13.367 -1.360) 13.644 19.488 ( -0.242 5.380 0.366) 5.398 19.574 ( -1.086 -2.947 0.621) 3.202 19.632 ( -0.679 7.620 -1.760) 7.850 19.783 ( -0.097 -7.473 -2.303) 7.821 20.273 ( 3.739 1.190 0.007) 3.924 20.296 ( 4.928 -1.276 -0.219) 5.095 20.404 ( 6.762 0.910 1.044) 6.903 20.417 ( 8.456 -0.539 0.025) 8.473 20.501 ( 12.079 1.987 -1.545) 12.338 20.550 ( 13.293 -3.023 -2.446) 13.850 20.831 ( 22.218 5.843 -0.094) 22.973 20.980 ( 30.908 -10.863 -2.815) 32.882 24.513 ( -1.489 3.283 1.879) 4.065 24.560 ( -1.071 0.023 -0.703) 1.282 24.594 ( -2.071 -0.633 0.651) 2.261 24.599 ( -2.282 -1.467 1.422) 3.063 28.739 ( 0.526 8.430 2.774) 8.890 28.818 ( -0.492 6.097 -1.271) 6.247 28.953 ( 0.314 -5.231 3.407) 6.250 29.051 ( -1.007 -9.518 -2.392) 9.866 29.516 ( -2.008 2.648 -0.375) 3.345 29.558 ( -1.451 -1.648 -1.126) 2.468 29.652 ( -1.669 2.288 0.035) 2.832 29.679 ( -1.041 -0.509 -0.130) 1.166 33.011 ( 3.422 1.792 -0.688) 3.923 33.015 ( 3.612 1.171 -0.837) 3.888 33.063 ( 4.625 -1.744 0.910) 5.026 33.074 ( 3.794 -2.254 -0.295) 4.423 36.410 ( -3.595 19.076 6.228) 20.387 36.618 ( -4.742 1.052 -2.907) 5.661 37.375 ( -12.572 -2.155 4.944) 13.680 37.574 ( -8.339 -20.927 -4.415) 22.956 38.442 ( -4.172 17.420 -0.419) 17.918 38.657 ( -0.357 13.304 -4.975) 14.208 38.808 ( -5.672 -6.237 4.997) 9.800 39.073 ( -1.607 -16.392 -0.923) 16.497 39.498 ( -9.731 8.755 3.749) 13.616 39.656 ( -4.216 -7.168 4.059) 9.253 39.988 ( -1.842 2.156 -1.065) 3.029 40.016 ( -1.281 -0.369 0.664) 1.489 41.726 ( -21.278 16.268 -15.505) 30.949 41.812 ( -9.712 3.255 -12.559) 16.207 42.842 ( -14.292 10.644 -0.570) 17.830 43.067 ( -15.242 -10.507 -10.087) 21.082 44.412 ( -15.685 0.016 19.381) 24.932 44.485 ( -9.184 -6.970 11.427) 16.233 45.329 ( -12.984 2.351 0.021) 13.195 45.370 ( -15.028 -1.775 -2.820) 15.393 70.712 ( -7.458 21.732 3.862) 23.298 71.058 ( -8.666 -11.185 -13.307) 19.423 72.321 ( -38.098 13.196 0.661) 40.324 72.523 ( -25.026 -7.774 1.013) 26.226 105.301 ( -0.628 1.912 3.518) 4.053 105.336 ( -1.030 -1.389 1.948) 2.605 105.513 ( -4.593 -0.450 -0.795) 4.683 105.527 ( -5.186 -1.510 -3.082) 6.218 ======================= Grid point 119 (62/102) ======================= q-point: ( 0.12 0.40 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 Number of triplets: 160 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.667 ( 26.896 23.077 16.438) 39.066 2.903 ( 23.567 15.513 20.287) 34.751 3.112 ( 28.586 0.825 1.179) 28.622 3.310 ( 33.943 -0.850 -7.720) 34.820 3.569 ( 19.835 -16.832 2.030) 26.094 3.584 ( 25.260 -16.650 -6.252) 30.893 3.896 ( 13.017 12.182 -25.874) 31.421 4.061 ( 13.079 1.446 -0.117) 13.159 4.410 ( 22.143 19.436 23.652) 37.782 4.439 ( 24.398 4.650 5.025) 25.340 4.525 ( 25.488 -3.315 7.122) 26.671 4.966 ( 23.349 -13.545 -5.697) 27.588 5.035 ( 15.125 1.219 -3.823) 15.648 5.136 ( 20.325 -3.304 -9.493) 22.675 5.540 ( 4.467 8.291 14.754) 17.504 5.650 ( 23.634 7.804 -0.099) 24.890 5.742 ( 3.021 -3.773 -6.279) 7.924 5.830 ( 16.809 -3.132 -10.528) 20.080 6.020 ( 15.854 0.769 1.098) 15.910 6.108 ( 28.955 0.193 -1.293) 28.985 6.129 ( 22.670 0.373 -3.025) 22.874 6.285 ( 17.621 -26.529 10.382) 33.497 6.548 ( 7.680 3.904 -4.101) 9.542 6.554 ( 2.913 2.699 -5.230) 6.567 6.658 ( 4.275 1.646 -2.634) 5.284 6.718 ( 3.637 -0.966 1.470) 4.040 7.026 ( 7.976 13.136 -23.030) 27.686 7.208 ( 8.656 1.212 -1.036) 8.802 7.257 ( 19.480 0.939 0.974) 19.527 7.452 ( 11.072 -11.623 -3.445) 16.418 7.527 ( 15.349 -1.196 -4.902) 16.157 7.597 ( 14.127 -6.515 1.793) 15.660 7.659 ( 9.562 9.815 5.580) 14.795 7.730 ( 11.765 2.498 2.581) 12.301 7.842 ( 9.731 -0.744 4.494) 10.745 7.895 ( 3.989 -7.403 4.978) 9.772 8.001 ( 10.853 6.261 -6.487) 14.109 8.098 ( 10.350 -2.777 -1.374) 10.804 8.210 ( 14.055 2.201 -0.576) 14.238 8.310 ( 11.345 -6.233 -1.232) 13.003 8.496 ( 1.472 10.570 6.504) 12.498 8.730 ( 1.511 -6.057 -5.758) 8.493 8.837 ( 0.920 6.173 1.147) 6.346 9.017 ( 2.710 -7.324 -4.591) 9.059 9.162 ( 3.109 4.644 -0.045) 5.589 9.214 ( 2.284 -3.150 6.357) 7.454 9.383 ( 4.490 6.980 1.968) 8.529 9.557 ( 6.947 -6.420 -1.179) 9.532 9.598 ( -2.029 -0.784 6.648) 6.995 9.700 ( 0.680 -5.548 0.620) 5.624 9.838 ( 4.011 7.348 4.491) 9.500 10.131 ( -5.336 -18.440 7.393) 20.571 10.355 ( 11.004 7.193 3.725) 13.664 10.502 ( 8.712 -7.516 7.834) 13.920 11.153 ( -4.110 4.380 -24.870) 25.585 11.221 ( -4.462 -2.476 -23.428) 23.977 11.773 ( -9.334 12.141 9.927) 18.250 11.841 ( -6.453 5.058 8.341) 11.696 12.213 ( -0.970 3.406 1.661) 3.912 12.276 ( 0.925 1.636 5.364) 5.684 12.315 ( 0.353 -2.567 3.582) 4.421 12.354 ( 3.493 -3.877 2.516) 5.793 12.635 ( 0.883 8.273 3.072) 8.869 12.789 ( 8.631 -5.177 1.141) 10.129 12.858 ( 0.295 2.038 -1.274) 2.421 12.982 ( -2.880 -7.326 0.548) 7.891 13.320 ( -1.115 2.648 6.635) 7.231 13.428 ( -2.374 -6.687 1.504) 7.254 14.229 ( -1.789 2.368 -2.108) 3.640 14.265 ( -1.113 -1.622 -1.125) 2.266 14.469 ( -1.146 -1.998 -3.579) 4.256 14.478 ( -1.552 -1.715 -4.095) 4.703 14.840 ( -4.743 7.039 2.713) 8.911 14.933 ( -4.894 -2.302 -0.569) 5.439 15.043 ( -3.746 5.251 1.196) 6.560 15.154 ( -5.977 -3.506 3.352) 7.697 15.448 ( -6.755 1.782 4.890) 8.528 15.506 ( -8.048 -2.816 8.363) 11.943 15.755 ( -18.768 1.698 -11.501) 22.077 15.784 ( -15.060 -1.421 -7.697) 16.972 18.234 ( 2.134 10.007 -0.342) 10.237 18.333 ( 5.237 2.631 0.382) 5.873 18.465 ( 3.176 0.551 1.488) 3.550 18.490 ( 5.247 -0.772 -1.057) 5.408 18.768 ( -1.559 6.626 -0.765) 6.850 18.858 ( 3.392 1.861 2.087) 4.396 19.068 ( -1.180 -8.320 -4.046) 9.327 19.180 ( 1.859 -15.255 2.501) 15.570 19.525 ( 4.549 4.516 -1.798) 6.657 19.600 ( 4.615 -2.121 -2.258) 5.559 19.685 ( 5.548 5.940 2.084) 8.391 19.831 ( 4.844 -7.901 0.632) 9.289 20.407 ( 9.729 2.117 -0.391) 9.965 20.452 ( 10.481 -2.403 -0.569) 10.768 20.598 ( 12.163 1.822 1.386) 12.376 20.633 ( 12.639 -1.834 2.431) 13.001 20.855 ( 22.105 2.914 -2.364) 22.421 20.932 ( 23.916 -5.083 -1.564) 24.500 21.310 ( 24.348 10.811 -1.790) 26.700 21.583 ( 28.086 -18.362 -6.605) 34.200 24.476 ( -2.467 2.770 1.959) 4.195 24.528 ( -3.864 -1.597 1.124) 4.330 24.533 ( -1.405 1.290 -1.130) 2.218 24.563 ( -1.775 -1.087 0.231) 2.094 28.757 ( 0.757 8.474 2.167) 8.780 28.810 ( 0.045 6.936 -0.681) 6.970 28.962 ( -0.147 -6.442 3.792) 7.477 29.024 ( -1.124 -8.877 -2.632) 9.327 29.468 ( -2.634 2.913 0.283) 3.938 29.519 ( -2.279 -2.275 0.030) 3.221 29.611 ( -2.260 2.697 -0.762) 3.600 29.645 ( -2.224 -0.810 -0.434) 2.406 33.106 ( 6.064 2.544 -0.651) 6.609 33.114 ( 6.225 1.830 -0.454) 6.504 33.179 ( 6.602 -2.937 0.131) 7.227 33.188 ( 7.252 -3.779 0.174) 8.179 36.322 ( -6.266 17.586 5.706) 19.521 36.489 ( -7.325 3.879 -2.436) 8.639 37.056 ( -18.466 2.633 4.538) 19.197 37.324 ( -15.224 -22.853 -4.224) 27.783 38.345 ( -5.124 18.366 -0.687) 19.080 38.605 ( -4.096 18.095 -2.223) 18.685 38.700 ( -5.617 -12.312 2.222) 13.714 39.009 ( -4.716 -18.450 0.413) 19.047 39.292 ( -10.409 12.578 1.713) 16.415 39.537 ( -7.918 -10.675 3.489) 13.742 39.919 ( -4.757 2.750 -1.031) 5.591 39.968 ( -3.845 -1.251 0.311) 4.055 41.239 ( -22.886 22.506 -7.163) 32.887 41.511 ( -16.775 -6.272 -10.493) 20.757 42.471 ( -22.757 8.765 6.682) 25.285 42.666 ( -22.675 -10.085 -3.524) 25.066 44.108 ( -16.398 7.076 12.930) 22.049 44.256 ( -13.986 -7.909 3.262) 16.395 44.993 ( -20.616 0.840 -1.573) 20.693 45.004 ( -18.301 -0.322 -1.518) 18.367 70.505 ( -13.382 17.846 2.769) 22.477 70.768 ( -16.678 -5.568 -12.540) 21.596 71.562 ( -36.664 15.392 6.583) 40.305 71.883 ( -36.641 -15.193 3.613) 39.830 105.278 ( -2.263 1.554 2.797) 3.919 105.295 ( -3.033 0.103 -0.579) 3.089 105.398 ( -6.605 -0.792 -2.596) 7.141 105.400 ( -6.196 -1.270 1.078) 6.416 ======================= Grid point 120 (63/102) ======================= q-point: ( 0.19 0.40 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 Number of triplets: 160 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.200 ( 24.250 21.337 17.667) 36.817 3.389 ( 20.065 13.326 23.459) 33.623 3.673 ( 26.353 -4.385 -0.090) 26.716 3.859 ( 22.514 -10.419 -2.650) 24.949 3.965 ( 21.354 -3.787 -1.130) 21.717 4.114 ( 25.366 -7.204 -13.175) 29.478 4.188 ( 19.418 2.317 -14.595) 24.402 4.332 ( 15.561 -10.311 -9.566) 20.975 4.905 ( 20.305 14.956 16.952) 30.386 4.989 ( 25.863 1.193 8.191) 27.156 5.105 ( 28.648 -1.718 1.116) 28.722 5.237 ( 12.244 -6.227 -2.879) 14.035 5.551 ( 19.066 3.414 -3.974) 19.773 5.604 ( 29.949 -0.898 -6.697) 30.702 5.718 ( 13.540 2.627 11.969) 18.262 5.790 ( 9.925 -5.089 -8.687) 14.137 6.084 ( 16.839 6.673 -5.867) 19.040 6.115 ( 17.043 3.363 -1.331) 17.423 6.299 ( 12.108 1.330 -3.079) 12.564 6.421 ( 9.283 -5.540 -4.132) 11.573 6.576 ( 4.413 1.000 -2.494) 5.167 6.631 ( 12.967 -0.090 3.387) 13.402 6.805 ( 16.499 2.903 -0.962) 16.781 6.900 ( 25.752 -6.098 0.657) 26.473 6.922 ( 28.780 2.607 0.133) 28.899 6.971 ( 22.435 0.743 -1.962) 22.533 7.147 ( 12.482 5.201 -13.421) 19.052 7.320 ( 6.446 -5.010 -1.414) 8.286 7.543 ( 6.960 4.284 6.327) 10.336 7.657 ( 12.036 -4.352 -6.946) 14.562 7.757 ( 4.677 -3.778 3.321) 6.869 7.801 ( 5.994 -4.596 0.642) 7.581 7.914 ( 13.887 8.197 6.069) 17.230 8.000 ( 11.706 7.007 -3.510) 14.087 8.102 ( 17.307 -5.235 2.150) 18.208 8.148 ( 16.739 -3.452 6.313) 18.220 8.229 ( 14.806 9.019 -7.708) 18.972 8.415 ( 19.473 -5.679 -1.615) 20.348 8.499 ( 10.359 -2.373 -1.592) 10.746 8.563 ( 13.847 -4.137 2.389) 14.648 8.656 ( 13.009 6.791 4.760) 15.428 8.780 ( 7.007 -5.069 0.441) 8.660 8.882 ( 6.277 6.795 -3.628) 9.937 9.065 ( 3.475 -7.901 -2.594) 9.013 9.194 ( 1.704 4.383 -2.093) 5.148 9.248 ( 0.927 -3.819 2.404) 4.607 9.434 ( 0.588 5.713 5.111) 7.688 9.578 ( 0.022 -6.706 0.902) 6.767 9.665 ( 0.280 2.480 11.090) 11.367 9.723 ( 2.652 -2.336 4.122) 5.430 10.010 ( 8.536 -2.468 4.269) 9.858 10.078 ( 2.992 -8.868 2.662) 9.731 10.626 ( 13.164 4.053 -2.978) 14.092 10.710 ( 10.681 -4.480 -0.983) 11.624 11.024 ( -3.555 6.261 -15.695) 17.267 11.112 ( -1.843 -1.846 -10.637) 10.952 11.601 ( -8.685 11.427 4.910) 15.169 11.714 ( -6.792 1.040 2.683) 7.377 12.153 ( -4.357 4.132 3.614) 7.009 12.251 ( -4.050 -5.027 4.397) 7.810 12.331 ( 0.247 2.486 2.112) 3.271 12.392 ( -0.017 -3.086 1.555) 3.455 12.535 ( -8.379 5.976 0.272) 10.295 12.692 ( -10.758 -8.041 0.918) 13.462 13.044 ( 10.932 2.711 0.182) 11.265 13.097 ( 9.882 -2.549 1.224) 10.279 13.378 ( 5.948 3.167 3.459) 7.574 13.477 ( 6.491 -6.179 -1.297) 9.055 14.187 ( -2.067 2.412 -1.093) 3.359 14.244 ( -1.004 -3.126 0.528) 3.325 14.428 ( -1.618 -0.640 -2.276) 2.865 14.460 ( -0.001 -4.639 -2.632) 5.333 14.742 ( -5.060 5.738 1.904) 7.883 14.828 ( -5.233 -3.230 -0.748) 6.195 14.974 ( -3.550 3.553 1.698) 5.302 15.024 ( -7.316 0.731 3.941) 8.342 15.307 ( -8.606 0.770 2.269) 8.933 15.374 ( -6.865 -3.140 5.346) 9.250 15.439 ( -10.321 1.671 -9.202) 13.928 15.510 ( -9.778 -4.553 -6.706) 12.701 18.228 ( -1.908 12.463 -0.562) 12.621 18.374 ( -1.089 7.795 0.921) 7.925 18.463 ( -1.477 -3.721 -1.354) 4.227 18.552 ( 0.905 -3.283 1.679) 3.797 18.771 ( 1.268 6.477 -0.504) 6.620 18.911 ( 1.160 0.048 0.953) 1.502 19.035 ( -1.448 -4.248 -3.007) 5.402 19.178 ( -2.251 -11.311 2.937) 11.901 19.664 ( 9.350 4.211 -2.366) 10.524 19.742 ( 9.113 -2.550 -2.296) 9.738 19.837 ( 8.393 4.026 2.628) 9.672 19.955 ( 6.764 -6.743 1.382) 9.650 20.648 ( 14.054 2.382 -0.446) 14.261 20.701 ( 14.143 -2.863 -0.688) 14.446 20.879 ( 15.220 1.973 1.352) 15.406 20.920 ( 15.099 -2.212 2.378) 15.445 21.329 ( 24.728 4.551 -1.774) 25.206 21.446 ( 26.234 -7.367 0.541) 27.254 21.762 ( 20.748 12.237 -2.010) 24.171 22.048 ( 19.737 -17.335 -5.884) 26.919 24.429 ( -2.515 1.662 1.820) 3.522 24.453 ( -3.578 -0.204 1.720) 3.975 24.510 ( -0.544 0.890 -1.567) 1.883 24.534 ( -0.874 -1.172 -1.072) 1.813 28.779 ( 1.085 8.019 1.186) 8.179 28.818 ( 0.758 6.356 0.302) 6.408 28.964 ( -0.404 -6.623 3.465) 7.485 28.997 ( -1.044 -7.816 -2.503) 8.274 29.415 ( -2.753 3.141 0.921) 4.277 29.470 ( -2.583 -2.543 0.762) 3.704 29.561 ( -2.392 2.299 -1.359) 3.585 29.593 ( -2.739 -0.883 -0.766) 2.978 33.243 ( 7.544 2.954 -0.400) 8.112 33.254 ( 7.607 2.683 -0.169) 8.068 33.327 ( 7.903 -3.715 0.034) 8.733 33.343 ( 7.993 -4.614 -0.006) 9.229 36.193 ( -7.496 15.329 4.492) 17.645 36.326 ( -8.160 6.063 -1.529) 10.280 36.704 ( -16.866 2.831 3.854) 17.530 36.982 ( -17.221 -21.286 -4.138) 27.691 38.243 ( -4.747 18.375 -0.408) 18.983 38.488 ( -7.034 20.159 -0.171) 21.352 38.602 ( -4.376 -16.820 0.209) 17.381 38.886 ( -7.550 -19.612 -0.127) 21.016 39.114 ( -7.421 12.621 0.997) 14.675 39.371 ( -9.013 -11.553 2.873) 14.932 39.794 ( -7.411 3.562 -1.429) 8.346 39.864 ( -6.373 -2.277 -0.166) 6.769 40.814 ( -18.472 20.812 -1.654) 27.876 41.141 ( -17.439 -11.924 -7.159) 22.305 41.991 ( -25.815 8.590 6.537) 27.981 42.165 ( -26.286 -8.604 -0.868) 27.672 43.834 ( -13.078 8.506 7.655) 17.378 43.976 ( -13.376 -5.430 -2.919) 14.728 44.576 ( -20.360 1.195 1.274) 20.435 44.622 ( -18.980 -3.060 -2.207) 19.351 70.210 ( -16.031 13.034 1.854) 20.744 70.377 ( -19.374 -0.202 -8.806) 21.283 70.897 ( -31.074 7.868 5.281) 32.487 71.151 ( -35.877 -14.530 3.213) 38.841 105.216 ( -4.387 1.138 -2.522) 5.187 105.225 ( -3.469 0.689 1.270) 3.758 105.262 ( -6.275 0.053 -1.209) 6.390 105.286 ( -5.546 -1.873 2.629) 6.417 ======================= Grid point 121 (64/102) ======================= q-point: ( 0.25 0.40 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 Number of triplets: 160 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.730 ( 24.945 14.307 15.138) 32.498 3.824 ( 19.047 10.939 22.677) 31.570 4.160 ( 22.430 -4.117 -0.829) 22.819 4.278 ( 20.433 -10.532 -1.569) 23.041 4.377 ( 20.424 2.100 -7.183) 21.752 4.535 ( 16.328 -4.908 -4.830) 17.721 4.541 ( 20.366 -5.369 -12.062) 24.271 4.656 ( 18.626 -9.978 -8.869) 22.916 5.260 ( 12.621 6.320 12.492) 18.849 5.366 ( 10.368 -4.822 8.710) 14.373 5.506 ( 15.193 3.636 -16.667) 22.843 5.563 ( 18.257 -1.278 -10.437) 21.068 5.864 ( 11.392 2.509 3.041) 12.054 5.951 ( 16.746 -4.026 -0.664) 17.236 6.041 ( 13.325 4.089 5.180) 14.870 6.147 ( 11.880 -3.873 3.264) 12.915 6.345 ( 9.971 8.583 -1.384) 13.229 6.498 ( 14.005 -3.785 -6.894) 16.063 6.558 ( 18.165 7.119 -4.546) 20.033 6.655 ( 16.555 -0.992 1.880) 16.691 6.729 ( 13.177 8.517 0.565) 15.700 6.905 ( 19.855 -2.200 -3.902) 20.354 7.068 ( 9.622 4.739 -6.895) 12.751 7.158 ( 0.954 4.650 -0.894) 4.830 7.245 ( 15.480 2.738 -1.593) 15.801 7.407 ( 9.574 -9.131 0.600) 13.243 7.503 ( 8.904 0.199 2.074) 9.145 7.600 ( 11.601 11.238 8.752) 18.370 7.730 ( 15.179 -5.953 0.802) 16.324 7.866 ( 16.380 -8.787 -2.508) 18.757 7.952 ( 5.352 -0.676 -2.483) 5.938 7.962 ( 13.604 -0.830 1.328) 13.693 8.107 ( 16.426 9.222 -4.268) 19.315 8.224 ( 11.528 6.005 -4.366) 13.712 8.386 ( 6.148 -0.204 0.695) 6.190 8.453 ( 10.321 -8.569 1.155) 13.464 8.530 ( 13.762 -1.025 6.333) 15.184 8.564 ( 7.920 -7.791 -5.805) 12.535 8.733 ( 2.219 6.539 5.175) 8.629 8.868 ( 9.007 -3.511 5.821) 11.284 8.961 ( 10.994 -1.869 -1.695) 11.280 8.973 ( 21.645 -0.681 -0.153) 21.656 9.151 ( 12.647 2.385 -0.295) 12.873 9.204 ( 13.270 -2.466 -1.570) 13.588 9.296 ( 10.953 0.059 -1.293) 11.029 9.325 ( 10.456 -4.534 0.570) 11.412 9.461 ( 2.124 1.982 3.535) 4.575 9.538 ( -1.802 -5.586 2.060) 6.220 9.775 ( 9.674 5.439 10.953) 15.593 9.850 ( 9.498 -1.564 8.309) 12.716 10.144 ( 6.515 4.061 4.037) 8.675 10.262 ( 10.127 -7.781 1.111) 12.819 10.775 ( 5.166 3.648 -17.946) 19.027 10.844 ( 3.197 -2.293 -17.435) 17.874 11.037 ( 6.042 6.127 6.314) 10.674 11.126 ( 2.697 -1.209 5.921) 6.618 11.483 ( -2.557 7.691 1.146) 8.185 11.604 ( -3.619 -3.066 -2.186) 5.222 12.076 ( -3.256 4.270 0.684) 5.413 12.176 ( -3.533 -4.826 1.885) 6.271 12.319 ( -3.612 5.864 1.870) 7.137 12.377 ( -3.076 1.649 -0.543) 3.532 12.395 ( 0.088 -2.844 -0.357) 2.868 12.478 ( -9.255 -7.309 1.706) 11.916 13.239 ( 8.029 3.791 0.633) 8.902 13.274 ( 6.947 0.652 1.483) 7.133 13.534 ( 7.776 2.149 0.265) 8.071 13.625 ( 7.211 -6.413 -1.643) 9.789 14.147 ( -1.613 2.497 -0.534) 3.020 14.224 ( -1.274 -5.056 1.655) 5.471 14.399 ( -1.191 1.419 0.075) 1.854 14.466 ( 1.088 -5.900 -1.306) 6.140 14.662 ( -2.926 3.142 0.180) 4.297 14.728 ( -4.376 -3.468 -0.327) 5.593 14.887 ( -6.256 3.763 2.161) 7.614 14.913 ( -3.579 0.107 4.069) 5.420 15.135 ( -7.876 1.291 -0.334) 7.988 15.218 ( -8.138 -6.555 -1.647) 10.579 15.301 ( -3.906 3.097 -1.426) 5.184 15.372 ( -3.834 -3.904 -4.887) 7.337 18.179 ( -2.511 13.769 -0.804) 14.020 18.327 ( -2.987 12.867 0.572) 13.221 18.428 ( -1.612 -8.276 -0.925) 8.482 18.551 ( -0.925 -6.542 1.641) 6.808 18.790 ( 0.485 5.731 -0.599) 5.783 18.913 ( -0.866 0.111 0.341) 0.937 18.992 ( -2.421 -2.515 -2.116) 4.082 19.120 ( -3.783 -8.786 2.410) 9.865 19.861 ( 10.126 3.744 -1.970) 10.974 19.924 ( 8.959 -1.349 -1.670) 9.213 20.009 ( 7.962 2.035 2.202) 8.508 20.089 ( 6.000 -4.754 1.397) 7.782 20.951 ( 15.811 2.214 -0.064) 15.965 21.001 ( 15.564 -2.765 -0.352) 15.812 21.195 ( 15.612 1.724 0.861) 15.731 21.231 ( 15.130 -1.960 1.649) 15.346 21.806 ( 22.544 6.013 -1.670) 23.392 21.945 ( 22.788 -7.871 0.830) 24.124 22.126 ( 15.977 10.524 -1.211) 19.170 22.363 ( 13.077 -13.337 -3.143) 18.941 24.385 ( -2.202 1.141 1.771) 3.047 24.403 ( -1.751 -0.475 2.352) 2.970 24.507 ( 0.602 0.978 -1.861) 2.187 24.526 ( 0.486 -0.915 -2.328) 2.548 28.807 ( 1.509 6.836 0.704) 7.036 28.840 ( 1.279 5.123 0.695) 5.325 28.961 ( -0.552 -6.107 2.616) 6.666 28.974 ( -0.753 -6.193 -2.031) 6.560 29.364 ( -2.560 3.167 1.384) 4.301 29.420 ( -2.604 -2.572 1.001) 3.794 29.511 ( -2.283 1.673 -1.657) 3.279 29.536 ( -2.723 -0.774 -0.986) 2.998 33.397 ( 7.694 3.351 -0.113) 8.393 33.409 ( 7.651 3.306 0.001) 8.334 33.487 ( 7.832 -4.254 0.081) 8.913 33.501 ( 7.662 -4.622 -0.277) 8.952 36.053 ( -7.009 12.576 3.086) 14.724 36.166 ( -7.475 6.577 -0.568) 9.973 36.411 ( -12.950 0.536 2.731) 13.246 36.645 ( -15.162 -17.433 -3.594) 23.382 38.158 ( -3.746 17.988 -0.214) 18.375 38.337 ( -7.589 18.186 -0.091) 19.706 38.526 ( -3.295 -16.693 0.424) 17.020 38.721 ( -8.287 -18.029 -1.330) 19.887 38.995 ( -4.861 8.693 1.100) 10.020 39.199 ( -8.429 -9.843 2.359) 13.171 39.623 ( -9.115 4.612 -2.149) 10.438 39.719 ( -7.976 -3.834 -0.235) 8.853 40.488 ( -14.036 17.431 0.580) 22.387 40.802 ( -14.996 -13.499 -4.151) 20.599 41.492 ( -24.592 7.887 4.287) 26.179 41.637 ( -25.633 -6.713 -0.627) 26.505 43.612 ( -10.528 8.349 5.107) 14.375 43.720 ( -11.202 -1.569 -5.197) 12.448 44.196 ( -17.903 -0.255 3.311) 18.209 44.251 ( -17.226 -4.925 -2.414) 18.078 69.890 ( -15.820 8.712 1.229) 18.102 69.980 ( -18.344 2.474 -5.048) 19.186 70.339 ( -25.327 2.033 2.605) 25.542 70.493 ( -29.955 -10.700 2.041) 31.874 105.118 ( -4.626 0.861 -2.163) 5.179 105.135 ( -5.104 -0.770 -1.903) 5.501 105.161 ( -4.098 1.363 2.113) 4.807 105.189 ( -4.706 -1.388 1.958) 5.282 ======================= Grid point 122 (65/102) ======================= q-point: ( 0.31 0.40 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 Number of triplets: 160 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 4.231 ( 20.870 8.115 11.235) 25.053 4.273 ( 22.266 7.330 19.405) 30.431 4.563 ( 18.334 0.369 -4.852) 18.969 4.660 ( 16.272 -6.305 -0.502) 17.458 4.729 ( 16.921 -4.553 -4.766) 18.159 4.801 ( 10.991 -8.855 -4.523) 14.821 4.937 ( 22.089 0.691 -7.592) 23.368 5.035 ( 20.571 -7.485 -6.011) 22.701 5.498 ( 9.908 2.148 6.827) 12.223 5.557 ( 8.285 -3.138 3.594) 9.561 5.727 ( 10.709 2.896 -14.570) 18.313 5.813 ( 9.639 -5.245 -15.824) 19.257 6.073 ( 9.146 8.740 7.380) 14.646 6.192 ( 5.772 3.185 0.492) 6.611 6.264 ( 8.902 -4.474 4.717) 11.023 6.313 ( 6.609 -2.997 -0.474) 7.272 6.532 ( 6.536 10.621 -1.990) 12.629 6.628 ( 8.947 1.775 -4.799) 10.307 6.871 ( 8.310 4.492 3.873) 10.210 6.910 ( 11.258 -1.427 3.632) 11.915 7.070 ( 6.530 3.813 1.076) 7.638 7.108 ( -1.015 3.475 -1.652) 3.979 7.275 ( 13.228 1.161 -6.849) 14.941 7.296 ( 13.454 -4.476 -6.272) 15.505 7.436 ( 4.091 2.545 0.547) 4.849 7.548 ( 2.696 -7.261 1.238) 7.844 7.597 ( 11.596 16.309 2.397) 20.154 7.748 ( -0.495 10.970 11.607) 15.978 7.871 ( -1.876 2.560 -0.235) 3.183 8.023 ( 8.781 -13.180 -5.783) 16.860 8.058 ( 6.611 -1.431 -9.594) 11.739 8.227 ( 2.187 -6.244 -0.973) 6.687 8.376 ( 3.989 0.008 -1.065) 4.128 8.422 ( 3.288 -3.493 3.571) 5.981 8.546 ( 6.381 1.467 -1.250) 6.666 8.644 ( 10.947 -3.114 -1.844) 11.530 8.684 ( 10.556 1.772 1.163) 10.767 8.767 ( 3.411 -4.122 1.415) 5.534 8.864 ( 6.444 -0.755 7.966) 10.274 8.955 ( 17.549 -5.428 6.986) 19.653 9.189 ( 7.288 3.032 0.262) 7.897 9.218 ( 6.826 -0.811 -0.913) 6.934 9.380 ( 11.004 2.566 -1.338) 11.378 9.441 ( 7.314 -2.532 -0.419) 7.752 9.579 ( 13.853 1.409 4.788) 14.724 9.617 ( 18.371 -1.509 -1.356) 18.482 9.676 ( 19.269 2.013 1.928) 19.469 9.738 ( 17.052 -3.459 3.176) 17.687 10.032 ( 12.001 3.114 9.802) 15.805 10.089 ( 10.433 -2.101 10.026) 14.621 10.289 ( 7.522 8.962 0.947) 11.739 10.441 ( 8.064 -6.069 -2.390) 10.372 10.857 ( 7.559 3.372 -14.485) 16.683 10.909 ( 7.596 -0.682 -9.249) 11.987 11.129 ( 2.564 2.633 -4.471) 5.787 11.190 ( 2.613 -1.285 3.549) 4.590 11.515 ( 3.762 1.059 5.120) 6.441 11.572 ( 0.464 -3.636 -1.319) 3.895 12.038 ( -0.532 4.249 -2.861) 5.150 12.126 ( -1.532 -2.907 -0.717) 3.363 12.227 ( -1.879 2.326 -0.517) 3.034 12.309 ( -3.699 -5.116 -1.236) 6.433 12.454 ( 7.735 1.793 1.175) 8.026 12.487 ( 7.327 -1.866 0.638) 7.588 13.351 ( 2.493 5.226 2.500) 6.307 13.373 ( 2.734 2.722 -0.452) 3.884 13.650 ( 3.335 1.198 -0.952) 3.670 13.724 ( 2.586 -5.600 -0.477) 6.186 14.126 ( -0.443 3.101 -0.381) 3.155 14.208 ( -0.475 -5.502 2.764) 6.176 14.375 ( -1.330 2.901 1.333) 3.459 14.493 ( 1.181 -8.309 0.296) 8.398 14.625 ( -0.980 0.881 -1.188) 1.775 14.664 ( -1.534 -3.062 -0.244) 3.433 14.779 ( -4.755 4.882 2.632) 7.306 14.856 ( -3.022 -2.919 3.410) 5.412 15.002 ( -5.255 1.962 -1.269) 5.752 15.078 ( -5.362 -5.994 -2.544) 8.435 15.234 ( -2.936 3.118 -0.280) 4.292 15.304 ( -2.546 -3.939 -3.350) 5.764 18.134 ( -1.596 14.349 -0.921) 14.467 18.272 ( -2.437 14.152 0.359) 14.365 18.401 ( -0.854 -9.194 -0.937) 9.281 18.534 ( -0.988 -8.406 1.368) 8.574 18.785 ( -0.780 4.575 -0.297) 4.651 18.885 ( -1.928 1.545 0.421) 2.506 18.931 ( -3.096 -2.990 -1.952) 4.726 19.045 ( -4.079 -7.519 2.012) 8.787 20.043 ( 8.092 2.932 -1.630) 8.760 20.082 ( 6.903 -0.049 -1.083) 6.988 20.155 ( 6.059 0.336 1.497) 6.250 20.196 ( 4.298 -2.841 1.414) 5.343 21.264 ( 15.007 1.960 0.527) 15.144 21.308 ( 14.727 -2.420 0.314) 14.928 21.494 ( 13.829 1.274 0.175) 13.888 21.520 ( 13.269 -1.433 0.748) 13.367 22.206 ( 17.474 6.728 -2.132) 18.846 22.331 ( 14.536 -1.628 0.702) 14.644 22.412 ( 13.714 2.295 -1.204) 13.956 22.571 ( 8.399 -9.562 -0.374) 12.732 24.356 ( -1.059 1.626 2.484) 3.152 24.389 ( -0.207 -1.708 2.434) 2.981 24.524 ( 1.426 1.098 -2.269) 2.896 24.542 ( 1.544 -0.723 -3.063) 3.506 28.842 ( 1.710 5.128 0.846) 5.472 28.871 ( 1.618 3.603 0.350) 3.965 28.953 ( -0.610 -4.907 1.239) 5.097 28.959 ( -0.352 -4.227 -1.000) 4.358 29.320 ( -2.129 2.857 1.695) 3.946 29.372 ( -2.362 -2.458 0.990) 3.550 29.464 ( -2.074 1.210 -1.754) 2.973 29.482 ( -2.322 -0.642 -1.107) 2.651 33.542 ( 6.556 3.715 0.169) 7.538 33.554 ( 6.661 3.744 -0.036) 7.641 33.632 ( 6.488 -4.360 0.268) 7.821 33.645 ( 6.740 -4.454 -0.559) 8.099 35.934 ( -5.200 9.636 2.102) 11.149 36.031 ( -5.787 4.969 0.090) 7.628 36.197 ( -8.988 -0.879 1.641) 9.179 36.369 ( -11.612 -12.871 -2.949) 17.584 38.089 ( -3.152 17.839 -0.757) 18.131 38.199 ( -5.918 17.780 0.807) 18.757 38.468 ( -2.703 -17.767 0.074) 17.971 38.565 ( -6.624 -16.538 -1.202) 17.856 38.920 ( -2.830 4.819 0.819) 5.648 39.052 ( -6.562 -6.865 1.988) 9.702 39.430 ( -9.387 5.424 -2.552) 11.138 39.549 ( -8.837 -5.303 -0.138) 10.307 40.253 ( -9.653 14.106 1.154) 17.132 40.529 ( -11.494 -13.030 -2.093) 17.500 41.040 ( -20.942 6.978 2.425) 22.207 41.156 ( -21.849 -4.877 -0.689) 22.397 43.432 ( -8.426 8.398 3.899) 12.519 43.509 ( -8.693 2.152 -5.249) 10.380 43.879 ( -14.395 -2.421 3.951) 15.123 43.933 ( -13.868 -6.324 -2.457) 15.438 69.596 ( -13.557 5.468 0.810) 14.640 69.634 ( -15.122 3.103 -2.725) 15.676 69.898 ( -19.098 -0.926 0.980) 19.146 69.970 ( -22.516 -6.715 1.240) 23.529 105.029 ( -3.866 0.511 -1.236) 4.091 105.039 ( -4.065 -0.509 -0.906) 4.196 105.087 ( -3.664 0.916 1.115) 3.938 105.104 ( -3.987 -0.871 1.011) 4.205 ======================= Grid point 123 (66/102) ======================= q-point: ( 0.38 0.40 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 Number of triplets: 160 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 4.633 ( 16.937 6.584 8.400) 20.019 4.730 ( 17.874 1.446 10.930) 21.001 4.862 ( 13.376 1.578 -6.178) 14.818 4.940 ( 12.976 -2.414 1.421) 13.275 4.960 ( 7.213 -4.745 -1.068) 8.700 5.059 ( 14.913 -8.368 -4.212) 17.612 5.357 ( 19.416 2.274 -4.406) 20.039 5.432 ( 19.136 -4.663 -3.624) 20.026 5.699 ( 8.107 -0.774 0.242) 8.148 5.711 ( 8.391 -2.252 -2.959) 9.178 5.894 ( 8.744 1.057 -8.050) 11.932 5.938 ( 7.009 -3.494 -9.343) 12.191 6.211 ( 2.722 5.966 0.464) 6.574 6.299 ( 5.988 5.866 2.000) 8.618 6.357 ( 1.388 -2.072 2.317) 3.405 6.440 ( 4.512 -1.700 3.425) 5.914 6.626 ( 3.877 11.215 -0.045) 11.866 6.802 ( 6.639 -4.093 -1.321) 7.910 6.973 ( -0.031 7.782 -1.384) 7.905 7.034 ( 1.717 3.614 -2.794) 4.881 7.043 ( -1.741 4.488 2.928) 5.634 7.146 ( 3.242 -5.076 6.196) 8.641 7.364 ( -1.607 0.497 0.405) 1.730 7.401 ( 0.907 -2.657 0.707) 2.895 7.602 ( 4.723 3.854 0.111) 6.097 7.628 ( 3.540 -1.957 -5.208) 6.594 7.685 ( -0.593 5.968 3.586) 6.988 7.730 ( -4.182 0.258 -1.885) 4.595 7.807 ( -0.042 7.238 -6.273) 9.578 8.040 ( -5.884 -13.363 -2.439) 14.803 8.112 ( -2.936 0.387 -3.560) 4.631 8.195 ( -2.053 -6.309 -4.509) 8.022 8.452 ( 3.577 -0.083 0.097) 3.579 8.511 ( 3.715 -5.395 1.734) 6.776 8.617 ( 5.153 1.969 5.733) 7.956 8.687 ( 1.873 -3.309 2.793) 4.718 8.745 ( -0.269 2.195 0.909) 2.391 8.804 ( -0.709 -4.702 3.431) 5.863 9.169 ( 10.219 8.800 3.514) 13.936 9.257 ( 2.098 0.853 1.939) 2.982 9.350 ( 13.670 4.184 8.647) 16.708 9.450 ( 16.754 -4.262 1.282) 17.335 9.614 ( 12.920 1.126 2.046) 13.130 9.659 ( 12.473 -1.786 0.939) 12.635 9.827 ( 9.839 4.069 0.734) 10.672 9.913 ( 10.846 -4.269 0.716) 11.678 9.975 ( 9.864 4.285 4.544) 11.675 10.053 ( 9.980 -3.724 1.541) 10.763 10.271 ( 10.725 1.943 5.890) 12.389 10.321 ( 13.149 -2.249 4.650) 14.127 10.466 ( 9.920 7.787 0.301) 12.615 10.599 ( 8.255 -4.654 -3.105) 9.972 10.999 ( 8.017 3.992 -10.190) 13.566 11.053 ( 5.795 1.713 -3.704) 7.088 11.167 ( 3.268 -0.444 -12.016) 12.461 11.250 ( 2.832 -5.105 -3.731) 6.928 11.595 ( 2.536 -2.308 2.596) 4.301 11.606 ( 2.347 -3.023 7.887) 8.767 12.022 ( -0.025 3.766 -4.557) 5.912 12.119 ( 0.971 -5.128 -5.958) 7.921 12.290 ( 8.644 1.110 -0.782) 8.750 12.338 ( 7.384 -3.548 0.334) 8.199 12.676 ( 12.929 2.768 1.107) 13.268 12.703 ( 13.491 -0.167 0.806) 13.516 13.352 ( -2.534 6.256 2.052) 7.055 13.373 ( -2.730 2.934 -0.841) 4.095 13.655 ( -2.500 1.927 -0.575) 3.209 13.727 ( -2.133 -4.221 0.529) 4.758 14.117 ( -0.630 5.622 0.711) 5.702 14.228 ( 1.884 -5.308 3.362) 6.559 14.358 ( -0.409 2.553 -0.182) 2.592 14.491 ( -1.622 -10.676 2.101) 11.001 14.622 ( 0.402 0.692 1.449) 1.655 14.652 ( -0.515 -1.904 0.292) 1.994 14.719 ( -0.911 3.743 -0.239) 3.860 14.810 ( -1.955 -4.823 1.781) 5.501 14.917 ( -2.856 1.974 -2.099) 4.057 14.984 ( -3.777 -5.332 -2.503) 6.998 15.176 ( -2.935 3.027 0.413) 4.236 15.245 ( -2.856 -4.098 -2.014) 5.385 18.114 ( -0.249 14.537 -0.814) 14.562 18.233 ( -1.575 14.677 -0.087) 14.761 18.392 ( 0.174 -9.258 -0.779) 9.292 18.519 ( -0.748 -9.025 0.966) 9.107 18.764 ( -1.120 2.755 0.091) 2.975 18.845 ( -1.884 1.990 0.292) 2.756 18.864 ( -3.166 -3.098 -1.570) 4.699 18.969 ( -3.829 -6.549 1.581) 7.749 20.172 ( 5.122 2.171 -1.250) 5.702 20.192 ( 4.325 0.625 -0.560) 4.406 20.257 ( 3.911 -0.679 0.758) 4.041 20.268 ( 2.694 -1.345 1.434) 3.335 21.539 ( 11.927 1.760 1.116) 12.108 21.577 ( 11.667 -2.070 1.058) 11.896 21.738 ( 10.352 0.827 -0.457) 10.395 21.755 ( 9.823 -0.858 -0.151) 9.861 22.486 ( 10.539 6.494 -1.872) 12.520 22.538 ( 7.467 5.459 0.737) 9.280 22.659 ( 9.367 -5.831 -1.475) 11.132 22.712 ( 6.501 -6.879 0.322) 9.470 24.352 ( -0.047 2.213 3.110) 3.817 24.401 ( 0.715 -2.756 2.594) 3.851 24.549 ( 1.553 1.282 -2.789) 3.440 24.570 ( 1.764 -0.754 -3.172) 3.707 28.875 ( 1.372 3.252 1.110) 3.701 28.905 ( 1.711 1.886 -0.084) 2.548 28.943 ( -0.531 -2.990 1.004) 3.198 28.954 ( 0.027 -2.456 -1.095) 2.689 29.287 ( -1.506 2.334 1.884) 3.356 29.332 ( -1.796 -2.196 1.060) 3.028 29.421 ( -1.789 1.139 -1.752) 2.751 29.440 ( -1.642 -0.742 -1.266) 2.203 33.654 ( 4.469 4.060 0.457) 6.055 33.671 ( 5.013 4.139 -0.279) 6.507 33.743 ( 4.445 -4.167 0.374) 6.104 33.764 ( 5.087 -4.458 -0.619) 6.793 35.857 ( -2.890 6.630 1.628) 7.414 35.937 ( -3.730 1.809 0.600) 4.188 36.055 ( -5.498 -0.447 0.722) 5.563 36.168 ( -7.909 -8.457 -2.587) 11.864 38.021 ( -3.263 18.284 -1.217) 18.613 38.114 ( -2.936 18.151 1.533) 18.451 38.404 ( -3.625 -19.229 -1.351) 19.614 38.470 ( -2.690 -16.305 0.469) 16.532 38.889 ( -0.370 1.889 0.245) 1.940 38.952 ( -3.623 -3.497 2.151) 5.475 39.244 ( -8.449 5.510 -2.622) 10.422 39.370 ( -8.759 -6.053 -0.112) 10.648 40.109 ( -4.811 10.807 0.980) 11.870 40.336 ( -7.401 -11.485 -0.918) 13.694 40.672 ( -15.999 6.444 1.319) 17.299 40.770 ( -16.356 -3.590 -0.606) 16.756 43.292 ( -6.240 9.062 3.044) 11.416 43.354 ( -5.693 5.152 -4.475) 8.887 43.640 ( -10.310 -4.568 3.740) 11.880 43.693 ( -9.423 -7.692 -2.296) 12.379 69.359 ( -10.216 3.451 1.183) 10.848 69.373 ( -10.164 2.545 -2.282) 10.723 69.580 ( -12.933 -2.127 0.755) 13.129 69.599 ( -14.654 -3.546 0.433) 15.083 104.962 ( -2.617 0.383 -0.409) 2.676 104.970 ( -2.676 -0.449 -0.328) 2.733 105.022 ( -2.866 0.686 0.366) 2.969 105.035 ( -3.072 -0.595 0.362) 3.150 ======================= Grid point 124 (67/102) ======================= q-point: ( 0.44 0.40 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 Number of triplets: 160 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 4.887 ( 6.908 4.311 -0.171) 8.145 4.973 ( 5.503 -3.342 4.696) 7.969 5.071 ( 6.948 0.282 0.163) 6.955 5.116 ( 8.281 -4.301 -2.938) 9.783 5.217 ( 12.358 2.860 4.023) 13.307 5.283 ( 8.600 -3.093 -3.262) 9.704 5.631 ( 8.311 4.093 -2.385) 9.566 5.716 ( 8.410 -3.475 -5.949) 10.872 5.811 ( 5.018 2.069 -4.738) 7.205 5.892 ( 6.939 -5.730 -7.058) 11.437 6.057 ( 8.374 0.569 -2.200) 8.677 6.073 ( 8.118 -0.372 -0.766) 8.163 6.254 ( 2.763 3.637 -1.282) 4.744 6.353 ( 0.506 -4.906 -2.062) 5.346 6.425 ( 4.301 9.697 9.546) 14.272 6.526 ( 4.767 1.571 4.233) 6.565 6.673 ( 0.433 7.545 0.822) 7.602 6.818 ( -4.035 -8.285 1.697) 9.371 6.933 ( -2.915 8.184 3.151) 9.241 7.031 ( 0.034 1.976 -2.325) 3.051 7.067 ( 2.294 2.740 3.719) 5.158 7.207 ( -0.182 -6.830 2.372) 7.233 7.331 ( -0.446 4.085 1.457) 4.360 7.403 ( -0.590 -1.479 -3.087) 3.474 7.507 ( -6.919 4.610 0.399) 8.324 7.607 ( -3.457 -4.211 -1.135) 5.565 7.641 ( -3.392 2.058 -3.256) 5.132 7.721 ( 1.726 -6.479 -10.252) 12.250 7.783 ( -3.557 -3.385 -6.892) 8.462 7.863 ( -10.704 -8.205 -3.179) 13.856 8.065 ( 2.690 5.224 2.802) 6.510 8.158 ( 0.031 -3.939 -3.693) 5.400 8.468 ( 0.955 5.358 0.657) 5.482 8.562 ( -0.562 -3.332 0.831) 3.480 8.623 ( -5.409 1.918 3.107) 6.526 8.654 ( -2.882 -2.234 4.130) 5.509 8.872 ( 7.321 1.901 2.822) 8.073 8.897 ( 7.589 -0.819 5.202) 9.237 9.244 ( -0.143 4.321 0.980) 4.433 9.279 ( -0.025 -0.066 1.847) 1.849 9.595 ( 7.501 8.653 14.948) 18.830 9.698 ( 6.298 -2.978 5.353) 8.785 9.796 ( 3.381 0.896 8.408) 9.107 9.850 ( 4.714 -3.553 2.259) 6.320 10.029 ( 10.096 4.677 -1.533) 11.231 10.106 ( 3.816 -0.772 1.449) 4.154 10.132 ( 9.062 0.716 3.449) 9.723 10.195 ( 8.208 -4.374 -3.500) 9.937 10.475 ( 7.659 9.322 1.453) 12.152 10.576 ( 9.752 2.590 1.010) 10.140 10.670 ( 9.602 -2.874 -0.687) 10.046 10.731 ( 5.036 -5.861 -2.882) 8.248 11.054 ( -1.921 6.996 -7.838) 10.681 11.136 ( 4.926 1.970 -5.565) 7.688 11.190 ( 0.452 -3.143 -10.539) 11.007 11.247 ( -2.062 -7.299 -6.260) 9.835 11.652 ( 2.299 -2.642 4.417) 5.637 11.664 ( 1.842 -3.431 6.706) 7.755 12.025 ( 0.894 2.893 -4.934) 5.789 12.127 ( 1.287 -6.971 -8.262) 10.886 12.550 ( 15.995 0.787 -0.503) 16.022 12.575 ( 14.515 -1.848 0.431) 14.639 12.911 ( 7.777 2.963 1.779) 8.511 12.963 ( 8.752 -2.014 1.103) 9.048 13.272 ( -5.151 4.526 0.551) 6.879 13.291 ( -2.712 2.898 1.104) 4.119 13.563 ( -5.981 5.427 -0.540) 8.094 13.649 ( -5.406 -1.926 -0.605) 5.771 14.106 ( -0.670 8.824 3.318) 9.451 14.290 ( 3.138 -7.339 3.600) 8.755 14.352 ( -0.118 3.915 -2.675) 4.743 14.458 ( -1.462 -8.484 1.712) 8.777 14.599 ( -2.810 0.955 5.393) 6.156 14.652 ( -0.646 -3.974 4.070) 5.725 14.738 ( 2.299 1.365 -4.174) 4.957 14.788 ( -0.212 -4.206 -0.662) 4.263 14.887 ( 0.770 -0.902 -3.626) 3.815 14.912 ( -2.642 -3.814 -2.807) 5.423 15.119 ( -2.867 2.582 1.408) 4.107 15.182 ( -3.021 -3.938 -0.787) 5.025 18.119 ( 0.806 14.741 -0.443) 14.770 18.207 ( -1.012 15.385 -0.858) 15.442 18.401 ( 0.597 -9.353 0.168) 9.374 18.505 ( -0.796 -9.469 -0.120) 9.503 18.746 ( -0.703 1.170 0.264) 1.391 18.805 ( -2.083 0.397 -1.079) 2.380 18.821 ( -0.392 -2.097 0.506) 2.193 18.901 ( -3.091 -5.295 0.996) 6.211 20.243 ( 2.199 1.533 -0.404) 2.711 20.254 ( 2.072 0.669 -0.582) 2.254 20.308 ( 1.260 -0.169 1.348) 1.853 20.319 ( 2.006 -1.034 0.187) 2.264 21.735 ( 7.022 1.518 1.709) 7.384 21.767 ( 6.673 -1.719 1.733) 7.105 21.897 ( 5.404 0.408 -1.112) 5.533 21.904 ( 4.996 -0.275 -0.891) 5.083 22.610 ( 2.857 5.502 1.336) 6.342 22.667 ( 4.975 4.253 -2.077) 6.867 22.758 ( 2.200 -2.741 1.764) 3.933 22.846 ( 5.643 -7.180 -3.240) 9.689 24.362 ( 0.258 2.716 3.554) 4.481 24.423 ( 0.748 -3.410 2.765) 4.453 24.569 ( 0.948 1.476 -3.221) 3.668 24.594 ( 1.161 -0.964 -3.070) 3.421 28.898 ( 0.536 1.740 1.095) 2.124 28.929 ( 0.080 -1.031 1.164) 1.557 28.943 ( 0.832 -0.129 -0.641) 1.058 28.955 ( 0.269 -0.910 -1.051) 1.415 29.268 ( -0.791 1.990 1.922) 2.878 29.307 ( -0.898 -1.900 1.410) 2.531 29.387 ( -1.147 1.403 -1.784) 2.543 29.412 ( -0.859 -1.089 -1.492) 2.037 33.722 ( 2.154 4.371 0.633) 4.914 33.749 ( 2.771 4.550 -0.550) 5.355 33.811 ( 2.166 -4.196 0.593) 4.759 33.842 ( 2.756 -4.429 -0.691) 5.262 35.824 ( -0.785 3.637 1.516) 4.018 35.882 ( -2.012 -1.242 1.244) 2.672 35.977 ( -2.526 0.862 -0.169) 2.674 36.041 ( -4.186 -4.646 -2.555) 6.755 37.969 ( -1.530 18.608 -0.068) 18.671 38.071 ( -1.931 18.619 -0.069) 18.719 38.346 ( -1.516 -19.232 0.021) 19.292 38.434 ( -1.336 -17.717 -0.100) 17.767 38.895 ( 0.273 1.390 0.135) 1.423 38.931 ( 1.566 -1.585 2.761) 3.548 39.089 ( -6.326 4.689 -2.619) 8.299 39.208 ( -7.018 -6.203 -0.613) 9.386 40.065 ( 0.085 7.394 0.653) 7.424 40.225 ( -4.060 -8.179 -0.515) 9.145 40.417 ( -9.133 5.615 1.120) 10.779 40.506 ( -9.701 -3.152 -0.678) 10.223 43.197 ( -3.754 10.121 2.231) 11.023 43.266 ( -2.104 7.088 -3.700) 8.268 43.483 ( -6.012 -6.200 3.345) 9.261 43.550 ( -4.403 -8.957 -1.898) 10.160 69.198 ( -5.733 2.917 0.898) 6.495 69.222 ( -4.514 1.125 -1.776) 4.979 69.370 ( -7.761 -0.988 1.646) 7.995 69.395 ( -6.217 -2.938 -0.747) 6.917 104.923 ( -1.168 0.362 0.211) 1.241 104.931 ( -1.141 -0.432 0.115) 1.225 104.976 ( -1.674 0.477 -0.205) 1.752 104.985 ( -1.895 -0.392 -0.125) 1.940 ======================= Grid point 125 (68/102) ======================= q-point: (-0.50 0.40 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 Number of triplets: 160 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 4.950 ( -0.734 0.983 0.760) 1.443 5.005 ( -1.762 -4.738 1.328) 5.227 5.114 ( -5.282 3.147 -3.763) 7.209 5.150 ( -2.166 -0.316 -3.107) 3.800 5.386 ( 2.820 0.061 3.146) 4.225 5.403 ( 1.808 -1.828 1.100) 2.796 5.723 ( 1.904 5.535 -1.415) 6.022 5.757 ( -1.360 2.127 -8.183) 8.564 5.858 ( 0.242 -1.079 -2.198) 2.461 5.909 ( -1.396 -5.880 -7.680) 9.773 6.182 ( 4.102 2.897 0.552) 5.052 6.206 ( 1.866 3.462 -0.144) 3.936 6.293 ( -0.750 1.288 -1.934) 2.441 6.341 ( -0.672 -2.716 -3.059) 4.145 6.577 ( 6.721 5.915 10.878) 14.089 6.649 ( 4.518 5.646 5.766) 9.249 6.669 ( -1.626 1.848 5.234) 5.784 6.748 ( 0.991 -1.501 -2.490) 3.071 6.891 ( -0.424 2.897 8.306) 8.806 7.012 ( -4.435 -6.772 3.895) 8.983 7.135 ( 4.582 1.578 -2.964) 5.681 7.193 ( 1.399 -3.132 -2.802) 4.429 7.282 ( -3.184 0.255 3.170) 4.500 7.353 ( -2.482 -5.712 -3.182) 6.994 7.449 ( -6.731 2.828 0.212) 7.304 7.511 ( -6.964 -1.892 -4.811) 8.674 7.592 ( 4.270 -0.678 -6.976) 8.207 7.663 ( -3.808 -6.134 -3.737) 8.129 7.718 ( 2.641 -0.224 -7.970) 8.399 7.772 ( 3.584 -4.166 -5.348) 7.668 8.139 ( 2.416 4.973 0.871) 5.597 8.225 ( 5.671 -3.222 -2.696) 7.057 8.493 ( 0.458 3.417 1.118) 3.624 8.524 ( -4.306 3.129 2.189) 5.755 8.535 ( -1.498 -0.174 3.248) 3.581 8.606 ( -1.551 -2.166 2.842) 3.896 8.963 ( -0.075 4.082 4.335) 5.955 9.006 ( 1.749 -0.070 4.798) 5.107 9.217 ( -2.450 4.496 0.076) 5.120 9.272 ( -1.309 -1.707 5.565) 5.966 9.707 ( 1.238 4.623 7.659) 9.031 9.757 ( -0.121 -2.620 8.105) 8.519 9.841 ( -0.545 0.435 11.086) 11.108 9.887 ( -1.231 -3.900 4.235) 5.887 10.137 ( 1.443 2.403 -0.168) 2.808 10.172 ( 2.174 1.506 4.428) 5.157 10.233 ( 0.914 5.195 1.916) 5.612 10.362 ( 5.220 -5.685 -1.808) 7.927 10.526 ( -3.252 11.745 -2.139) 12.373 10.700 ( 0.075 3.003 -5.395) 6.175 10.756 ( 2.057 -5.322 -0.652) 5.743 10.800 ( -1.122 -3.069 0.047) 3.268 10.977 ( -0.972 4.336 -8.736) 9.801 11.101 ( -5.926 -4.383 -12.868) 14.830 11.178 ( -1.294 0.313 -2.742) 3.049 11.220 ( 2.374 -5.913 -4.221) 7.644 11.696 ( 0.952 -2.186 4.810) 5.368 11.700 ( 0.309 -2.980 3.526) 4.627 12.022 ( -0.437 2.729 -4.906) 5.631 12.132 ( 0.729 -7.868 -8.333) 11.484 12.791 ( -1.444 3.037 1.455) 3.664 12.838 ( 3.089 -1.826 -0.540) 3.629 12.930 ( -0.496 -0.422 -0.760) 1.001 12.943 ( 1.908 -1.657 -0.939) 2.696 13.240 ( -1.917 4.511 4.791) 6.854 13.309 ( -1.093 -1.976 6.148) 6.550 13.469 ( -0.267 8.794 -3.820) 9.592 13.557 ( -0.069 0.855 -3.407) 3.513 14.111 ( 0.299 9.566 4.954) 10.777 14.300 ( -2.575 -3.159 0.506) 4.107 14.377 ( 2.268 -0.413 0.152) 2.310 14.456 ( 1.305 -4.370 -0.513) 4.590 14.560 ( -2.015 -0.641 5.228) 5.639 14.619 ( -3.520 -6.942 5.818) 9.718 14.781 ( 2.937 -0.151 -3.731) 4.751 14.802 ( 1.389 -2.470 -1.218) 3.084 14.882 ( 0.800 -0.826 -3.783) 3.954 14.929 ( 3.916 -3.889 -4.409) 7.064 15.071 ( -2.234 2.240 2.408) 3.976 15.129 ( -1.916 -3.725 0.257) 4.197 18.138 ( 0.867 15.685 0.236) 15.711 18.187 ( -0.615 15.548 -1.763) 15.660 18.412 ( 0.240 -8.925 1.480) 9.050 18.487 ( -0.759 -11.834 -1.543) 11.958 18.739 ( 0.150 2.109 0.393) 2.150 18.781 ( -0.154 0.911 -0.820) 1.235 18.830 ( 0.179 -3.959 1.240) 4.153 18.863 ( 0.141 -4.303 0.126) 4.307 20.263 ( -0.123 1.254 0.067) 1.262 20.274 ( 0.084 0.442 -0.654) 0.794 20.322 ( -0.172 0.536 1.155) 1.285 20.342 ( 0.213 -1.147 0.049) 1.168 21.819 ( 0.877 1.167 2.444) 2.847 21.844 ( 0.564 -1.337 2.294) 2.714 21.939 ( -0.881 0.618 -1.907) 2.189 21.949 ( -0.443 -0.384 -1.438) 1.553 22.632 ( -0.849 5.187 1.396) 5.438 22.716 ( 0.482 0.245 -1.101) 1.227 22.777 ( -0.711 1.948 0.835) 2.236 22.905 ( 0.874 -7.420 -3.380) 8.200 24.372 ( -0.069 2.949 3.836) 4.839 24.437 ( -0.036 -3.546 2.984) 4.635 24.571 ( -0.011 1.653 -3.602) 3.963 24.601 ( 0.184 -1.289 -3.068) 3.333 28.901 ( -0.316 1.080 1.023) 1.521 28.925 ( -0.614 -1.284 0.959) 1.716 28.951 ( 0.073 0.551 -0.991) 1.136 28.964 ( 0.677 -0.748 -0.563) 1.155 29.264 ( -0.001 2.007 1.977) 2.817 29.302 ( 0.143 -1.841 1.751) 2.544 29.371 ( -0.003 1.567 -1.886) 2.452 29.399 ( -0.043 -1.292 -1.721) 2.152 33.743 ( -0.119 4.513 0.667) 4.564 33.777 ( 0.143 4.820 -0.674) 4.869 33.832 ( -0.123 -4.373 0.729) 4.435 33.869 ( 0.100 -4.389 -0.723) 4.449 35.825 ( 0.269 1.397 1.652) 2.180 35.862 ( -0.073 -2.081 1.817) 2.764 35.941 ( -1.089 2.393 -1.356) 2.958 36.000 ( 0.826 -3.454 -2.193) 4.174 37.965 ( 1.033 18.438 1.149) 18.503 38.034 ( -1.402 18.258 -1.652) 18.386 38.347 ( 1.303 -18.572 1.499) 18.678 38.411 ( -0.864 -18.173 -1.120) 18.228 38.895 ( -0.896 4.055 1.995) 4.607 38.981 ( -2.273 -2.680 0.846) 3.615 39.018 ( 4.373 2.501 -0.775) 5.097 39.113 ( -1.082 -5.119 -2.321) 5.724 40.098 ( 1.594 3.467 1.038) 3.954 40.151 ( -2.189 -1.261 -1.097) 2.754 40.333 ( 0.068 2.807 1.658) 3.260 40.402 ( 0.399 -3.630 -1.112) 3.818 43.153 ( -0.955 11.041 1.456) 11.177 43.257 ( 1.926 7.562 -3.341) 8.488 43.413 ( -1.734 -6.837 3.198) 7.745 43.510 ( 0.740 -9.682 -1.346) 9.803 69.138 ( -0.369 3.281 0.564) 3.349 69.185 ( 1.186 -0.536 -1.608) 2.069 69.285 ( -1.041 0.673 1.652) 2.065 69.334 ( 0.227 -3.349 -0.601) 3.410 104.916 ( 0.326 0.399 0.595) 0.787 104.924 ( 0.363 -0.466 0.457) 0.747 104.956 ( -0.241 0.253 -0.554) 0.655 104.960 ( -0.451 -0.176 -0.500) 0.696 ======================= Grid point 126 (69/102) ======================= q-point: (-0.44 0.40 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 Number of triplets: 160 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 4.775 ( -16.589 6.910 -1.163) 18.008 4.917 ( -8.922 -7.863 1.374) 11.971 4.972 ( -7.736 1.170 0.790) 7.864 5.016 ( -9.348 -2.765 -0.833) 9.784 5.297 ( -9.732 1.057 3.311) 10.334 5.364 ( -6.290 -4.722 0.609) 7.889 5.657 ( -6.796 4.348 -8.041) 11.391 5.703 ( -3.721 4.134 -0.977) 5.647 5.794 ( -6.567 -2.674 -3.846) 8.067 5.844 ( -4.804 -4.764 -3.233) 7.498 6.118 ( -7.903 5.398 -5.209) 10.896 6.200 ( -5.289 -2.542 -3.961) 7.080 6.254 ( 0.068 3.435 2.571) 4.291 6.320 ( 0.520 -1.554 -0.657) 1.766 6.593 ( -6.708 10.566 2.790) 12.822 6.663 ( 0.901 7.019 6.537) 9.634 6.725 ( 3.071 3.893 1.976) 5.338 6.830 ( 1.450 -7.406 -0.519) 7.565 6.879 ( -6.200 0.953 2.134) 6.626 6.986 ( 4.696 -4.558 6.169) 8.994 7.152 ( -1.620 4.081 -8.495) 9.563 7.183 ( -8.637 -1.174 4.285) 9.712 7.260 ( -4.132 2.029 4.730) 6.600 7.314 ( 5.908 -1.328 -1.148) 6.163 7.378 ( 6.083 -1.522 -1.127) 6.371 7.433 ( 2.041 -7.411 -3.194) 8.324 7.651 ( 4.133 0.604 -7.029) 8.176 7.733 ( 1.802 -3.709 -7.193) 8.291 7.834 ( 7.906 -2.925 -0.307) 8.436 7.854 ( 9.218 -2.098 -2.661) 9.821 8.178 ( 2.793 4.751 -4.353) 7.023 8.282 ( 1.152 -5.024 -5.378) 7.449 8.442 ( -4.736 2.655 0.544) 5.457 8.487 ( -2.362 1.016 1.430) 2.942 8.556 ( 2.421 1.281 7.717) 8.189 8.621 ( 1.732 -1.980 3.974) 4.766 8.908 ( -5.093 4.941 4.160) 8.226 8.970 ( -5.744 -1.090 4.511) 7.385 9.141 ( -5.721 6.375 0.578) 8.585 9.234 ( -3.927 -2.829 4.233) 6.430 9.685 ( -4.068 3.629 0.751) 5.503 9.772 ( -1.462 -5.955 10.053) 11.775 9.802 ( -7.905 -0.094 7.222) 10.707 9.819 ( -4.077 -1.838 9.458) 10.462 10.095 ( -8.598 6.344 2.469) 10.967 10.168 ( -6.899 -0.661 1.733) 7.144 10.188 ( -2.880 5.592 2.642) 6.822 10.301 ( -10.642 -0.239 0.143) 10.646 10.399 ( -5.808 3.029 -0.879) 6.609 10.564 ( -9.983 -6.504 -4.360) 12.688 10.685 ( -8.305 4.457 1.450) 9.536 10.751 ( -4.590 -1.831 -0.018) 4.941 10.949 ( -2.823 1.980 -8.970) 9.609 10.978 ( -1.777 -0.176 -10.794) 10.941 11.147 ( -0.601 2.322 -7.151) 7.543 11.258 ( 1.712 -8.200 -4.781) 9.646 11.686 ( -1.805 -0.550 3.085) 3.617 11.716 ( -0.118 -3.362 6.142) 7.003 11.977 ( -3.265 3.513 -5.224) 7.091 12.105 ( -2.121 -8.858 -8.106) 12.193 12.564 ( -13.994 1.778 -0.396) 14.112 12.603 ( -14.221 -2.350 -0.277) 14.416 12.923 ( -9.775 3.159 1.724) 10.416 12.976 ( -10.410 -1.881 1.158) 10.642 13.252 ( 7.081 4.924 1.203) 8.708 13.282 ( 2.811 3.321 0.644) 4.399 13.542 ( 5.866 4.600 -0.577) 7.477 13.641 ( 5.620 -3.695 -0.556) 6.749 14.134 ( 0.927 7.341 3.620) 8.238 14.243 ( -2.827 0.075 1.380) 3.146 14.398 ( 0.485 -1.489 -1.452) 2.136 14.491 ( 0.608 -6.895 2.117) 7.238 14.542 ( -0.649 -1.086 2.304) 2.628 14.563 ( -2.135 -4.546 3.553) 6.153 14.794 ( 0.028 1.131 -0.933) 1.467 14.869 ( 3.601 -5.320 -1.121) 6.521 14.921 ( 3.678 3.193 -4.239) 6.457 15.013 ( 4.791 -4.800 -2.944) 7.393 15.045 ( -0.457 2.702 2.108) 3.457 15.116 ( 0.696 -4.210 0.262) 4.275 18.141 ( -0.622 17.772 -0.345) 17.786 18.187 ( 1.016 13.977 -0.953) 14.046 18.418 ( 0.224 -8.175 0.621) 8.202 18.469 ( -0.768 -14.277 -0.656) 14.312 18.757 ( 1.328 3.364 0.746) 3.693 18.793 ( 1.434 0.976 -1.033) 2.019 18.832 ( 0.921 -1.578 0.149) 1.833 18.908 ( 3.195 -6.628 0.907) 7.414 20.239 ( -2.235 1.502 -0.287) 2.708 20.256 ( -1.802 0.228 -0.756) 1.967 20.304 ( -1.847 0.623 1.223) 2.301 20.328 ( -1.664 -1.344 0.366) 2.170 21.778 ( -5.567 1.020 3.307) 6.555 21.801 ( -5.341 -1.260 2.784) 6.154 21.857 ( -6.676 1.003 -2.485) 7.194 21.875 ( -6.461 -0.811 -2.158) 6.860 22.583 ( -4.294 5.811 0.476) 7.241 22.691 ( -2.622 -1.732 -1.115) 3.334 22.724 ( -4.830 3.343 0.688) 5.914 22.866 ( -4.164 -7.602 -2.272) 8.961 24.375 ( -0.490 2.735 3.956) 4.834 24.432 ( -1.005 -3.075 3.168) 4.528 24.555 ( -0.766 1.797 -3.865) 4.331 24.590 ( -0.598 -1.665 -3.235) 3.687 28.890 ( -1.080 0.977 0.960) 1.745 28.908 ( -1.075 -0.725 0.510) 1.394 28.946 ( -0.453 1.066 -0.578) 1.294 28.974 ( 0.418 -1.604 -0.323) 1.689 29.277 ( 0.803 2.250 2.179) 3.234 29.319 ( 1.156 -2.052 1.785) 2.955 29.379 ( 1.215 1.263 -1.995) 2.655 29.403 ( 0.775 -1.067 -1.915) 2.326 33.720 ( -2.357 4.387 0.555) 5.011 33.752 ( -2.570 4.618 -0.476) 5.306 33.809 ( -2.364 -4.334 0.549) 4.967 33.843 ( -2.551 -4.364 -0.644) 5.096 35.835 ( 0.620 2.542 1.721) 3.132 35.894 ( 2.605 -3.131 2.551) 4.806 35.937 ( 1.354 5.345 -2.315) 5.980 36.055 ( 4.827 -6.239 -1.921) 8.119 38.010 ( 1.750 18.053 -0.250) 18.139 38.017 ( 1.579 17.960 0.122) 18.029 38.396 ( 3.062 -17.740 1.625) 18.076 38.398 ( 0.047 -17.890 -1.712) 17.972 38.873 ( -0.964 2.862 0.586) 3.076 38.937 ( -1.314 -2.544 1.871) 3.420 39.139 ( 7.106 1.008 -3.206) 7.861 39.178 ( 6.958 -2.385 0.414) 7.366 40.090 ( 0.117 4.543 0.946) 4.642 40.180 ( 3.209 -4.098 -0.714) 5.254 40.430 ( 9.489 4.276 1.029) 10.459 40.510 ( 9.649 -3.697 -0.681) 10.355 43.166 ( 1.985 11.672 0.892) 11.873 43.327 ( 5.624 4.542 -3.849) 8.190 43.430 ( 2.889 -4.435 3.785) 6.507 43.572 ( 5.715 -9.733 -0.850) 11.319 69.185 ( 4.896 4.371 0.159) 6.565 69.263 ( 6.925 -2.596 -1.775) 7.606 69.334 ( 5.537 2.230 1.826) 6.242 69.404 ( 6.880 -3.888 -0.188) 7.905 104.938 ( 1.703 0.280 0.563) 1.815 104.943 ( 1.295 -0.250 0.036) 1.319 104.967 ( 1.476 0.028 -0.109) 1.480 104.967 ( 1.393 -0.044 -0.494) 1.478 ======================= Grid point 127 (70/102) ======================= q-point: (-0.38 0.40 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 Number of triplets: 160 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 4.368 ( -23.005 13.850 2.801) 26.998 4.623 ( -19.603 -7.375 6.029) 21.795 4.751 ( -15.295 -6.594 -1.407) 16.715 4.789 ( -13.886 -6.108 0.962) 15.200 5.097 ( -9.992 3.407 0.428) 10.566 5.196 ( -9.446 -6.219 0.439) 11.318 5.451 ( -11.677 3.953 -8.828) 15.163 5.564 ( -10.927 -3.722 -2.821) 11.883 5.588 ( -11.952 2.090 0.191) 12.135 5.682 ( -11.442 -3.997 2.282) 12.333 5.954 ( -5.804 5.131 -8.393) 11.422 6.040 ( -7.381 -3.962 -7.932) 11.537 6.224 ( -6.206 7.481 3.487) 10.327 6.322 ( -2.087 -1.534 -0.294) 2.607 6.472 ( -5.323 8.979 1.406) 10.533 6.632 ( -5.339 -1.006 0.749) 5.484 6.675 ( -8.857 4.459 -2.009) 10.118 6.698 ( -6.764 4.602 -6.153) 10.237 6.859 ( 0.102 4.117 4.015) 5.751 7.027 ( -2.468 -7.770 10.665) 13.424 7.099 ( -0.840 -1.613 -3.514) 3.957 7.125 ( -0.984 -5.893 4.425) 7.435 7.263 ( 2.942 8.077 -3.164) 9.160 7.375 ( 1.131 2.617 -2.464) 3.768 7.457 ( -1.336 -0.065 -5.024) 5.199 7.504 ( 2.115 0.235 1.732) 2.743 7.698 ( 1.820 -1.187 1.257) 2.510 7.764 ( 3.769 -3.648 -1.807) 5.548 7.944 ( 4.009 4.467 -0.988) 6.083 8.068 ( 7.014 -4.818 -6.597) 10.767 8.243 ( -5.260 2.454 -1.350) 5.959 8.286 ( 3.570 -1.421 -1.137) 4.007 8.332 ( -1.321 -3.770 -5.460) 6.765 8.369 ( -7.570 -4.917 1.819) 9.208 8.576 ( -3.903 3.504 6.349) 8.235 8.638 ( -1.870 -2.089 2.708) 3.898 8.854 ( -0.603 1.284 3.923) 4.172 8.884 ( -0.563 -0.421 3.798) 3.863 8.985 ( -9.377 7.230 2.911) 12.194 9.117 ( -8.905 -5.154 2.932) 10.699 9.489 ( -16.722 3.685 -0.790) 17.142 9.540 ( -17.238 -1.401 2.227) 17.438 9.703 ( -10.200 -0.109 8.318) 13.162 9.736 ( -15.536 -1.236 5.052) 16.383 9.832 ( -7.785 2.543 1.306) 8.293 9.905 ( -12.954 -2.608 -5.022) 14.136 10.061 ( -11.797 1.935 2.950) 12.314 10.115 ( -12.055 -2.953 9.366) 15.549 10.243 ( -11.042 3.345 3.242) 11.985 10.328 ( -13.259 -3.636 2.735) 14.018 10.520 ( -6.995 6.202 3.944) 10.146 10.631 ( -5.382 -4.370 0.135) 6.934 10.871 ( -2.916 5.158 -11.235) 12.701 10.925 ( -1.967 1.756 -8.160) 8.575 11.088 ( -3.889 4.322 -10.303) 11.831 11.255 ( -0.785 -9.592 -6.119) 11.405 11.661 ( -1.111 2.252 4.525) 5.175 11.733 ( 0.607 -4.356 9.306) 10.293 11.870 ( -5.620 4.903 -5.476) 9.253 12.008 ( -5.120 -8.315 -8.364) 12.857 12.337 ( -7.433 0.961 -1.073) 7.572 12.375 ( -7.368 -2.601 -0.409) 7.824 12.657 ( -14.349 2.930 1.068) 14.684 12.687 ( -15.273 0.035 0.904) 15.300 13.334 ( 1.275 8.899 0.994) 9.045 13.397 ( 4.584 1.809 0.059) 4.929 13.652 ( 4.401 -0.319 -0.529) 4.444 13.724 ( 2.332 -6.475 0.570) 6.906 14.156 ( 0.543 4.966 0.548) 5.025 14.207 ( -0.941 1.232 3.129) 3.492 14.404 ( 0.373 -2.656 -1.292) 2.977 14.468 ( -2.196 -9.301 3.684) 10.242 14.544 ( 0.856 0.369 0.141) 0.943 14.569 ( 1.336 -1.695 0.681) 2.263 14.796 ( 0.384 3.193 0.848) 3.326 14.909 ( 1.011 -7.859 0.188) 7.926 14.995 ( 3.864 5.098 -2.944) 7.042 15.055 ( 1.136 2.547 4.768) 5.524 15.111 ( 5.263 -3.287 -5.592) 8.352 15.164 ( 4.203 -4.847 -1.156) 6.519 18.126 ( -0.474 17.732 -0.958) 17.765 18.216 ( 1.982 13.643 0.075) 13.786 18.422 ( 0.253 -9.505 -2.211) 9.762 18.460 ( -0.017 -12.920 2.297) 13.123 18.792 ( 2.103 3.438 0.337) 4.044 18.828 ( 2.121 3.985 -0.347) 4.528 18.873 ( 2.948 -2.486 -0.931) 3.967 18.978 ( 3.437 -7.949 1.425) 8.776 20.170 ( -4.638 2.208 -1.013) 5.236 20.197 ( -4.022 0.135 -1.036) 4.156 20.251 ( -3.752 0.137 1.381) 4.000 20.276 ( -3.676 -1.707 1.044) 4.186 21.618 ( -10.841 1.298 3.975) 11.620 21.646 ( -10.554 -1.237 2.268) 10.866 21.669 ( -11.255 0.587 -1.868) 11.424 21.687 ( -11.554 -0.957 -2.806) 11.928 22.458 ( -8.214 7.311 -1.264) 11.069 22.575 ( -9.918 7.128 0.692) 12.233 22.610 ( -5.791 -7.497 -1.641) 9.614 22.726 ( -9.656 -7.689 -0.072) 12.343 24.373 ( -0.403 2.037 3.819) 4.347 24.414 ( -1.311 -2.122 3.016) 3.913 24.529 ( -0.937 1.930 -3.743) 4.314 24.567 ( -0.851 -1.957 -3.356) 3.977 28.860 ( -2.063 1.902 0.790) 2.915 28.889 ( -1.005 -0.041 0.476) 1.113 28.932 ( -0.802 1.079 -0.286) 1.375 28.983 ( 0.637 -3.117 -0.047) 3.182 29.305 ( 1.530 2.668 2.353) 3.873 29.354 ( 1.897 -2.363 1.831) 3.541 29.408 ( 1.945 0.850 -2.297) 3.127 29.423 ( 1.695 -0.678 -1.959) 2.677 33.652 ( -4.541 4.046 0.352) 6.092 33.675 ( -4.916 4.261 -0.167) 6.508 33.739 ( -4.694 -4.259 0.244) 6.342 33.767 ( -4.850 -4.439 -0.496) 6.594 35.867 ( 2.260 5.378 1.751) 6.091 35.970 ( 4.485 1.149 2.704) 5.361 35.992 ( 4.647 2.890 -2.099) 5.861 36.184 ( 8.564 -10.101 -1.994) 13.392 38.028 ( 1.854 18.374 -1.492) 18.527 38.102 ( 4.872 17.602 1.770) 18.350 38.410 ( 1.632 -17.591 -1.325) 17.716 38.471 ( 4.047 -16.968 0.478) 17.451 38.871 ( 0.817 2.523 0.410) 2.684 38.954 ( 2.777 -5.141 1.810) 6.117 39.293 ( 8.963 3.512 -3.886) 10.381 39.346 ( 9.084 -1.985 1.331) 9.393 40.144 ( 5.131 6.338 1.450) 8.282 40.277 ( 7.162 -5.645 -1.295) 9.211 40.694 ( 16.049 3.346 1.461) 16.459 40.765 ( 15.814 -3.218 -0.841) 16.160 43.235 ( 4.692 12.196 0.736) 13.088 43.446 ( 6.702 -5.398 -3.793) 9.405 43.562 ( 9.724 4.406 3.648) 11.282 43.733 ( 10.413 -9.256 -0.578) 13.944 69.331 ( 9.615 6.289 -0.177) 11.490 69.452 ( 12.284 -4.947 -2.403) 13.459 69.515 ( 12.083 3.957 2.236) 12.909 69.612 ( 14.046 -4.971 0.433) 14.906 104.975 ( 2.048 0.381 -0.788) 2.227 104.982 ( 2.624 -0.377 -0.412) 2.683 105.012 ( 3.214 0.286 0.321) 3.243 105.018 ( 3.304 -0.262 0.869) 3.426 ======================= Grid point 128 (71/102) ======================= q-point: (-0.31 0.40 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 Number of triplets: 160 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.890 ( -25.511 19.546 7.548) 33.013 4.200 ( -23.646 1.924 9.538) 25.570 4.377 ( -20.592 -16.068 -0.665) 26.128 4.471 ( -17.853 -12.412 2.068) 21.841 4.884 ( -11.294 4.617 -5.353) 13.323 4.988 ( -11.711 -4.964 -1.605) 12.820 5.162 ( -14.852 3.075 -11.210) 18.860 5.278 ( -15.277 -6.539 -7.598) 18.272 5.322 ( -15.668 3.589 5.456) 16.975 5.410 ( -16.035 -4.209 6.427) 17.781 5.851 ( -4.234 4.233 -5.240) 7.956 5.892 ( -6.332 -0.625 -9.121) 11.121 6.027 ( -11.743 8.085 3.156) 14.603 6.182 ( -12.118 -5.928 2.223) 13.672 6.320 ( -12.202 7.600 -1.297) 14.434 6.459 ( -10.907 -6.293 -2.727) 12.884 6.517 ( -6.470 9.589 -1.733) 11.696 6.583 ( -3.605 3.503 -7.687) 9.184 6.798 ( -8.577 5.930 10.496) 14.795 6.911 ( -11.068 -3.540 7.735) 13.960 7.082 ( -1.516 -0.327 -4.274) 4.547 7.097 ( -1.310 -1.072 -5.198) 5.467 7.264 ( -9.671 -1.402 -7.647) 12.409 7.282 ( -2.278 -4.516 -1.617) 5.310 7.440 ( 1.677 10.915 -1.022) 11.090 7.540 ( -0.968 8.435 1.212) 8.576 7.619 ( -17.396 3.439 3.319) 18.040 7.747 ( -12.081 -8.603 6.861) 16.341 7.839 ( -4.787 -0.625 2.267) 5.334 7.970 ( -6.885 -5.432 -3.406) 9.408 8.206 ( -2.798 1.635 -5.841) 6.680 8.238 ( 1.530 1.461 -4.433) 4.912 8.325 ( -1.404 -0.581 -1.740) 2.310 8.419 ( -4.089 -7.709 1.382) 8.835 8.461 ( -7.806 5.327 4.090) 10.297 8.560 ( -3.648 -5.352 -2.502) 6.944 8.714 ( -10.731 6.006 1.784) 12.426 8.816 ( -14.302 1.131 7.389) 16.138 8.947 ( -2.259 -5.329 3.886) 6.971 8.984 ( 2.154 -3.049 7.143) 8.059 9.106 ( -16.760 2.848 -3.232) 17.305 9.184 ( -12.767 -3.660 -3.350) 13.697 9.330 ( -19.038 2.777 -2.569) 19.410 9.398 ( -20.173 -4.032 0.592) 20.581 9.601 ( -17.868 2.541 -0.178) 18.049 9.684 ( -14.957 -4.566 -0.129) 15.639 9.806 ( -12.985 1.971 7.540) 15.145 9.835 ( -15.774 -1.192 5.927) 16.893 9.975 ( -14.382 3.118 5.305) 15.643 10.069 ( -13.218 -4.847 6.981) 15.714 10.407 ( -6.864 5.886 6.525) 11.150 10.509 ( -8.240 -3.929 2.708) 9.522 10.802 ( -1.991 4.065 -11.097) 11.985 10.870 ( -2.957 -2.608 -6.966) 8.005 10.996 ( 0.131 12.888 -8.546) 15.464 11.226 ( 0.359 -9.420 -6.374) 11.380 11.654 ( -1.272 6.651 -0.152) 6.774 11.768 ( -2.363 3.329 2.775) 4.936 11.791 ( 2.592 -2.896 8.720) 9.547 11.908 ( -2.570 -6.835 -8.458) 11.175 12.267 ( 0.527 2.032 -0.268) 2.116 12.314 ( 0.326 -2.264 -1.440) 2.703 12.418 ( -8.343 0.494 1.536) 8.497 12.444 ( -7.587 -1.640 0.059) 7.763 13.314 ( -3.608 9.043 1.088) 9.797 13.417 ( -2.719 -0.849 0.600) 2.911 13.682 ( -1.905 -1.625 -0.307) 2.523 13.736 ( -1.097 -6.144 -0.883) 6.303 14.160 ( 0.332 3.888 -0.414) 3.924 14.220 ( 1.185 0.101 3.235) 3.446 14.401 ( -0.398 -2.024 -0.033) 2.063 14.449 ( -0.152 -8.752 0.869) 8.796 14.584 ( 3.206 1.247 -0.633) 3.498 14.598 ( 1.379 -0.207 0.207) 1.410 14.827 ( 2.675 2.396 2.727) 4.509 14.928 ( 0.925 -6.878 2.428) 7.353 15.064 ( 3.925 3.878 -3.123) 6.340 15.102 ( 2.685 3.425 4.275) 6.101 15.202 ( 5.363 -1.850 -7.096) 9.085 15.269 ( 6.220 -5.471 -1.303) 8.386 18.122 ( 0.333 17.206 -0.883) 17.232 18.268 ( 3.175 13.065 0.327) 13.449 18.417 ( -0.188 -11.647 -1.765) 11.781 18.483 ( 1.676 -9.224 2.152) 9.619 18.839 ( 2.346 3.608 -1.301) 4.496 18.870 ( 1.803 7.072 1.612) 7.474 18.934 ( 3.230 -4.510 -2.134) 5.944 19.049 ( 3.241 -9.216 2.063) 9.985 20.047 ( -7.351 3.262 -1.754) 8.231 20.088 ( -6.561 0.182 -1.175) 6.667 20.158 ( -5.846 -0.712 1.326) 6.037 20.186 ( -5.599 -2.371 1.791) 6.339 21.371 ( -14.431 1.556 3.831) 15.012 21.385 ( -14.922 0.627 -2.845) 15.204 21.413 ( -14.793 -0.790 -2.938) 15.102 21.421 ( -13.758 -1.934 3.672) 14.370 22.242 ( -13.014 8.859 -3.561) 16.141 22.322 ( -15.672 6.136 2.965) 17.089 22.450 ( -10.466 -9.336 -4.442) 14.711 22.485 ( -13.743 -7.848 2.081) 15.962 24.379 ( 0.404 1.005 3.324) 3.496 24.399 ( -0.685 -0.964 2.474) 2.742 24.507 ( -0.372 1.982 -3.126) 3.720 24.545 ( -0.555 -1.936 -3.100) 3.697 28.816 ( -2.305 3.478 0.601) 4.216 28.871 ( -0.859 0.929 1.030) 1.631 28.914 ( -0.908 0.587 -0.349) 1.137 29.000 ( 1.009 -5.125 0.143) 5.225 29.347 ( 2.151 3.027 2.425) 4.435 29.400 ( 2.137 -2.261 1.901) 3.646 29.446 ( 2.464 0.763 -2.591) 3.656 29.462 ( 2.488 -0.704 -1.893) 3.204 33.542 ( -6.405 3.609 0.132) 7.353 33.558 ( -6.636 4.189 0.016) 7.847 33.623 ( -6.799 -4.342 0.035) 8.067 33.651 ( -6.560 -4.736 -0.341) 8.098 35.935 ( 4.135 8.451 1.939) 9.606 36.096 ( 7.846 8.834 1.960) 11.976 36.106 ( 6.823 -2.479 -0.756) 7.298 36.391 ( 12.613 -14.322 -2.258) 19.218 38.082 ( 3.745 18.873 -0.657) 19.252 38.209 ( 5.379 17.719 0.708) 18.531 38.464 ( 4.074 -18.391 0.115) 18.837 38.558 ( 4.648 -15.960 -1.222) 16.668 38.911 ( 3.044 4.682 0.795) 5.641 39.051 ( 6.283 -8.717 1.872) 10.907 39.474 ( 9.620 4.699 -3.536) 11.276 39.534 ( 9.153 -1.532 0.964) 9.331 40.302 ( 10.289 8.642 1.972) 13.581 40.469 ( 12.444 -5.855 -2.819) 14.038 41.063 ( 19.972 2.506 3.064) 20.361 41.135 ( 21.297 -3.689 -1.420) 21.661 43.353 ( 6.756 12.728 1.049) 14.448 43.584 ( 7.929 -9.596 -2.731) 12.744 43.824 ( 15.529 6.916 2.346) 17.160 43.984 ( 14.653 -8.236 -0.521) 16.817 69.563 ( 13.386 9.183 -0.269) 16.235 69.738 ( 16.657 -6.565 -3.955) 18.335 69.830 ( 18.848 5.346 3.466) 19.896 69.971 ( 21.681 -7.022 1.063) 22.814 105.022 ( 2.845 0.857 -0.983) 3.129 105.040 ( 3.244 -0.910 -1.037) 3.525 105.095 ( 4.763 0.291 0.785) 4.836 105.099 ( 4.594 -0.178 1.218) 4.756 ======================= Grid point 129 (72/102) ======================= q-point: (-0.25 0.40 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 Number of triplets: 160 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.392 ( -25.760 25.475 11.184) 37.916 3.733 ( -25.055 14.814 11.638) 31.348 3.962 ( -20.398 -26.938 2.228) 33.863 4.089 ( -21.034 -17.223 3.575) 27.420 4.609 ( -14.432 5.132 -12.099) 19.519 4.706 ( -16.083 -2.637 -3.983) 16.778 4.821 ( -16.488 4.185 -12.694) 21.225 4.924 ( -18.796 1.324 -6.057) 19.792 4.996 ( -17.160 -2.675 2.555) 17.555 5.082 ( -18.073 -6.747 5.905) 20.175 5.624 ( -19.991 6.169 8.343) 22.523 5.706 ( -15.744 -2.226 -0.056) 15.901 5.862 ( -6.192 3.217 -5.911) 9.145 5.914 ( -12.170 -3.269 -3.636) 13.115 5.957 ( -22.112 9.741 9.788) 26.070 6.124 ( -20.200 -6.725 -1.418) 21.337 6.392 ( -6.310 9.211 -4.947) 12.212 6.508 ( -3.303 0.483 -7.103) 7.849 6.585 ( -12.570 7.920 -1.012) 14.891 6.713 ( -7.737 -3.149 -3.635) 9.110 6.860 ( -24.190 5.479 1.169) 24.830 6.954 ( -18.606 4.810 -3.880) 19.605 7.062 ( -2.794 -1.181 -5.336) 6.138 7.092 ( -11.198 -8.677 -4.435) 14.845 7.299 ( -10.063 -1.884 3.682) 10.880 7.344 ( -18.202 -11.417 5.409) 22.157 7.461 ( -2.812 10.560 -0.365) 10.934 7.534 ( -11.568 5.416 1.625) 12.876 7.709 ( -14.047 -0.388 -1.365) 14.118 7.800 ( -15.749 -7.253 4.456) 17.902 7.955 ( -21.418 2.324 0.318) 21.546 8.004 ( -13.130 -2.819 -3.604) 13.904 8.204 ( -5.963 5.086 -0.422) 7.849 8.291 ( -4.250 1.565 -1.954) 4.933 8.326 ( -7.307 0.169 4.166) 8.413 8.465 ( -7.094 -4.708 -2.471) 8.865 8.585 ( -3.873 3.269 1.772) 5.369 8.680 ( -7.680 4.654 -3.982) 9.824 8.760 ( -6.879 -7.263 7.192) 12.321 8.791 ( -13.686 -4.732 -3.455) 14.887 8.853 ( -16.156 5.144 -0.301) 16.957 8.940 ( -22.696 -2.506 1.699) 22.897 9.113 ( -12.206 1.776 2.009) 12.497 9.187 ( -8.187 -5.059 -2.811) 10.026 9.217 ( -5.388 5.538 1.267) 7.830 9.338 ( -10.121 -5.580 0.849) 11.588 9.572 ( -10.048 0.446 1.864) 10.230 9.599 ( -7.242 -1.312 2.949) 7.929 9.727 ( -11.383 1.488 7.676) 13.810 9.840 ( -9.605 -6.654 6.249) 13.251 10.281 ( -6.703 0.547 6.833) 9.587 10.330 ( -9.679 -3.505 4.637) 11.290 10.668 ( -9.594 3.403 -10.227) 14.430 10.731 ( -8.936 -3.307 -9.715) 13.608 11.116 ( 10.415 13.401 0.292) 16.975 11.289 ( 6.927 -3.604 -2.004) 8.061 11.582 ( -3.033 9.807 -13.919) 17.295 11.752 ( -1.770 -3.906 -4.793) 6.431 11.859 ( 3.595 0.786 6.348) 7.337 11.931 ( 4.830 -2.285 12.708) 13.786 12.272 ( -1.607 2.541 0.578) 3.061 12.325 ( 0.250 2.424 0.522) 2.492 12.373 ( 6.170 -2.256 -1.011) 6.647 12.476 ( 8.119 -6.440 0.731) 10.389 13.196 ( -8.144 6.487 0.662) 10.433 13.299 ( -8.905 -3.340 1.071) 9.571 13.579 ( -7.839 1.136 0.778) 7.959 13.672 ( -4.856 -6.775 -1.506) 8.470 14.177 ( 1.405 3.226 -0.603) 3.570 14.255 ( 1.525 -2.042 2.432) 3.523 14.399 ( 0.465 0.543 -1.456) 1.622 14.460 ( 1.190 -6.923 -0.636) 7.053 14.629 ( 1.878 2.039 0.663) 2.850 14.665 ( 4.874 -0.561 -1.004) 5.008 14.915 ( 5.114 1.096 3.249) 6.157 14.966 ( 2.365 -4.150 4.185) 6.351 15.147 ( 4.939 3.819 -1.695) 6.470 15.186 ( 5.091 2.401 1.667) 5.870 15.310 ( 7.443 -0.006 -7.909) 10.861 15.407 ( 8.152 -6.634 -1.375) 10.600 18.135 ( 0.973 16.467 -0.637) 16.508 18.343 ( 4.033 11.820 0.451) 12.497 18.411 ( -0.167 -10.787 -0.941) 10.830 18.529 ( 2.255 -7.093 1.632) 7.619 18.862 ( 0.142 5.096 -2.271) 5.581 18.912 ( 1.811 7.280 2.951) 8.062 18.986 ( 2.366 -6.000 -3.350) 7.268 19.118 ( 3.110 -10.731 2.725) 11.500 19.872 ( -9.526 4.550 -2.326) 10.810 19.933 ( -8.495 0.073 -1.255) 8.588 20.024 ( -7.740 -1.455 1.327) 7.986 20.061 ( -7.103 -3.475 2.203) 8.208 21.058 ( -16.407 1.093 -3.752) 16.866 21.069 ( -16.194 0.628 1.677) 16.293 21.100 ( -15.733 0.315 -0.478) 15.743 21.136 ( -15.311 -2.625 4.474) 16.166 21.916 ( -18.744 8.588 -4.357) 21.073 21.965 ( -20.528 5.580 3.857) 21.620 22.133 ( -19.117 -6.134 3.127) 20.319 22.223 ( -13.875 -13.029 -7.641) 20.510 24.400 ( 0.439 0.304 1.899) 1.973 24.406 ( 1.619 -0.208 2.476) 2.966 24.504 ( 0.715 1.786 -2.165) 2.896 24.535 ( 0.188 -1.439 -2.311) 2.729 28.773 ( -2.029 5.055 0.601) 5.480 28.861 ( -0.378 1.416 1.804) 2.324 28.895 ( -0.931 0.728 -0.562) 1.309 29.024 ( 1.307 -7.154 0.121) 7.274 29.400 ( 2.602 3.056 2.395) 4.673 29.446 ( 2.179 -1.380 1.391) 2.930 29.496 ( 2.910 0.458 -2.093) 3.614 29.512 ( 2.813 -0.833 -1.917) 3.505 33.401 ( -7.491 3.086 -0.122) 8.102 33.414 ( -7.631 4.273 0.014) 8.746 33.474 ( -7.964 -4.397 -0.017) 9.097 33.507 ( -7.638 -5.057 -0.183) 9.162 36.038 ( 5.641 11.648 2.446) 13.171 36.256 ( 8.093 -4.462 -0.416) 9.251 36.298 ( 11.959 13.328 2.292) 18.053 36.678 ( 16.373 -18.844 -2.662) 25.105 38.173 ( 5.366 19.728 -0.191) 20.446 38.318 ( 5.418 17.678 -0.199) 18.491 38.574 ( 6.523 -19.986 1.804) 21.101 38.651 ( 5.110 -14.984 -2.507) 16.028 38.994 ( 4.998 8.325 1.038) 9.766 39.203 ( 8.213 -11.846 2.205) 14.582 39.656 ( 8.997 4.535 -2.643) 10.417 39.710 ( 8.113 -0.938 0.374) 8.175 40.564 ( 15.582 12.146 1.592) 19.821 40.763 ( 17.682 -5.218 -5.287) 19.179 41.495 ( 22.140 3.614 5.024) 22.989 41.606 ( 25.726 -6.059 -1.244) 26.460 43.505 ( 7.979 13.283 2.081) 15.634 43.751 ( 9.124 -11.101 -1.981) 14.505 44.184 ( 19.879 5.915 1.350) 20.784 44.311 ( 17.922 -6.460 -0.653) 19.062 69.856 ( 15.626 12.912 -0.119) 20.270 70.090 ( 19.194 -7.506 -6.063) 21.483 70.288 ( 26.117 6.985 5.105) 27.512 70.487 ( 29.592 -9.882 1.905) 31.257 105.082 ( 3.211 1.208 -0.808) 3.524 105.106 ( 3.473 -1.183 -0.974) 3.796 105.198 ( 5.388 0.607 0.687) 5.466 105.209 ( 6.071 -0.502 1.100) 6.190 ======================= Grid point 130 (73/102) ======================= q-point: (-0.19 0.40 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 Number of triplets: 160 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.923 ( -23.138 32.404 13.293) 41.977 3.237 ( -27.622 21.183 12.245) 36.900 3.589 ( -17.559 -33.257 4.939) 37.931 3.629 ( -25.908 -19.050 5.084) 32.557 4.238 ( -20.981 4.680 -15.644) 26.586 4.328 ( -20.040 -0.139 -8.821) 21.896 4.445 ( -19.384 7.039 -13.141) 24.454 4.509 ( -20.703 12.116 4.786) 24.461 4.668 ( -16.530 -8.527 -2.836) 18.815 4.699 ( -20.762 -7.151 3.207) 22.192 5.082 ( -32.317 5.760 6.453) 33.454 5.179 ( -32.874 -5.212 3.030) 33.423 5.524 ( -24.981 8.880 7.911) 27.668 5.620 ( -16.226 2.192 8.335) 18.373 5.699 ( -11.335 3.183 -5.065) 12.817 5.854 ( -7.373 -5.834 3.305) 9.967 6.220 ( -9.577 8.525 -11.023) 16.908 6.290 ( -14.798 6.891 -2.998) 16.597 6.339 ( -11.671 -5.768 -9.180) 15.929 6.486 ( -10.054 0.178 -9.007) 13.500 6.568 ( -12.356 3.622 -0.668) 12.894 6.635 ( -5.198 -1.075 -0.251) 5.314 6.756 ( -24.768 -8.356 -0.421) 26.143 6.819 ( -22.708 -5.882 1.479) 23.504 6.895 ( -28.807 0.196 0.954) 28.823 7.024 ( -28.809 -11.936 0.706) 31.191 7.162 ( -6.818 3.074 2.887) 8.017 7.188 ( -11.454 1.891 -8.482) 14.378 7.505 ( -3.253 6.899 3.730) 8.491 7.609 ( -8.571 -0.834 -2.704) 9.026 7.672 ( -8.351 4.115 -3.858) 10.077 7.790 ( -10.534 -6.288 -2.033) 12.435 8.036 ( -12.693 3.073 5.844) 14.308 8.107 ( -14.023 -2.699 3.111) 14.616 8.200 ( -8.836 -1.167 2.300) 9.205 8.232 ( -18.168 -4.679 -0.506) 18.768 8.367 ( -13.726 7.965 2.765) 16.109 8.436 ( -12.269 1.921 -5.270) 13.490 8.524 ( -13.196 5.174 1.878) 14.297 8.560 ( -11.410 7.231 -0.609) 13.522 8.585 ( -12.428 -0.974 -5.695) 13.705 8.739 ( -7.829 -0.349 5.621) 9.644 8.815 ( -5.480 -8.477 0.634) 10.114 8.854 ( -8.207 -8.296 -5.275) 12.806 9.217 ( -1.688 11.988 2.363) 12.335 9.379 ( 3.736 6.727 3.672) 8.526 9.435 ( -4.722 1.798 -2.978) 5.865 9.543 ( -1.090 -10.227 5.090) 11.476 9.614 ( -0.759 -3.677 7.057) 7.994 9.752 ( -1.116 -7.360 3.359) 8.166 10.132 ( -9.166 -2.763 6.110) 11.357 10.189 ( -5.239 -8.897 6.996) 12.472 10.414 ( -12.418 2.104 -8.265) 15.065 10.478 ( -13.712 -5.010 -7.329) 16.335 11.348 ( 11.393 13.503 0.906) 17.691 11.452 ( 7.014 5.433 5.187) 10.277 11.514 ( 0.687 5.741 -21.758) 22.513 11.702 ( 0.477 -7.581 -13.413) 15.414 11.989 ( 6.279 6.459 13.771) 16.456 12.075 ( 5.572 0.151 16.202) 17.134 12.265 ( 0.112 3.184 0.070) 3.187 12.356 ( 2.201 -3.590 0.017) 4.210 12.523 ( 7.002 3.291 -0.328) 7.744 12.667 ( 9.536 -8.359 0.596) 12.695 13.003 ( -10.884 2.656 0.346) 11.209 13.085 ( -12.061 -5.118 1.171) 13.155 13.411 ( -7.684 5.964 2.503) 10.043 13.567 ( -4.289 -8.715 0.732) 9.740 14.209 ( 1.935 2.331 -1.330) 3.309 14.288 ( 1.461 -3.367 1.456) 3.949 14.413 ( 1.446 3.437 -4.183) 5.603 14.492 ( 2.172 -4.850 -1.947) 5.660 14.678 ( 2.692 4.032 1.649) 5.121 14.768 ( 5.474 -3.043 -1.103) 6.360 15.021 ( 4.338 2.367 4.659) 6.792 15.050 ( 5.136 -2.318 2.769) 6.278 15.258 ( 6.311 4.058 2.014) 7.769 15.312 ( 7.303 0.289 -0.471) 7.324 15.483 ( 11.823 2.371 -8.408) 14.700 15.603 ( 12.224 -7.030 -2.540) 14.329 18.151 ( 0.449 15.426 -0.379) 15.438 18.388 ( -1.304 -5.966 0.662) 6.142 18.430 ( 3.179 7.231 -0.690) 7.929 18.569 ( 1.073 -4.821 1.204) 5.084 18.841 ( -1.527 6.287 -1.017) 6.549 18.937 ( -0.252 3.879 2.344) 4.539 19.016 ( 1.550 -5.678 -3.837) 7.026 19.181 ( 2.296 -12.707 2.858) 13.225 19.672 ( -9.164 5.685 -2.596) 11.092 19.755 ( -8.471 -0.464 -1.617) 8.637 19.863 ( -8.212 -1.499 1.350) 8.456 19.918 ( -7.350 -4.653 2.208) 8.975 20.729 ( -15.125 1.494 -3.406) 15.576 20.751 ( -15.189 -0.241 0.163) 15.192 20.794 ( -14.612 1.222 1.117) 14.705 20.839 ( -14.922 -2.837 4.253) 15.773 21.484 ( -23.039 6.550 -3.765) 24.247 21.522 ( -24.197 3.985 3.677) 24.797 21.722 ( -22.485 -3.313 3.678) 23.023 21.865 ( -20.122 -16.120 -12.275) 28.555 24.423 ( 1.499 1.498 1.535) 2.617 24.454 ( 2.595 -1.406 1.504) 3.312 24.526 ( 1.760 1.425 -1.098) 2.517 24.545 ( 1.132 -0.592 -1.100) 1.686 28.740 ( -1.418 6.333 0.849) 6.545 28.864 ( 0.086 -1.783 2.780) 3.304 28.876 ( -0.670 4.592 -1.069) 4.762 29.051 ( 1.328 -8.830 -0.136) 8.931 29.459 ( 2.754 2.725 2.112) 4.413 29.492 ( 2.217 -0.387 0.402) 2.286 29.551 ( 2.949 0.263 -1.215) 3.200 29.565 ( 2.825 -0.769 -1.701) 3.386 33.249 ( -7.423 2.385 -0.443) 7.810 33.258 ( -7.707 3.798 -0.178) 8.594 33.313 ( -7.861 -3.793 0.085) 8.729 33.350 ( -7.866 -4.915 -0.010) 9.275 36.165 ( 6.233 14.850 3.313) 16.442 36.420 ( 8.127 -5.031 -0.685) 9.583 36.584 ( 15.912 15.415 3.019) 22.359 37.024 ( 18.303 -23.257 -2.950) 29.742 38.293 ( 6.557 21.002 -0.506) 22.007 38.423 ( 4.997 17.155 -0.078) 17.869 38.723 ( 7.761 -21.299 0.716) 22.680 38.753 ( 5.469 -14.242 -0.490) 15.264 39.113 ( 6.650 12.385 0.980) 14.091 39.378 ( 8.410 -13.618 2.622) 16.219 39.816 ( 7.272 3.377 -1.380) 8.135 39.855 ( 6.306 -0.201 -0.040) 6.310 40.934 ( 21.175 15.704 -1.096) 26.386 41.148 ( 21.974 -3.314 -8.696) 23.863 41.962 ( 23.008 7.216 7.233) 25.175 42.148 ( 28.260 -9.328 -0.647) 29.767 43.679 ( 8.701 13.740 4.899) 16.985 43.938 ( 9.750 -12.215 -0.250) 15.631 44.613 ( 22.394 3.496 0.146) 22.666 44.686 ( 19.240 -3.660 -0.936) 19.607 70.174 ( 15.631 16.918 0.322) 23.035 70.464 ( 19.153 -8.769 -8.306) 22.643 70.899 ( 33.720 10.288 6.361) 35.824 71.162 ( 37.065 -12.682 3.147) 39.301 105.144 ( 3.067 1.420 -0.247) 3.389 105.172 ( 3.211 -1.337 -0.400) 3.501 105.312 ( 5.770 1.590 0.196) 5.989 105.341 ( 6.765 -1.384 0.629) 6.934 ======================= Grid point 131 (74/102) ======================= q-point: (-0.12 0.40 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 Number of triplets: 160 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.525 ( -21.952 35.259 11.173) 43.011 2.661 ( -29.860 24.279 13.668) 40.840 3.049 ( -31.684 -21.281 5.391) 38.547 3.291 ( -15.555 -26.607 3.981) 31.077 3.665 ( -31.354 3.522 -12.486) 33.932 3.842 ( -27.328 -10.551 -16.012) 33.385 3.999 ( -20.832 16.285 0.163) 26.442 4.154 ( -18.513 17.613 20.890) 33.005 4.244 ( -19.177 -7.124 0.407) 20.461 4.353 ( -16.965 -1.976 -1.187) 17.121 4.509 ( -24.636 9.087 -0.063) 26.259 4.645 ( -15.635 0.733 -9.586) 18.354 5.055 ( -19.462 1.292 -2.072) 19.614 5.241 ( -20.448 -12.320 -0.353) 23.876 5.510 ( -8.604 13.190 11.118) 19.278 5.728 ( -8.033 -4.613 10.071) 13.683 5.823 ( -28.376 13.103 -3.518) 31.453 5.962 ( -23.212 -0.283 -2.456) 23.343 6.097 ( -21.527 -7.976 1.851) 23.031 6.186 ( -12.804 0.007 -10.764) 16.727 6.210 ( -14.217 -9.852 -10.104) 20.032 6.292 ( -20.933 -14.355 8.617) 26.805 6.439 ( -7.256 0.566 2.467) 7.684 6.467 ( -7.914 -3.035 -4.597) 9.642 6.574 ( -2.186 5.956 -6.785) 9.289 6.691 ( -2.897 -4.536 -4.014) 6.714 7.019 ( -6.719 3.387 -9.631) 12.222 7.082 ( -4.405 -3.673 -2.947) 6.448 7.298 ( -18.968 4.367 0.298) 19.466 7.414 ( -15.589 -3.849 -4.762) 16.749 7.490 ( -2.448 10.357 1.368) 10.730 7.587 ( -9.342 0.193 -4.577) 10.404 7.756 ( -14.554 -3.761 1.878) 15.149 7.864 ( -15.668 -1.231 4.243) 16.279 7.889 ( -7.476 -7.131 0.959) 10.376 7.917 ( -15.095 -2.004 3.125) 15.545 8.140 ( -11.351 7.723 -7.116) 15.464 8.196 ( -11.384 1.886 2.232) 11.753 8.223 ( -11.847 -1.991 -1.158) 12.068 8.312 ( -12.231 -8.347 0.209) 14.809 8.472 ( -1.145 20.537 7.220) 21.799 8.644 ( 1.612 5.298 -5.161) 7.570 8.793 ( 0.828 -9.200 -2.867) 9.672 8.844 ( 1.123 -10.186 1.424) 10.346 9.210 ( -0.619 9.778 0.454) 9.808 9.313 ( -6.585 -0.674 -5.943) 8.896 9.374 ( -6.847 14.048 12.094) 19.761 9.570 ( 1.685 -10.405 2.699) 10.881 9.621 ( -0.274 -0.781 2.393) 2.533 9.709 ( -5.224 1.808 3.229) 6.402 10.029 ( -2.825 -9.281 13.550) 16.665 10.135 ( -1.749 -21.426 4.713) 22.008 10.196 ( -8.285 -0.605 -6.510) 10.554 10.223 ( -5.579 -3.210 -6.859) 9.406 11.474 ( 1.350 7.384 -21.068) 22.365 11.496 ( 3.205 6.132 -15.703) 17.159 11.620 ( 7.768 7.991 10.494) 15.308 11.762 ( 6.236 -3.541 -0.478) 7.187 12.135 ( 4.641 6.598 11.917) 14.390 12.196 ( 2.532 2.162 12.675) 13.105 12.245 ( -1.787 5.847 -0.237) 6.119 12.363 ( -2.161 -4.445 -0.010) 4.943 12.610 ( -0.548 5.156 0.395) 5.200 12.757 ( -9.700 -5.318 1.619) 11.180 12.845 ( 2.819 -2.170 -0.527) 3.596 12.887 ( -2.500 -6.975 1.624) 7.585 13.340 ( 0.008 7.637 4.747) 8.992 13.546 ( 1.865 -11.796 4.533) 12.774 14.244 ( 1.820 1.693 -2.348) 3.419 14.320 ( 1.510 -4.205 -0.349) 4.481 14.438 ( 2.135 6.320 -5.716) 8.784 14.534 ( 2.472 -3.278 -4.107) 5.807 14.740 ( 2.954 6.139 2.828) 7.376 14.875 ( 5.214 -4.675 -0.411) 7.015 15.117 ( 4.102 3.730 5.094) 7.530 15.150 ( 3.985 -1.101 0.578) 4.175 15.409 ( 7.466 2.916 7.399) 10.908 15.469 ( 8.085 -1.821 1.693) 8.458 15.754 ( 16.989 7.130 -9.769) 20.855 15.897 ( 17.984 -5.865 -5.852) 19.801 18.133 ( -2.602 13.581 -0.122) 13.828 18.326 ( -5.040 -5.811 0.307) 7.698 18.452 ( -2.398 7.643 0.250) 8.014 18.558 ( -2.657 -2.491 -0.030) 3.642 18.824 ( 0.387 3.848 0.052) 3.868 18.910 ( -2.589 0.831 2.692) 3.826 19.023 ( -0.461 -6.244 -4.262) 7.574 19.194 ( -2.300 -15.143 1.619) 15.402 19.534 ( -3.211 6.229 -1.815) 7.239 19.619 ( -3.632 0.072 -1.660) 3.994 19.721 ( -5.684 -0.729 1.242) 5.863 19.793 ( -4.859 -5.099 0.792) 7.088 20.458 ( -10.941 1.620 -2.144) 11.267 20.479 ( -11.725 -0.022 0.343) 11.731 20.535 ( -10.951 0.853 0.408) 10.992 20.572 ( -12.172 -2.481 3.347) 12.865 20.999 ( -23.622 4.163 -5.352) 24.576 21.034 ( -24.490 1.099 3.243) 24.728 21.257 ( -24.213 -2.127 3.289) 24.528 21.362 ( -26.882 -13.576 -12.706) 32.686 24.463 ( 2.007 2.419 1.503) 3.484 24.509 ( 2.569 -1.880 0.490) 3.221 24.566 ( 2.075 0.832 0.207) 2.245 24.574 ( 1.900 -0.089 -0.073) 1.903 28.721 ( -0.683 7.186 1.375) 7.348 28.858 ( -0.701 -1.868 0.041) 1.996 28.882 ( 0.877 4.919 1.830) 5.321 29.073 ( 0.908 -9.933 -0.625) 9.994 29.514 ( 2.220 2.236 1.332) 3.420 29.535 ( 2.044 0.249 -0.900) 2.247 29.607 ( 2.697 0.314 -0.327) 2.735 29.616 ( 2.510 -0.472 -0.971) 2.732 33.110 ( -6.072 1.643 -0.625) 6.321 33.114 ( -6.391 2.408 -0.539) 6.850 33.167 ( -6.559 -2.281 0.250) 6.949 33.199 ( -6.936 -3.903 0.099) 7.959 36.293 ( 5.455 17.580 4.393) 18.923 36.567 ( 6.487 -4.685 -1.403) 8.124 36.934 ( 17.775 13.343 3.479) 22.497 37.371 ( 16.046 -26.213 -2.853) 30.867 38.427 ( 6.680 20.892 -0.912) 21.953 38.507 ( 3.238 16.010 -0.659) 16.348 38.857 ( 5.655 -13.030 -2.514) 14.425 38.879 ( 6.024 -19.329 3.988) 20.635 39.272 ( 9.199 13.386 1.579) 16.319 39.539 ( 6.767 -12.883 3.121) 14.883 39.934 ( 4.609 2.022 -0.474) 5.055 39.959 ( 4.047 0.461 0.110) 4.074 41.383 ( 23.133 15.790 -7.717) 29.052 41.590 ( 23.695 -1.462 -12.544) 26.850 42.443 ( 23.375 13.811 6.762) 27.980 42.710 ( 27.061 -10.759 -2.727) 29.248 43.887 ( 10.954 12.984 12.617) 21.160 44.141 ( 10.200 -12.649 4.333) 16.817 45.054 ( 18.394 0.329 -1.000) 18.424 45.059 ( 20.120 -0.138 -1.092) 20.150 70.466 ( 12.975 20.390 1.322) 24.204 70.802 ( 16.109 -10.307 -10.124) 21.639 71.652 ( 39.227 14.163 4.915) 41.994 71.961 ( 40.627 -14.496 4.059) 43.327 105.202 ( 2.599 1.535 0.781) 3.118 105.231 ( 2.671 -1.413 0.866) 3.144 105.426 ( 5.514 2.723 -0.753) 6.196 105.475 ( 6.239 -2.318 -0.115) 6.656 ======================= Grid point 132 (75/102) ======================= q-point: (-0.06 0.40 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 Number of triplets: 160 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.906 ( -32.405 26.627 8.494) 42.793 2.323 ( -15.464 17.658 12.242) 26.473 2.496 ( -18.613 -1.432 12.874) 22.677 2.793 ( -29.236 11.092 -14.426) 34.437 3.165 ( -22.084 -12.848 -10.303) 27.549 3.315 ( -12.677 -34.603 3.300) 37.000 3.688 ( -10.382 21.875 6.621) 25.103 3.882 ( -11.486 8.552 23.703) 27.693 3.976 ( -11.293 -3.800 14.021) 18.400 4.076 ( -7.084 23.020 -18.330) 30.267 4.105 ( -14.687 4.023 -1.140) 15.271 4.446 ( -3.787 6.167 -15.540) 17.142 4.769 ( -8.015 -4.348 -7.972) 12.112 4.908 ( -11.468 -11.979 -0.357) 16.588 5.263 ( -22.553 10.183 2.031) 24.829 5.316 ( -13.400 5.391 -3.583) 14.881 5.450 ( -20.481 -3.902 0.404) 20.853 5.586 ( -7.692 6.791 17.047) 19.896 5.677 ( -15.792 -13.844 2.018) 21.098 5.907 ( -8.358 -21.282 19.598) 30.114 6.091 ( -2.513 -1.835 -14.068) 14.408 6.103 ( -4.534 -7.553 -6.364) 10.868 6.389 ( 1.857 1.552 -3.930) 4.616 6.418 ( 1.239 -1.387 -5.604) 5.905 6.564 ( 1.580 7.064 -7.393) 10.347 6.665 ( -0.353 -1.180 -2.848) 3.103 6.810 ( -11.543 1.591 -3.160) 12.073 6.862 ( -15.407 -3.285 -0.947) 15.782 7.036 ( -4.814 4.707 -5.167) 8.487 7.178 ( -4.959 -5.690 -6.253) 9.801 7.377 ( -6.651 6.714 -10.553) 14.166 7.455 ( -4.257 8.172 5.687) 10.828 7.522 ( -8.140 -6.724 -4.708) 11.561 7.619 ( -9.601 -1.669 3.820) 10.467 7.661 ( -10.249 1.466 1.072) 10.409 7.769 ( -5.579 -12.421 -3.808) 14.139 7.917 ( -5.870 8.947 0.019) 10.701 8.040 ( -6.551 3.348 -1.658) 7.541 8.091 ( -1.980 -2.286 0.487) 3.063 8.164 ( -2.742 -14.301 2.642) 14.799 8.482 ( -0.122 23.258 6.712) 24.207 8.691 ( 2.774 3.745 -3.413) 5.776 8.795 ( -3.282 -5.978 -6.413) 9.361 8.833 ( -0.810 -9.166 3.826) 9.965 9.061 ( -11.089 1.455 -1.419) 11.274 9.168 ( -5.578 -8.127 -1.668) 9.998 9.318 ( -0.827 17.067 12.340) 21.077 9.566 ( -2.062 -9.266 -3.794) 10.223 9.596 ( -2.863 8.999 4.131) 10.307 9.650 ( -0.190 3.611 6.162) 7.145 10.005 ( -3.874 -4.983 11.276) 12.922 10.043 ( -1.083 -5.256 -2.900) 6.100 10.181 ( 1.742 -12.427 -2.260) 12.750 10.224 ( 3.576 -15.224 3.244) 15.972 11.445 ( 0.672 5.665 -28.342) 28.911 11.490 ( 0.845 -0.635 -18.254) 18.284 11.784 ( 5.428 10.291 14.280) 18.420 11.882 ( 3.843 -0.065 9.821) 10.546 12.163 ( -3.029 2.183 1.467) 4.012 12.188 ( -1.141 0.742 4.860) 5.047 12.251 ( -1.551 6.825 2.048) 7.292 12.297 ( -3.991 0.749 0.209) 4.066 12.497 ( -5.963 5.663 4.491) 9.370 12.598 ( -4.472 -0.402 8.339) 9.471 12.917 ( 5.012 -0.009 -0.288) 5.020 12.989 ( 6.300 -8.124 -1.582) 10.402 13.385 ( 1.788 5.506 6.761) 8.901 13.628 ( 3.522 -17.763 6.635) 19.286 14.271 ( 1.394 1.725 -3.438) 4.091 14.340 ( 0.735 -4.103 -3.679) 5.559 14.474 ( 2.430 6.983 -5.228) 9.055 14.566 ( 1.634 -1.959 -6.562) 7.041 14.808 ( 3.169 8.296 4.252) 9.846 14.969 ( 3.895 -3.966 0.397) 5.573 15.195 ( 2.632 1.826 3.005) 4.393 15.206 ( 1.370 -1.853 0.803) 2.440 15.563 ( 5.107 3.422 10.697) 12.337 15.640 ( 7.155 -3.776 10.980) 13.639 16.083 ( 16.144 13.365 -11.645) 23.976 16.283 ( 21.089 -6.215 -11.755) 24.931 18.054 ( -4.211 11.017 0.443) 11.803 18.207 ( -5.638 -4.556 0.053) 7.249 18.315 ( -10.091 4.382 -0.352) 11.007 18.418 ( -12.978 -5.551 -0.736) 14.134 18.804 ( -2.580 2.904 0.825) 3.971 18.908 ( 2.220 6.059 1.033) 6.535 18.989 ( -1.150 -12.533 -2.553) 12.842 19.120 ( -3.100 -12.675 -0.543) 13.060 19.522 ( -0.013 5.579 1.145) 5.696 19.613 ( 1.722 -0.907 -0.756) 2.088 19.661 ( 0.350 2.666 -0.369) 2.714 19.761 ( 2.435 -4.390 -3.963) 6.396 20.288 ( -6.124 1.215 0.164) 6.245 20.301 ( -5.238 0.116 -0.624) 5.276 20.371 ( -5.276 -0.052 -0.583) 5.308 20.383 ( -6.829 -1.268 1.635) 7.136 20.570 ( -16.163 1.487 -3.864) 16.684 20.593 ( -18.020 -0.865 -1.217) 18.082 20.800 ( -21.056 -1.799 -0.234) 21.134 20.812 ( -22.881 -2.992 -0.781) 23.089 24.503 ( 1.499 3.007 1.617) 3.729 24.553 ( 1.646 -1.292 -0.030) 2.093 24.600 ( 1.112 0.805 0.983) 1.689 24.615 ( 1.645 -1.280 0.651) 2.184 28.718 ( -0.075 7.706 2.092) 7.986 28.845 ( -0.552 1.361 -0.600) 1.586 28.908 ( 1.159 1.063 2.261) 2.754 29.082 ( 0.115 -10.324 -1.252) 10.401 29.547 ( 0.792 2.116 0.064) 2.260 29.567 ( 1.357 0.110 -1.900) 2.338 29.654 ( 1.762 0.312 0.730) 1.932 29.658 ( 1.838 -0.002 -0.519) 1.909 33.009 ( -3.548 1.583 -0.570) 3.926 33.013 ( -3.392 0.623 -0.833) 3.548 33.059 ( -4.153 -0.603 0.494) 4.225 33.084 ( -4.260 -2.440 -0.016) 4.909 36.392 ( 3.178 19.256 5.397) 20.249 36.663 ( 3.238 -3.541 -2.253) 5.301 37.273 ( 14.206 6.061 3.513) 15.840 37.618 ( 8.476 -25.384 -2.778) 26.905 38.519 ( 1.026 16.374 2.139) 16.545 38.570 ( 4.790 16.618 -5.523) 18.155 38.925 ( 0.295 -12.331 5.394) 13.463 38.994 ( 5.516 -12.601 -3.284) 14.142 39.477 ( 9.678 7.815 3.558) 12.938 39.649 ( 3.202 -8.664 3.626) 9.924 39.994 ( 1.373 1.753 0.301) 2.247 40.018 ( 1.778 0.384 -0.135) 1.824 41.757 ( 15.226 13.958 -13.025) 24.419 41.974 ( 15.070 -3.633 -16.092) 22.344 42.879 ( 17.252 17.860 -6.717) 25.725 43.151 ( 16.399 -9.094 -10.382) 21.433 44.210 ( 17.199 5.126 25.203) 30.940 44.365 ( 9.967 -10.260 12.296) 18.863 45.346 ( 11.259 3.877 -0.779) 11.933 45.417 ( 13.575 -3.340 -1.406) 14.050 70.682 ( 7.749 22.652 2.913) 24.118 71.049 ( 10.355 -11.911 -11.055) 19.269 72.400 ( 31.510 14.154 -1.185) 34.563 72.704 ( 28.705 -16.052 0.456) 32.892 105.252 ( 2.036 1.637 2.206) 3.419 105.284 ( 2.213 -1.632 2.725) 3.871 105.522 ( 4.083 2.908 -1.950) 5.378 105.576 ( 3.614 -2.767 -1.159) 4.696 ======================= Grid point 165 (76/102) ======================= q-point: ( 0.00 0.00 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 Number of triplets: 54 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.319 ( -5.737 0.000 -31.777) 32.291 1.319 ( 5.737 0.000 31.777) 32.291 2.295 ( 2.958 0.000 -51.616) 51.701 2.295 ( -2.958 0.000 51.616) 51.701 2.990 ( 0.436 0.000 -4.289) 4.311 2.990 ( -0.436 0.000 4.289) 4.311 3.731 ( 2.522 0.000 -33.562) 33.657 3.731 ( -2.522 0.000 33.562) 33.657 3.999 ( 4.136 0.000 -7.237) 8.335 3.999 ( -4.136 0.000 7.237) 8.335 4.213 ( 3.243 0.000 -21.970) 22.208 4.213 ( -3.243 0.000 21.970) 22.208 4.596 ( 0.090 0.000 -21.682) 21.682 4.596 ( -0.090 0.000 21.682) 21.682 4.838 ( 0.007 0.000 -15.965) 15.965 4.838 ( -0.007 0.000 15.965) 15.965 5.351 ( -0.607 0.000 -3.985) 4.031 5.351 ( 0.607 0.000 3.985) 4.031 5.631 ( -5.902 0.000 -7.494) 9.539 5.631 ( 5.902 0.000 7.494) 9.539 6.213 ( 0.094 0.000 -3.531) 3.532 6.213 ( -0.094 0.000 3.531) 3.532 6.353 ( 1.961 0.000 -4.256) 4.686 6.353 ( -1.961 0.000 4.256) 4.686 6.537 ( 2.346 0.000 -8.261) 8.588 6.537 ( -2.346 0.000 8.261) 8.588 6.695 ( -0.070 0.000 -1.186) 1.188 6.695 ( 0.070 0.000 1.186) 1.188 7.220 ( 1.144 0.000 -5.440) 5.559 7.220 ( -1.144 0.000 5.440) 5.559 7.312 ( 0.426 0.000 -9.900) 9.909 7.312 ( -0.426 0.000 9.900) 9.909 7.496 ( 0.306 0.000 -0.319) 0.442 7.496 ( -0.306 0.000 0.319) 0.442 7.653 ( 0.409 0.000 -2.885) 2.914 7.653 ( -0.409 0.000 2.885) 2.914 7.871 ( 2.801 0.000 -15.657) 15.906 7.871 ( -2.801 0.000 15.657) 15.906 8.275 ( 0.124 0.000 -1.945) 1.949 8.275 ( -0.124 0.000 1.945) 1.949 8.686 ( -2.683 0.000 -0.719) 2.778 8.686 ( 2.683 0.000 0.719) 2.778 8.711 ( 2.292 0.000 -4.946) 5.452 8.711 ( -2.292 0.000 4.946) 5.452 8.908 ( 2.987 0.000 -10.392) 10.812 8.908 ( -2.987 0.000 10.392) 10.812 9.507 ( 2.330 0.000 -6.919) 7.301 9.507 ( -2.330 0.000 6.919) 7.301 9.582 ( 0.532 0.000 -7.172) 7.192 9.582 ( -0.532 0.000 7.172) 7.192 10.368 ( -6.323 0.000 -0.328) 6.332 10.368 ( 6.323 0.000 0.328) 6.332 10.771 ( 3.695 0.000 -6.602) 7.566 10.771 ( -3.695 0.000 6.602) 7.566 10.951 ( -1.310 0.000 -18.667) 18.713 10.951 ( 1.310 0.000 18.667) 18.713 11.834 ( -8.586 0.000 -2.028) 8.822 11.834 ( 8.586 0.000 2.028) 8.822 12.137 ( 4.034 0.000 -1.656) 4.360 12.137 ( -4.034 0.000 1.656) 4.360 12.285 ( -6.628 0.000 0.663) 6.661 12.285 ( 6.628 0.000 -0.663) 6.661 12.462 ( -3.906 0.000 -6.734) 7.785 12.462 ( 3.906 0.000 6.734) 7.785 13.103 ( -2.673 0.000 -19.821) 20.001 13.103 ( 2.673 0.000 19.821) 20.001 13.382 ( 0.884 0.000 -2.800) 2.936 13.382 ( -0.884 0.000 2.800) 2.936 14.361 ( -1.518 0.000 -0.568) 1.621 14.361 ( 1.518 0.000 0.568) 1.621 14.427 ( 1.801 0.000 -3.432) 3.876 14.427 ( -1.801 0.000 3.432) 3.876 14.874 ( 1.944 0.000 -2.047) 2.823 14.874 ( -1.944 0.000 2.047) 2.823 15.477 ( 2.564 0.000 -5.673) 6.226 15.477 ( -2.564 0.000 5.673) 6.226 15.675 ( 4.432 0.000 -5.431) 7.010 15.675 ( -4.432 0.000 5.431) 7.010 16.303 ( -7.176 0.000 -5.103) 8.806 16.303 ( 7.176 0.000 5.103) 8.806 17.921 ( -9.241 0.000 -7.643) 11.993 17.921 ( 9.241 0.000 7.643) 11.993 18.251 ( -5.726 0.000 -0.878) 5.793 18.251 ( 5.726 0.000 0.878) 5.793 18.754 ( 1.368 0.000 -0.857) 1.614 18.754 ( -1.368 0.000 0.857) 1.614 19.291 ( -2.653 0.000 -2.411) 3.584 19.291 ( 2.653 0.000 2.411) 3.584 19.464 ( -5.322 0.000 -1.111) 5.437 19.464 ( 5.322 0.000 1.111) 5.437 19.926 ( 4.998 0.000 -6.687) 8.349 19.926 ( -4.998 0.000 6.687) 8.349 20.174 ( 2.161 0.000 -2.878) 3.599 20.174 ( -2.161 0.000 2.878) 3.599 20.323 ( 2.333 0.000 -2.030) 3.093 20.323 ( -2.333 0.000 2.030) 3.093 20.418 ( -5.807 0.000 0.931) 5.881 20.418 ( 5.807 0.000 -0.931) 5.881 20.564 ( -15.765 0.000 -0.633) 15.777 20.564 ( 15.765 0.000 0.633) 15.777 24.488 ( -0.063 0.000 -1.927) 1.928 24.488 ( 0.063 0.000 1.927) 1.928 24.627 ( -0.679 0.000 -1.694) 1.825 24.627 ( 0.679 0.000 1.694) 1.825 28.511 ( -0.666 0.000 -0.206) 0.697 28.511 ( 0.666 0.000 0.206) 0.697 29.272 ( -1.011 0.000 -6.035) 6.119 29.272 ( 1.011 0.000 6.035) 6.119 29.531 ( 0.863 0.000 -0.485) 0.990 29.531 ( -0.863 0.000 0.485) 0.990 29.632 ( -0.695 0.000 -0.991) 1.211 29.632 ( 0.695 0.000 0.991) 1.211 32.937 ( 0.303 0.000 -1.063) 1.106 32.937 ( -0.303 0.000 1.063) 1.106 33.059 ( -0.111 0.000 -1.466) 1.470 33.059 ( 0.111 0.000 1.466) 1.470 35.985 ( 0.749 0.000 -5.426) 5.477 35.985 ( -0.749 0.000 5.426) 5.477 38.038 ( 0.878 0.000 -1.257) 1.533 38.038 ( -0.878 0.000 1.257) 1.533 38.571 ( -9.439 0.000 -10.178) 13.882 38.571 ( 9.439 0.000 10.178) 13.882 39.037 ( -22.935 0.000 -0.662) 22.944 39.037 ( 22.935 0.000 0.662) 22.944 39.506 ( -4.278 0.000 -3.813) 5.731 39.506 ( 4.278 0.000 3.813) 5.731 39.995 ( -1.339 0.000 -0.570) 1.455 39.995 ( 1.339 0.000 0.570) 1.455 41.173 ( 5.802 0.000 -23.139) 23.856 41.173 ( -5.802 0.000 23.139) 23.856 43.159 ( 0.819 0.000 -15.819) 15.840 43.159 ( -0.819 0.000 15.819) 15.840 44.948 ( -2.146 0.000 -10.265) 10.487 44.948 ( 2.146 0.000 10.265) 10.487 45.578 ( -4.884 0.000 -4.405) 6.577 45.578 ( 4.884 0.000 4.405) 6.577 70.374 ( -0.382 0.000 -13.483) 13.488 70.374 ( 0.382 0.000 13.483) 13.488 72.961 ( -25.144 0.000 -13.491) 28.535 72.961 ( 25.144 0.000 13.491) 28.535 105.318 ( -1.214 0.000 -3.882) 4.068 105.318 ( 1.214 0.000 3.882) 4.068 105.646 ( -4.716 0.000 -1.038) 4.829 105.646 ( 4.716 0.000 1.038) 4.829 ======================= Grid point 167 (77/102) ======================= q-point: ( 0.06 0.00 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 Number of triplets: 96 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.732 ( 43.532 0.000 -22.116) 48.828 1.970 ( 42.491 0.000 20.077) 46.995 2.368 ( 15.846 0.000 -45.722) 48.391 2.450 ( 7.648 0.000 48.290) 48.892 3.178 ( 17.297 0.000 -4.754) 17.939 3.192 ( 19.142 0.000 -3.197) 19.407 3.826 ( 14.058 0.000 -36.582) 39.190 3.872 ( 11.101 0.000 22.833) 25.389 4.107 ( 12.424 0.000 5.316) 13.513 4.240 ( 19.279 0.000 -6.014) 20.196 4.318 ( 8.814 0.000 25.103) 26.605 4.377 ( 17.980 0.000 -18.328) 25.675 4.708 ( 14.399 0.000 -14.613) 20.515 4.764 ( 10.669 0.000 21.511) 24.012 4.865 ( 7.184 0.000 -21.848) 22.999 4.914 ( 4.012 0.000 13.504) 14.087 5.541 ( 1.569 0.000 1.098) 1.915 5.552 ( 20.296 0.000 -0.433) 20.301 5.585 ( 17.584 0.000 0.115) 17.585 5.819 ( 11.757 0.000 7.715) 14.062 6.221 ( -0.387 0.000 6.539) 6.550 6.235 ( 1.606 0.000 5.078) 5.326 6.330 ( 0.313 0.000 1.252) 1.291 6.374 ( 1.995 0.000 -7.211) 7.481 6.530 ( -0.105 0.000 3.402) 3.404 6.628 ( 7.134 0.000 -9.409) 11.808 6.829 ( 12.912 0.000 0.387) 12.918 6.855 ( 14.539 0.000 0.822) 14.563 7.305 ( 8.232 0.000 7.244) 10.965 7.308 ( 7.541 0.000 -4.541) 8.802 7.352 ( 1.818 0.000 6.297) 6.554 7.367 ( 7.864 0.000 -7.464) 10.842 7.594 ( 6.998 0.000 2.711) 7.505 7.599 ( 7.116 0.000 6.794) 9.839 7.662 ( 3.134 0.000 -0.671) 3.205 7.672 ( 5.461 0.000 -6.475) 8.470 7.921 ( 4.917 0.000 11.763) 12.749 7.962 ( 9.089 0.000 -13.153) 15.988 8.263 ( -0.895 0.000 1.690) 1.913 8.276 ( 1.450 0.000 -1.693) 2.229 8.551 ( -5.993 0.000 -0.844) 6.052 8.685 ( 3.460 0.000 -0.853) 3.564 8.829 ( 3.359 0.000 7.478) 8.198 8.873 ( -1.353 0.000 4.855) 5.040 8.907 ( 8.818 0.000 7.381) 11.500 8.953 ( 4.695 0.000 -13.092) 13.909 9.505 ( -0.077 0.000 4.176) 4.177 9.542 ( 1.980 0.000 -16.878) 16.994 9.621 ( 6.274 0.000 -7.031) 9.423 9.663 ( 8.468 0.000 11.335) 14.149 10.245 ( -5.780 0.000 9.160) 10.831 10.467 ( 2.813 0.000 6.910) 7.461 10.682 ( -6.252 0.000 5.450) 8.294 10.767 ( -3.376 0.000 -18.740) 19.041 10.892 ( -0.099 0.000 -1.774) 1.777 10.993 ( -0.776 0.000 18.947) 18.963 11.621 ( -12.152 0.000 0.388) 12.158 11.879 ( -4.861 0.000 -0.351) 4.873 12.161 ( 5.345 0.000 -0.532) 5.372 12.226 ( 3.934 0.000 -5.679) 6.908 12.227 ( 0.430 0.000 1.105) 1.186 12.346 ( -0.817 0.000 -4.108) 4.188 12.524 ( 9.847 0.000 -4.212) 10.710 12.596 ( 8.498 0.000 4.630) 9.677 12.997 ( 0.171 0.000 -16.276) 16.277 13.090 ( -6.549 0.000 9.060) 11.179 13.343 ( -4.484 0.000 3.972) 5.990 13.401 ( 0.409 0.000 7.229) 7.240 14.321 ( -2.240 0.000 -0.193) 2.249 14.378 ( 0.050 0.000 0.033) 0.059 14.396 ( -1.758 0.000 2.137) 2.767 14.453 ( 1.651 0.000 -4.661) 4.945 14.839 ( -1.974 0.000 2.045) 2.843 14.904 ( 1.117 0.000 -0.613) 1.274 15.376 ( -8.731 0.000 9.629) 12.998 15.453 ( -4.530 0.000 -0.584) 4.567 15.563 ( -7.286 0.000 5.453) 9.101 15.707 ( -0.401 0.000 -3.533) 3.556 15.792 ( -29.627 0.000 -23.730) 37.959 16.093 ( -18.608 0.000 6.328) 19.654 17.884 ( 2.056 0.000 -9.246) 9.472 18.134 ( 5.707 0.000 9.330) 10.937 18.283 ( 6.709 0.000 -1.779) 6.941 18.470 ( 6.055 0.000 9.106) 10.935 18.774 ( 3.941 0.000 6.147) 7.302 18.776 ( 0.854 0.000 -0.820) 1.184 19.274 ( 1.666 0.000 -2.508) 3.011 19.370 ( -4.147 0.000 -2.080) 4.639 19.381 ( 5.465 0.000 2.202) 5.892 19.611 ( 8.538 0.000 1.334) 8.641 19.758 ( -9.143 0.000 1.812) 9.321 19.955 ( 2.046 0.000 -4.264) 4.729 20.223 ( 5.049 0.000 1.079) 5.163 20.305 ( 9.401 0.000 -4.378) 10.371 20.347 ( 4.802 0.000 1.480) 5.025 20.444 ( 11.618 0.000 2.528) 11.889 20.517 ( 6.955 0.000 -1.678) 7.155 20.631 ( 26.852 0.000 9.436) 28.462 20.665 ( 17.039 0.000 -2.151) 17.175 21.142 ( 36.618 0.000 -15.557) 39.786 24.470 ( -1.243 0.000 -1.883) 2.256 24.480 ( -1.262 0.000 2.206) 2.541 24.591 ( -2.299 0.000 -1.362) 2.672 24.620 ( -1.638 0.000 1.185) 2.021 28.510 ( 0.577 0.000 -0.193) 0.608 28.537 ( 1.809 0.000 0.173) 1.817 29.231 ( -1.644 0.000 -6.681) 6.880 29.293 ( -0.185 0.000 5.108) 5.111 29.490 ( -3.173 0.000 2.429) 3.996 29.522 ( -1.491 0.000 -0.214) 1.506 29.614 ( -0.875 0.000 -0.930) 1.277 29.637 ( -0.597 0.000 0.736) 0.948 32.968 ( 3.143 0.000 1.101) 3.330 32.971 ( 3.168 0.000 -1.197) 3.386 33.126 ( 6.385 0.000 -0.214) 6.389 33.136 ( 6.780 0.000 -0.226) 6.784 35.950 ( -3.775 0.000 5.199) 6.425 35.961 ( -1.835 0.000 -5.077) 5.398 37.931 ( -14.167 0.000 2.123) 14.325 37.967 ( -5.936 0.000 -2.610) 6.485 38.269 ( -16.679 0.000 -11.199) 20.090 38.490 ( -16.891 0.000 8.247) 18.797 38.795 ( 1.025 0.000 9.918) 9.970 39.337 ( 4.550 0.000 3.656) 5.837 39.397 ( -5.556 0.000 -1.695) 5.808 39.578 ( 1.481 0.000 6.694) 6.856 39.961 ( -1.975 0.000 -0.288) 1.996 40.002 ( -1.067 0.000 -0.563) 1.206 41.043 ( -11.481 0.000 20.852) 23.803 41.177 ( -0.442 0.000 -22.943) 22.947 43.017 ( -11.386 0.000 -15.255) 19.036 43.042 ( -14.175 0.000 15.005) 20.642 44.714 ( -18.014 0.000 -2.762) 18.224 44.734 ( -25.899 0.000 -8.105) 27.138 45.273 ( -15.428 0.000 -4.884) 16.182 45.405 ( -18.431 0.000 6.835) 19.658 70.288 ( -5.410 0.000 -12.136) 13.288 70.358 ( -4.798 0.000 13.414) 14.246 72.263 ( -37.326 0.000 4.319) 37.575 73.060 ( -19.888 0.000 16.966) 26.142 105.270 ( -2.679 0.000 -3.609) 4.495 105.331 ( -0.739 0.000 3.635) 3.709 105.490 ( -8.336 0.000 -5.399) 9.932 105.648 ( -4.048 0.000 0.371) 4.065 ======================= Grid point 168 (78/102) ======================= q-point: ( 0.12 0.00 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 Number of triplets: 102 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.597 ( 25.468 0.000 -37.753) 45.540 2.603 ( 41.296 0.000 -12.955) 43.281 2.792 ( 17.247 0.000 33.898) 38.033 2.959 ( 38.094 0.000 17.058) 41.739 3.602 ( 27.509 0.000 -17.174) 32.430 3.666 ( 26.955 0.000 0.444) 26.959 4.119 ( 20.905 0.000 -24.537) 32.234 4.293 ( 27.116 0.000 10.383) 29.036 4.458 ( 20.609 0.000 2.580) 20.770 4.553 ( 14.159 0.000 13.819) 19.785 4.733 ( 21.855 0.000 10.612) 24.295 4.848 ( 29.944 0.000 -12.785) 32.559 4.979 ( 10.794 0.000 -13.456) 17.250 5.018 ( 11.676 0.000 -1.456) 11.766 5.092 ( 17.799 0.000 6.471) 18.939 5.147 ( 22.698 0.000 4.394) 23.120 5.594 ( 6.483 0.000 -1.096) 6.575 5.993 ( 14.380 0.000 7.126) 16.049 6.090 ( 24.585 0.000 8.931) 26.157 6.153 ( 15.387 0.000 2.330) 15.563 6.244 ( -1.275 0.000 7.009) 7.124 6.297 ( 16.513 0.000 0.561) 16.522 6.457 ( 13.119 0.000 3.848) 13.671 6.463 ( 11.114 0.000 -7.105) 13.191 6.571 ( 5.440 0.000 -1.701) 5.700 6.749 ( 7.009 0.000 -3.346) 7.766 7.092 ( 9.685 0.000 -5.445) 11.111 7.153 ( 9.205 0.000 3.133) 9.723 7.394 ( 3.898 0.000 -4.375) 5.859 7.500 ( 12.626 0.000 -0.437) 12.633 7.561 ( 14.574 0.000 7.804) 16.532 7.586 ( 13.431 0.000 -1.581) 13.524 7.712 ( 7.588 0.000 2.040) 7.857 7.738 ( 13.066 0.000 -7.367) 15.000 7.889 ( 15.414 0.000 8.618) 17.659 7.919 ( 15.333 0.000 4.728) 16.045 8.101 ( 9.111 0.000 6.992) 11.484 8.180 ( 14.963 0.000 -8.875) 17.397 8.288 ( 5.511 0.000 -0.722) 5.558 8.353 ( 6.909 0.000 -1.844) 7.150 8.459 ( -3.228 0.000 1.951) 3.772 8.721 ( -0.123 0.000 -9.722) 9.722 8.870 ( 0.830 0.000 3.144) 3.252 8.890 ( 2.898 0.000 7.579) 8.115 9.037 ( 5.806 0.000 -12.371) 13.666 9.041 ( 3.517 0.000 7.785) 8.543 9.533 ( 2.731 0.000 4.503) 5.266 9.535 ( 1.468 0.000 -19.099) 19.155 9.800 ( 10.209 0.000 -0.422) 10.217 9.889 ( 9.106 0.000 9.379) 13.072 10.205 ( 0.195 0.000 11.016) 11.018 10.533 ( 2.716 0.000 6.460) 7.008 10.549 ( -7.735 0.000 5.184) 9.311 10.594 ( -8.223 0.000 -18.194) 19.966 10.939 ( 3.909 0.000 4.067) 5.640 11.012 ( -0.692 0.000 15.298) 15.314 11.362 ( -13.041 0.000 0.742) 13.062 11.740 ( -7.175 0.000 -4.014) 8.222 12.179 ( -0.926 0.000 -4.445) 4.540 12.182 ( -4.112 0.000 -11.841) 12.535 12.296 ( 2.629 0.000 0.481) 2.673 12.403 ( 2.628 0.000 -0.710) 2.722 12.616 ( 3.280 0.000 -4.364) 5.459 12.787 ( 4.490 0.000 8.115) 9.274 12.973 ( -1.386 0.000 -1.355) 1.938 13.158 ( 12.436 0.000 -5.682) 13.673 13.222 ( -4.018 0.000 -1.101) 4.166 13.425 ( 0.932 0.000 10.719) 10.759 14.273 ( -2.554 0.000 0.243) 2.565 14.364 ( -1.217 0.000 -1.104) 1.643 14.373 ( -0.711 0.000 1.257) 1.444 14.475 ( 1.627 0.000 -5.155) 5.405 14.804 ( -1.827 0.000 0.592) 1.921 14.908 ( -1.090 0.000 1.636) 1.966 15.208 ( -9.056 0.000 11.729) 14.818 15.243 ( -15.571 0.000 -5.905) 16.653 15.330 ( -11.104 0.000 -7.935) 13.648 15.441 ( -5.291 0.000 -1.836) 5.600 15.646 ( -4.681 0.000 -5.348) 7.107 15.792 ( -12.349 0.000 5.439) 13.493 17.871 ( -1.376 0.000 -8.202) 8.317 18.175 ( -3.420 0.000 7.124) 7.902 18.426 ( 6.955 0.000 -2.729) 7.472 18.533 ( 2.938 0.000 3.688) 4.715 18.783 ( 0.167 0.000 -2.164) 2.171 18.839 ( -0.154 0.000 8.108) 8.110 19.287 ( -3.689 0.000 -1.912) 4.155 19.354 ( 6.732 0.000 -1.840) 6.979 19.499 ( 4.438 0.000 1.522) 4.691 19.616 ( -3.794 0.000 0.757) 3.869 19.778 ( 7.438 0.000 2.952) 8.002 20.016 ( 4.422 0.000 -2.792) 5.229 20.374 ( 9.988 0.000 1.303) 10.073 20.512 ( 10.942 0.000 1.046) 10.992 20.519 ( 13.032 0.000 -3.671) 13.539 20.717 ( 13.200 0.000 -2.505) 13.436 20.789 ( 20.124 0.000 2.260) 20.251 21.051 ( 21.244 0.000 -2.665) 21.411 21.331 ( 32.769 0.000 25.309) 41.405 21.777 ( 29.286 0.000 -22.367) 36.851 24.435 ( -1.712 0.000 -1.522) 2.291 24.452 ( -1.830 0.000 2.476) 3.079 24.543 ( -2.042 0.000 -0.072) 2.043 24.574 ( -2.750 0.000 -0.061) 2.750 28.534 ( 1.786 0.000 -0.042) 1.787 28.582 ( 2.620 0.000 0.057) 2.621 29.182 ( -1.870 0.000 -6.421) 6.688 29.285 ( -1.567 0.000 3.994) 4.290 29.429 ( -3.281 0.000 3.930) 5.120 29.479 ( -2.398 0.000 -1.443) 2.798 29.590 ( -1.420 0.000 -0.559) 1.526 29.613 ( -1.756 0.000 0.374) 1.795 33.056 ( 5.543 0.000 -0.965) 5.626 33.060 ( 5.640 0.000 1.097) 5.746 33.284 ( 8.603 0.000 1.331) 8.705 33.297 ( 8.849 0.000 -1.807) 9.032 35.868 ( -5.095 0.000 4.381) 6.720 35.903 ( -2.747 0.000 -4.018) 4.867 37.531 ( -23.429 0.000 13.527) 27.054 37.711 ( -18.459 0.000 -18.253) 25.960 37.990 ( -7.857 0.000 2.031) 8.116 38.266 ( -8.883 0.000 2.888) 9.341 38.822 ( -0.673 0.000 6.573) 6.607 39.294 ( -4.614 0.000 2.141) 5.087 39.310 ( -4.925 0.000 -2.288) 5.431 39.547 ( -6.267 0.000 4.124) 7.502 39.906 ( -3.441 0.000 -0.014) 3.441 39.940 ( -4.960 0.000 -1.968) 5.336 40.823 ( -14.052 0.000 17.900) 22.757 41.071 ( -5.153 0.000 -21.038) 21.660 42.664 ( -20.052 0.000 -13.066) 23.933 42.669 ( -25.285 0.000 13.459) 28.644 44.121 ( -25.568 0.000 -24.523) 35.427 44.309 ( -21.108 0.000 10.092) 23.397 45.002 ( -13.795 0.000 3.217) 14.166 45.019 ( -19.838 0.000 2.252) 19.966 70.113 ( -9.477 0.000 -9.890) 13.697 70.241 ( -9.378 0.000 11.897) 15.148 71.576 ( -32.554 0.000 5.989) 33.100 72.404 ( -42.077 0.000 3.325) 42.208 105.203 ( -3.228 0.000 -2.879) 4.326 105.305 ( -2.487 0.000 2.967) 3.871 105.334 ( -6.031 0.000 -4.808) 7.713 105.527 ( -7.390 0.000 1.294) 7.502 ======================= Grid point 169 (79/102) ======================= q-point: ( 0.19 0.00 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 Number of triplets: 96 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.095 ( 31.832 0.000 -33.377) 46.123 3.212 ( 22.284 0.000 -23.448) 32.348 3.277 ( 27.050 0.000 24.467) 36.474 3.622 ( 24.239 0.000 25.514) 35.193 4.196 ( 31.788 0.000 -8.336) 32.863 4.220 ( 26.881 0.000 -1.190) 26.907 4.524 ( 22.437 0.000 -11.985) 25.437 4.817 ( 19.353 0.000 -2.109) 19.468 4.885 ( 19.447 0.000 1.488) 19.504 4.965 ( 21.479 0.000 -9.669) 23.555 5.081 ( 11.111 0.000 39.930) 41.447 5.203 ( 9.548 0.000 -2.209) 9.800 5.309 ( 30.560 0.000 -23.007) 38.253 5.391 ( 26.050 0.000 -1.047) 26.071 5.617 ( 15.260 0.000 5.852) 16.344 5.647 ( 32.483 0.000 -2.230) 32.560 5.850 ( 21.325 0.000 -0.190) 21.326 6.111 ( 2.401 0.000 1.859) 3.036 6.262 ( 3.925 0.000 8.961) 9.783 6.338 ( 6.151 0.000 2.609) 6.682 6.380 ( 5.030 0.000 10.942) 12.043 6.685 ( 12.344 0.000 -7.996) 14.707 6.726 ( 10.244 0.000 4.829) 11.325 6.864 ( 21.133 0.000 0.716) 21.145 6.972 ( 27.719 0.000 -2.201) 27.806 7.072 ( 30.519 0.000 0.844) 30.531 7.178 ( -0.136 0.000 5.968) 5.970 7.188 ( 4.591 0.000 -8.814) 9.938 7.494 ( 5.945 0.000 -10.474) 12.043 7.750 ( 11.234 0.000 8.552) 14.119 7.824 ( 9.982 0.000 6.676) 12.009 7.880 ( 14.869 0.000 2.598) 15.095 7.954 ( 11.846 0.000 -2.621) 12.132 8.141 ( 24.190 0.000 -6.488) 25.044 8.196 ( 9.819 0.000 7.556) 12.390 8.234 ( 16.028 0.000 1.824) 16.132 8.331 ( 17.798 0.000 4.408) 18.336 8.435 ( 1.213 0.000 3.164) 3.388 8.473 ( 11.129 0.000 -5.198) 12.283 8.529 ( 15.219 0.000 -2.097) 15.363 8.548 ( 15.333 0.000 -0.807) 15.354 8.735 ( 6.426 0.000 -8.395) 10.572 8.939 ( 7.012 0.000 -2.292) 7.377 8.960 ( 3.071 0.000 3.968) 5.017 9.136 ( 5.789 0.000 2.304) 6.231 9.167 ( 10.564 0.000 -8.124) 13.326 9.537 ( 3.356 0.000 -15.574) 15.932 9.622 ( 4.142 0.000 7.622) 8.675 9.896 ( -3.482 0.000 7.164) 7.965 10.013 ( 1.175 0.000 10.780) 10.844 10.316 ( 7.821 0.000 1.461) 7.956 10.401 ( -6.669 0.000 -11.415) 13.221 10.448 ( -0.906 0.000 7.507) 7.562 10.594 ( 1.820 0.000 2.034) 2.729 11.032 ( -0.751 0.000 11.178) 11.203 11.051 ( 6.146 0.000 -4.364) 7.537 11.148 ( -6.693 0.000 1.043) 6.774 11.628 ( -2.269 0.000 1.538) 2.741 12.068 ( -4.418 0.000 -11.554) 12.370 12.138 ( -1.997 0.000 -5.726) 6.064 12.306 ( -0.843 0.000 -2.825) 2.948 12.364 ( -4.360 0.000 -0.704) 4.416 12.697 ( -9.210 0.000 4.367) 10.193 12.727 ( 5.731 0.000 -4.708) 7.417 13.030 ( -7.428 0.000 0.350) 7.437 13.102 ( 8.021 0.000 1.913) 8.246 13.513 ( 5.579 0.000 10.066) 11.509 13.519 ( 17.166 0.000 -4.929) 17.859 14.220 ( -2.763 0.000 0.472) 2.803 14.333 ( -1.487 0.000 -1.113) 1.858 14.379 ( 1.197 0.000 0.655) 1.364 14.494 ( 1.147 0.000 -4.604) 4.745 14.766 ( -1.839 0.000 -2.324) 2.964 14.858 ( -4.338 0.000 4.001) 5.901 15.006 ( -6.661 0.000 -8.603) 10.880 15.098 ( -4.009 0.000 9.493) 10.305 15.112 ( -10.847 0.000 6.365) 12.577 15.347 ( -3.375 0.000 -3.932) 5.182 15.502 ( -7.562 0.000 -10.243) 12.732 15.602 ( -8.715 0.000 7.370) 11.413 17.811 ( -2.797 0.000 -5.532) 6.199 18.075 ( -6.518 0.000 4.903) 8.156 18.532 ( 4.037 0.000 -2.653) 4.830 18.610 ( 3.080 0.000 2.687) 4.087 18.777 ( -0.028 0.000 -3.146) 3.146 18.821 ( -2.501 0.000 5.665) 6.193 19.214 ( -3.307 0.000 -1.439) 3.607 19.459 ( -5.147 0.000 1.082) 5.259 19.527 ( 10.452 0.000 -0.959) 10.496 19.703 ( 8.508 0.000 0.888) 8.554 19.932 ( 7.394 0.000 2.468) 7.795 20.106 ( 4.870 0.000 -2.168) 5.331 20.627 ( 14.528 0.000 2.300) 14.709 20.771 ( 14.333 0.000 1.134) 14.378 20.805 ( 15.934 0.000 -3.399) 16.292 20.996 ( 14.875 0.000 -2.738) 15.125 21.228 ( 22.346 0.000 1.615) 22.405 21.477 ( 21.155 0.000 -2.325) 21.283 21.935 ( 22.415 0.000 21.541) 31.088 22.222 ( 19.995 0.000 -17.858) 26.809 24.401 ( -1.416 0.000 -0.319) 1.452 24.425 ( -1.250 0.000 2.162) 2.497 24.515 ( -0.802 0.000 1.378) 1.594 24.518 ( -2.514 0.000 -1.717) 3.045 28.581 ( 2.912 0.000 0.213) 2.920 28.640 ( 3.128 0.000 -0.236) 3.137 29.130 ( -2.047 0.000 -5.234) 5.620 29.247 ( -2.879 0.000 2.501) 3.814 29.381 ( -2.475 0.000 4.973) 5.555 29.426 ( -2.272 0.000 -2.884) 3.672 29.554 ( -2.155 0.000 -0.120) 2.159 29.573 ( -2.273 0.000 0.220) 2.284 33.182 ( 7.023 0.000 -0.639) 7.052 33.191 ( 6.992 0.000 0.789) 7.036 33.458 ( 8.318 0.000 1.224) 8.407 33.468 ( 8.418 0.000 -1.619) 8.573 35.778 ( -4.388 0.000 3.192) 5.426 35.842 ( -2.471 0.000 -2.704) 3.663 37.123 ( -20.102 0.000 15.374) 25.307 37.266 ( -20.294 0.000 -18.215) 27.270 37.887 ( -4.291 0.000 4.029) 5.886 38.085 ( -9.446 0.000 -1.681) 9.594 38.806 ( -1.706 0.000 4.604) 4.910 39.185 ( -6.248 0.000 -4.373) 7.627 39.219 ( -3.811 0.000 5.237) 6.476 39.369 ( -10.678 0.000 -1.468) 10.778 39.799 ( -8.387 0.000 -3.000) 8.907 39.825 ( -4.928 0.000 1.087) 5.047 40.573 ( -14.074 0.000 14.923) 20.513 40.898 ( -7.593 0.000 -18.350) 19.859 42.131 ( -29.895 0.000 11.795) 32.137 42.191 ( -24.042 0.000 -9.474) 25.842 43.666 ( -15.957 0.000 -19.239) 24.995 43.945 ( -17.847 0.000 14.307) 22.874 44.634 ( -18.240 0.000 -3.416) 18.557 44.711 ( -15.852 0.000 4.455) 16.466 69.879 ( -11.766 0.000 -7.309) 13.851 70.042 ( -12.465 0.000 9.512) 15.679 70.968 ( -29.236 0.000 3.039) 29.393 71.544 ( -41.809 0.000 -1.998) 41.857 105.131 ( -3.420 0.000 -2.007) 3.965 105.220 ( -4.819 0.000 -2.333) 5.354 105.248 ( -3.692 0.000 2.173) 4.284 105.377 ( -7.465 0.000 0.849) 7.513 ======================= Grid point 170 (80/102) ======================= q-point: ( 0.25 0.00 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 Number of triplets: 102 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.576 ( 20.761 0.000 -30.395) 36.809 3.710 ( 35.155 0.000 -26.110) 43.790 3.875 ( 27.597 0.000 22.391) 35.538 4.100 ( 19.120 0.000 25.598) 31.950 4.697 ( 20.929 0.000 -3.367) 21.198 4.741 ( 22.676 0.000 1.036) 22.700 4.931 ( 19.044 0.000 -4.480) 19.563 5.171 ( 14.383 0.000 -1.593) 14.471 5.182 ( 11.584 0.000 -10.251) 15.468 5.203 ( 12.635 0.000 4.570) 13.436 5.389 ( 10.081 0.000 -5.018) 11.261 5.398 ( 10.834 0.000 14.110) 17.790 5.830 ( 10.575 0.000 0.382) 10.582 5.907 ( 21.682 0.000 -6.151) 22.538 6.019 ( 29.999 0.000 -3.731) 30.230 6.133 ( 10.019 0.000 -0.709) 10.045 6.138 ( 11.446 0.000 3.216) 11.889 6.245 ( 11.957 0.000 -1.073) 12.005 6.441 ( 6.201 0.000 17.013) 18.107 6.528 ( 18.302 0.000 -2.962) 18.541 6.627 ( 17.770 0.000 3.929) 18.199 6.772 ( 0.558 0.000 -5.431) 5.459 6.910 ( 9.469 0.000 4.894) 10.659 7.081 ( -0.677 0.000 10.409) 10.431 7.211 ( 7.679 0.000 -7.236) 10.551 7.379 ( 21.762 0.000 0.647) 21.772 7.420 ( 5.619 0.000 -4.497) 7.197 7.620 ( 13.328 0.000 11.359) 17.512 7.784 ( 25.454 0.000 -5.476) 26.037 7.996 ( 3.890 0.000 1.449) 4.151 8.033 ( 19.282 0.000 0.969) 19.306 8.043 ( 2.013 0.000 -9.555) 9.764 8.164 ( 11.713 0.000 7.943) 14.152 8.352 ( 2.715 0.000 11.530) 11.845 8.432 ( 11.555 0.000 -6.279) 13.151 8.561 ( 9.192 0.000 -4.793) 10.367 8.613 ( 11.321 0.000 -4.002) 12.008 8.627 ( 6.799 0.000 -1.419) 6.945 8.697 ( 18.517 0.000 -1.644) 18.590 8.863 ( 16.568 0.000 -1.857) 16.672 8.874 ( 13.959 0.000 -6.394) 15.354 8.955 ( 17.717 0.000 8.039) 19.455 9.123 ( 15.620 0.000 -1.912) 15.737 9.152 ( 12.774 0.000 -4.472) 13.534 9.300 ( 12.152 0.000 -5.776) 13.455 9.427 ( 14.635 0.000 -0.064) 14.635 9.650 ( -7.349 0.000 6.617) 9.889 9.661 ( 11.165 0.000 -0.339) 11.170 9.826 ( 3.820 0.000 6.954) 7.934 10.010 ( -0.720 0.000 2.388) 2.494 10.327 ( 0.652 0.000 1.378) 1.525 10.396 ( 0.981 0.000 10.844) 10.888 10.577 ( 7.442 0.000 -5.696) 9.371 10.614 ( 0.416 0.000 -0.704) 0.817 11.026 ( 2.362 0.000 7.027) 7.413 11.118 ( 3.290 0.000 -19.459) 19.735 11.161 ( 4.902 0.000 6.195) 7.900 11.689 ( 6.063 0.000 12.203) 13.626 11.970 ( -2.584 0.000 -10.520) 10.833 12.078 ( -2.704 0.000 -5.946) 6.532 12.283 ( -3.007 0.000 0.395) 3.033 12.283 ( 0.332 0.000 -5.623) 5.633 12.528 ( -7.339 0.000 3.851) 8.288 12.692 ( -6.562 0.000 -4.193) 7.787 13.016 ( 4.794 0.000 -3.941) 6.206 13.224 ( 3.172 0.000 5.518) 6.365 13.655 ( 5.638 0.000 7.228) 9.167 13.799 ( 10.815 0.000 -1.807) 10.965 14.166 ( -2.645 0.000 0.345) 2.668 14.300 ( -1.717 0.000 -0.963) 1.969 14.422 ( 2.910 0.000 0.176) 2.915 14.498 ( 0.083 0.000 -2.646) 2.647 14.719 ( -1.881 0.000 -5.943) 6.234 14.776 ( -4.105 0.000 4.438) 6.046 14.903 ( -4.081 0.000 -3.402) 5.313 14.946 ( -5.666 0.000 7.140) 9.115 15.067 ( -1.571 0.000 8.141) 8.291 15.295 ( -1.010 0.000 -3.902) 4.031 15.327 ( -7.256 0.000 -10.625) 12.866 15.453 ( -7.792 0.000 6.232) 9.978 17.747 ( -2.366 0.000 -3.537) 4.255 17.961 ( -5.397 0.000 3.211) 6.280 18.576 ( 1.070 0.000 -2.699) 2.904 18.651 ( 0.407 0.000 2.959) 2.986 18.777 ( -2.713 0.000 3.968) 4.807 18.777 ( 0.809 0.000 -3.229) 3.328 19.143 ( -3.573 0.000 -1.215) 3.774 19.359 ( -4.955 0.000 1.173) 5.092 19.747 ( 11.069 0.000 -0.341) 11.074 19.884 ( 8.851 0.000 0.443) 8.862 20.079 ( 6.633 0.000 1.631) 6.830 20.195 ( 4.237 0.000 -1.481) 4.488 20.946 ( 16.239 0.000 3.272) 16.566 21.077 ( 15.601 0.000 1.499) 15.673 21.126 ( 16.353 0.000 -3.375) 16.697 21.287 ( 14.449 0.000 -2.545) 14.671 21.663 ( 20.445 0.000 0.488) 20.451 21.869 ( 18.082 0.000 -1.356) 18.132 22.340 ( 15.134 0.000 12.046) 19.343 22.527 ( 13.860 0.000 -10.542) 17.414 24.381 ( -0.669 0.000 1.462) 1.608 24.414 ( -0.135 0.000 1.207) 1.215 24.473 ( -1.214 0.000 -3.341) 3.555 24.516 ( 0.409 0.000 2.304) 2.340 28.649 ( 3.783 0.000 0.488) 3.815 28.705 ( 3.471 0.000 -0.633) 3.528 29.078 ( -2.215 0.000 -3.669) 4.286 29.184 ( -3.681 0.000 1.473) 3.964 29.350 ( -1.702 0.000 5.412) 5.674 29.379 ( -1.658 0.000 -3.959) 4.292 29.505 ( -2.699 0.000 0.219) 2.708 29.525 ( -2.447 0.000 0.020) 2.447 33.326 ( 7.232 0.000 -0.303) 7.239 33.335 ( 7.086 0.000 0.388) 7.097 33.618 ( 7.382 0.000 0.458) 7.396 33.623 ( 7.279 0.000 -0.764) 7.319 35.712 ( -2.610 0.000 2.223) 3.428 35.796 ( -1.511 0.000 -1.776) 2.332 36.787 ( -16.467 0.000 12.902) 20.919 36.852 ( -17.431 0.000 -13.848) 22.262 37.819 ( -3.502 0.000 3.461) 4.924 37.892 ( -8.987 0.000 -3.153) 9.524 38.780 ( -1.688 0.000 3.527) 3.910 39.054 ( -5.754 0.000 -4.393) 7.239 39.152 ( -9.873 0.000 -3.398) 10.441 39.160 ( -3.331 0.000 6.232) 7.066 39.602 ( -10.311 0.000 -3.624) 10.929 39.709 ( -6.917 0.000 1.713) 7.126 40.334 ( -12.247 0.000 11.129) 16.548 40.704 ( -7.857 0.000 -15.318) 17.216 41.559 ( -28.827 0.000 9.891) 30.476 41.687 ( -24.131 0.000 -5.808) 24.820 43.368 ( -11.087 0.000 -12.647) 16.819 43.645 ( -15.236 0.000 13.061) 20.068 44.285 ( -15.358 0.000 -5.850) 16.435 44.401 ( -15.586 0.000 4.200) 16.142 69.625 ( -11.928 0.000 -4.938) 12.910 69.796 ( -13.465 0.000 7.021) 15.185 70.423 ( -25.384 0.000 0.796) 25.396 70.768 ( -34.753 0.000 -2.123) 34.818 105.059 ( -3.300 0.000 -1.165) 3.500 105.126 ( -4.244 0.000 -0.619) 4.289 105.170 ( -4.340 0.000 1.432) 4.570 105.239 ( -6.337 0.000 -0.057) 6.338 ======================= Grid point 171 (81/102) ======================= q-point: ( 0.31 0.00 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 Number of triplets: 96 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.936 ( 21.132 0.000 -25.491) 33.111 4.361 ( 33.699 0.000 -19.829) 39.100 4.453 ( 25.041 0.000 16.693) 30.095 4.516 ( 17.630 0.000 21.262) 27.620 5.031 ( 13.026 0.000 -6.861) 14.723 5.090 ( 10.952 0.000 5.087) 12.076 5.251 ( 13.916 0.000 0.396) 13.922 5.319 ( 6.939 0.000 -5.900) 9.108 5.465 ( 13.654 0.000 6.175) 14.985 5.481 ( 11.824 0.000 3.597) 12.359 5.599 ( 11.856 0.000 -5.667) 13.141 5.600 ( 10.669 0.000 -4.078) 11.422 6.012 ( 6.791 0.000 4.122) 7.944 6.157 ( 8.066 0.000 -4.302) 9.142 6.211 ( 6.501 0.000 -2.176) 6.856 6.239 ( -0.039 0.000 1.740) 1.740 6.420 ( 5.419 0.000 5.963) 8.057 6.510 ( 14.225 0.000 -3.998) 14.776 6.717 ( -3.820 0.000 -8.347) 9.180 6.748 ( 2.938 0.000 12.660) 12.996 6.802 ( 16.621 0.000 5.634) 17.550 6.962 ( 18.950 0.000 -4.659) 19.515 7.135 ( 6.167 0.000 3.936) 7.316 7.225 ( 13.148 0.000 1.165) 13.199 7.401 ( 12.438 0.000 0.330) 12.443 7.546 ( 10.070 0.000 4.458) 11.012 7.650 ( 1.162 0.000 16.790) 16.830 7.752 ( 2.123 0.000 0.122) 2.127 7.924 ( -3.100 0.000 -15.113) 15.428 8.146 ( 11.689 0.000 -0.695) 11.710 8.227 ( -3.988 0.000 14.762) 15.291 8.243 ( 11.773 0.000 -8.122) 14.303 8.381 ( 11.136 0.000 -10.104) 15.037 8.505 ( 6.044 0.000 1.570) 6.245 8.531 ( -2.055 0.000 -2.253) 3.050 8.642 ( 6.022 0.000 -9.643) 11.368 8.727 ( 6.626 0.000 -3.039) 7.290 8.896 ( 3.731 0.000 1.354) 3.969 8.928 ( 16.191 0.000 -0.538) 16.200 9.128 ( 13.393 0.000 -4.818) 14.233 9.163 ( 12.859 0.000 -1.527) 12.950 9.235 ( 4.952 0.000 2.071) 5.367 9.281 ( 1.388 0.000 3.006) 3.311 9.527 ( 19.549 0.000 1.369) 19.597 9.553 ( 5.182 0.000 5.824) 7.796 9.653 ( 20.876 0.000 -0.301) 20.878 9.791 ( 21.682 0.000 7.683) 23.003 9.921 ( 12.365 0.000 4.782) 13.257 10.031 ( 11.233 0.000 3.329) 11.716 10.104 ( 10.462 0.000 -6.596) 12.367 10.401 ( 5.144 0.000 4.921) 7.119 10.424 ( -0.675 0.000 14.823) 14.838 10.634 ( 2.848 0.000 -3.229) 4.306 10.647 ( 3.311 0.000 -13.677) 14.072 11.140 ( 3.722 0.000 -20.219) 20.558 11.168 ( 6.842 0.000 7.598) 10.225 11.346 ( 12.806 0.000 6.384) 14.309 11.862 ( 7.717 0.000 11.987) 14.256 11.940 ( 2.098 0.000 -9.882) 10.102 12.002 ( -3.613 0.000 -4.914) 6.099 12.270 ( 2.080 0.000 2.272) 3.080 12.331 ( 6.563 0.000 -5.375) 8.483 12.464 ( 0.754 0.000 2.974) 3.068 12.572 ( -3.011 0.000 -5.198) 6.007 13.095 ( 3.254 0.000 -5.904) 6.741 13.248 ( -2.072 0.000 7.447) 7.730 13.741 ( 1.284 0.000 4.547) 4.725 13.925 ( 1.485 0.000 0.944) 1.759 14.117 ( -2.225 0.000 -0.592) 2.303 14.254 ( -2.780 0.000 -1.209) 3.031 14.488 ( -0.716 0.000 -0.760) 1.044 14.491 ( 3.776 0.000 -0.151) 3.779 14.680 ( -0.205 0.000 -6.435) 6.439 14.726 ( -1.714 0.000 3.843) 4.208 14.815 ( -3.610 0.000 5.399) 6.495 14.917 ( 0.300 0.000 -0.626) 0.695 15.051 ( -2.016 0.000 7.733) 7.992 15.180 ( -4.863 0.000 -9.957) 11.081 15.280 ( -0.131 0.000 -3.413) 3.415 15.316 ( -6.951 0.000 4.749) 8.418 17.706 ( -1.040 0.000 -2.437) 2.650 17.876 ( -3.745 0.000 2.265) 4.377 18.574 ( -0.440 0.000 -2.831) 2.865 18.644 ( -1.534 0.000 3.135) 3.490 18.736 ( -1.871 0.000 2.901) 3.452 18.799 ( 2.065 0.000 -2.614) 3.331 19.063 ( -4.237 0.000 -1.266) 4.422 19.266 ( -4.606 0.000 1.174) 4.753 19.950 ( 8.998 0.000 -0.077) 8.999 20.045 ( 6.966 0.000 0.280) 6.972 20.199 ( 5.020 0.000 0.578) 5.054 20.267 ( 3.178 0.000 -0.572) 3.229 21.271 ( 15.083 0.000 3.679) 15.525 21.389 ( 14.765 0.000 1.972) 14.896 21.431 ( 14.506 0.000 -3.379) 14.894 21.553 ( 12.265 0.000 -2.291) 12.477 22.034 ( 16.299 0.000 -0.604) 16.311 22.184 ( 13.273 0.000 -0.161) 13.274 22.612 ( 10.757 0.000 3.782) 11.402 22.743 ( 9.320 0.000 -3.821) 10.073 24.380 ( 0.070 0.000 3.315) 3.315 24.416 ( 0.134 0.000 -1.393) 1.399 24.465 ( 1.259 0.000 -3.336) 3.565 24.537 ( 1.065 0.000 2.623) 2.831 28.731 ( 4.150 0.000 0.724) 4.212 28.775 ( 3.677 0.000 -0.993) 3.809 29.027 ( -2.184 0.000 -2.367) 3.221 29.112 ( -3.679 0.000 1.141) 3.852 29.332 ( -1.360 0.000 5.286) 5.458 29.343 ( -1.101 0.000 -4.417) 4.552 29.450 ( -2.733 0.000 0.479) 2.775 29.477 ( -2.314 0.000 -0.353) 2.341 33.462 ( 6.172 0.000 0.000) 6.172 33.468 ( 6.010 0.000 0.025) 6.010 33.753 ( 6.086 0.000 -0.211) 6.090 33.754 ( 5.843 0.000 0.032) 5.843 35.686 ( -0.441 0.000 1.747) 1.802 35.777 ( -0.006 0.000 -1.409) 1.409 36.514 ( -13.248 0.000 9.547) 16.330 36.514 ( -13.832 0.000 -9.682) 16.884 37.726 ( -6.798 0.000 -2.382) 7.203 37.757 ( -3.325 0.000 2.092) 3.928 38.756 ( -1.260 0.000 2.488) 2.788 38.937 ( -5.192 0.000 -3.057) 6.025 38.979 ( -6.319 0.000 -3.079) 7.029 39.114 ( -2.414 0.000 5.930) 6.402 39.384 ( -10.346 0.000 -3.993) 11.089 39.562 ( -7.883 0.000 1.570) 8.038 40.138 ( -9.074 0.000 7.050) 11.491 40.529 ( -6.534 0.000 -12.140) 13.787 41.037 ( -24.840 0.000 7.773) 26.028 41.220 ( -21.291 0.000 -2.636) 21.453 43.156 ( -8.028 0.000 -8.111) 11.412 43.387 ( -12.915 0.000 9.794) 16.209 44.003 ( -11.444 0.000 -5.660) 12.767 44.118 ( -13.294 0.000 3.620) 13.778 69.393 ( -10.184 0.000 -3.162) 10.664 69.546 ( -12.445 0.000 5.024) 13.421 69.966 ( -19.945 0.000 -0.767) 19.960 70.155 ( -25.949 0.000 -0.938) 25.966 104.997 ( -2.704 0.000 -0.339) 2.725 105.047 ( -3.580 0.000 0.246) 3.589 105.084 ( -4.386 0.000 0.563) 4.422 105.127 ( -4.746 0.000 -0.585) 4.782 ======================= Grid point 172 (82/102) ======================= q-point: ( 0.38 0.00 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 Number of triplets: 102 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 4.309 ( 20.315 0.000 -16.634) 26.256 4.881 ( 15.947 0.000 7.012) 17.421 4.903 ( 16.267 0.000 8.586) 18.394 4.929 ( 23.212 0.000 -5.723) 23.907 5.185 ( 4.682 0.000 -9.506) 10.597 5.237 ( 4.275 0.000 7.779) 8.876 5.421 ( 4.608 0.000 -3.873) 6.020 5.490 ( 9.145 0.000 1.716) 9.304 5.672 ( 8.402 0.000 -0.260) 8.406 5.784 ( 13.390 0.000 -5.928) 14.643 5.830 ( 11.360 0.000 -5.239) 12.510 5.831 ( 14.676 0.000 10.103) 17.817 6.137 ( 6.151 0.000 5.389) 8.177 6.191 ( -2.784 0.000 3.056) 4.134 6.312 ( 6.207 0.000 -4.035) 7.403 6.357 ( 8.740 0.000 -3.425) 9.387 6.455 ( -2.748 0.000 4.388) 5.178 6.605 ( -3.570 0.000 -9.910) 10.533 6.755 ( 10.842 0.000 -4.446) 11.718 6.853 ( 7.492 0.000 15.070) 16.830 6.966 ( -0.219 0.000 11.017) 11.019 7.209 ( 7.595 0.000 -1.933) 7.838 7.316 ( 7.906 0.000 2.303) 8.235 7.463 ( 10.880 0.000 -0.641) 10.899 7.550 ( -2.302 0.000 3.630) 4.298 7.613 ( -3.762 0.000 12.132) 12.702 7.691 ( 1.277 0.000 -6.163) 6.294 7.805 ( 1.647 0.000 -3.539) 3.904 7.877 ( 1.479 0.000 -11.743) 11.835 8.171 ( -0.930 0.000 9.471) 9.517 8.282 ( 1.874 0.000 1.638) 2.489 8.304 ( -3.286 0.000 -5.943) 6.791 8.392 ( -7.016 0.000 -10.892) 12.956 8.422 ( -4.302 0.000 0.285) 4.311 8.604 ( 6.461 0.000 -3.300) 7.256 8.840 ( 3.477 0.000 1.308) 3.715 8.856 ( -6.883 0.000 -1.304) 7.006 8.870 ( 1.643 0.000 2.192) 2.739 8.949 ( 5.163 0.000 -6.548) 8.339 9.199 ( 2.618 0.000 1.642) 3.090 9.459 ( 15.570 0.000 -0.553) 15.580 9.511 ( 19.435 0.000 -0.587) 19.444 9.555 ( 16.031 0.000 5.241) 16.866 9.711 ( 7.413 0.000 11.235) 13.460 9.855 ( 13.405 0.000 -0.442) 13.413 9.955 ( 7.869 0.000 8.585) 11.646 10.106 ( 3.806 0.000 -2.078) 4.337 10.137 ( 1.437 0.000 -0.105) 1.441 10.310 ( 20.956 0.000 7.218) 22.164 10.329 ( 11.365 0.000 -9.071) 14.541 10.491 ( 5.775 0.000 11.774) 13.114 10.538 ( 8.249 0.000 2.137) 8.522 10.680 ( 2.618 0.000 -12.680) 12.948 10.742 ( 8.873 0.000 -4.210) 9.821 11.179 ( 3.435 0.000 -14.915) 15.306 11.283 ( 3.291 0.000 6.807) 7.561 11.638 ( 13.101 0.000 2.404) 13.320 11.923 ( -2.211 0.000 -4.855) 5.335 12.001 ( 5.043 0.000 -8.663) 10.024 12.039 ( 6.453 0.000 12.239) 13.836 12.395 ( 9.520 0.000 2.215) 9.774 12.546 ( 11.206 0.000 0.594) 11.221 12.556 ( 11.798 0.000 -3.682) 12.359 12.591 ( 7.090 0.000 -3.535) 7.923 13.113 ( -0.244 0.000 -6.262) 6.266 13.180 ( -6.115 0.000 7.737) 9.862 13.712 ( -5.071 0.000 2.168) 5.515 13.864 ( -7.540 0.000 3.018) 8.121 14.076 ( -1.592 0.000 -2.064) 2.607 14.182 ( -4.089 0.000 -0.623) 4.136 14.478 ( 0.375 0.000 -0.554) 0.669 14.566 ( 3.630 0.000 -0.145) 3.633 14.686 ( 1.385 0.000 -3.596) 3.853 14.708 ( -1.426 0.000 3.072) 3.387 14.790 ( 0.037 0.000 3.890) 3.890 14.932 ( 1.249 0.000 -1.171) 1.712 15.015 ( -2.555 0.000 5.711) 6.257 15.098 ( -1.779 0.000 -7.601) 7.806 15.196 ( -5.923 0.000 3.766) 7.019 15.261 ( -1.352 0.000 -2.605) 2.935 17.696 ( 0.447 0.000 -1.971) 2.021 17.819 ( -2.513 0.000 1.910) 3.157 18.555 ( -0.646 0.000 -2.863) 2.935 18.609 ( -2.385 0.000 2.945) 3.790 18.720 ( -0.241 0.000 2.329) 2.341 18.847 ( 3.110 0.000 -1.885) 3.637 18.970 ( -4.566 0.000 -1.343) 4.759 19.178 ( -4.442 0.000 1.089) 4.574 20.100 ( 5.957 0.000 0.017) 5.957 20.159 ( 4.315 0.000 0.138) 4.317 20.281 ( 3.207 0.000 -0.298) 3.221 20.318 ( 1.937 0.000 0.293) 1.959 21.552 ( 11.948 0.000 3.626) 12.486 21.662 ( 11.667 0.000 2.310) 11.894 21.680 ( 10.819 0.000 -3.406) 11.342 21.759 ( 8.616 0.000 -2.103) 8.869 22.308 ( 11.185 0.000 -1.286) 11.258 22.398 ( 8.052 0.000 0.864) 8.099 22.795 ( 7.430 0.000 -1.872) 7.662 22.885 ( 5.168 0.000 1.251) 5.317 24.395 ( 0.398 0.000 4.828) 4.845 24.417 ( 0.595 0.000 -4.181) 4.224 24.501 ( 2.545 0.000 -2.603) 3.640 24.564 ( 0.955 0.000 2.577) 2.748 28.813 ( 3.703 0.000 0.928) 3.818 28.846 ( 3.527 0.000 -1.278) 3.751 28.983 ( -1.737 0.000 -1.556) 2.332 29.047 ( -2.918 0.000 1.126) 3.128 29.314 ( -1.639 0.000 4.604) 4.887 29.314 ( -0.929 0.000 -4.191) 4.293 29.404 ( -1.834 0.000 1.056) 2.116 29.433 ( -1.798 0.000 -0.972) 2.044 33.568 ( 4.242 0.000 0.246) 4.250 33.571 ( 4.164 0.000 -0.247) 4.171 33.855 ( 4.153 0.000 0.582) 4.193 33.858 ( 4.373 0.000 -0.653) 4.421 35.703 ( 1.771 0.000 1.688) 2.447 35.792 ( 1.755 0.000 -1.442) 2.272 36.255 ( -10.368 0.000 -6.679) 12.333 36.295 ( -10.369 0.000 6.650) 12.318 37.615 ( -3.832 0.000 -0.633) 3.884 37.693 ( -3.316 0.000 0.273) 3.327 38.742 ( -0.484 0.000 1.352) 1.436 38.843 ( -3.306 0.000 -0.972) 3.446 38.881 ( -3.291 0.000 -1.861) 3.781 39.086 ( -2.077 0.000 4.596) 5.044 39.187 ( -7.583 0.000 -3.657) 8.419 39.411 ( -7.151 0.000 0.578) 7.175 40.007 ( -4.887 0.000 3.458) 5.986 40.395 ( -4.825 0.000 -8.410) 9.696 40.609 ( -18.670 0.000 4.981) 19.323 40.836 ( -16.508 0.000 0.026) 16.508 43.011 ( -4.967 0.000 -5.266) 7.239 43.173 ( -9.978 0.000 6.484) 11.900 43.806 ( -7.188 0.000 -4.419) 8.438 43.892 ( -9.803 0.000 3.092) 10.279 69.213 ( -7.032 0.000 -2.145) 7.352 69.329 ( -9.966 0.000 3.728) 10.641 69.629 ( -13.246 0.000 -1.952) 13.389 69.725 ( -17.036 0.000 0.400) 17.040 104.952 ( -1.747 0.000 0.372) 1.787 104.986 ( -2.545 0.000 0.608) 2.617 105.004 ( -3.397 0.000 -0.329) 3.413 105.044 ( -3.467 0.000 -0.680) 3.533 ======================= Grid point 173 (83/102) ======================= q-point: ( 0.44 0.00 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 Number of triplets: 96 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 4.665 ( 17.286 0.000 -7.245) 18.743 5.086 ( 1.051 0.000 -2.424) 2.642 5.122 ( 5.080 0.000 2.396) 5.617 5.170 ( 1.940 0.000 -6.176) 6.473 5.309 ( 11.841 0.000 4.578) 12.695 5.353 ( 5.525 0.000 11.599) 12.847 5.504 ( 3.953 0.000 -10.827) 11.526 5.606 ( 1.666 0.000 -0.025) 1.667 5.832 ( 6.841 0.000 4.978) 8.460 5.919 ( 4.019 0.000 -6.507) 7.649 5.983 ( 5.831 0.000 -7.298) 9.341 6.113 ( -0.284 0.000 4.860) 4.868 6.250 ( 14.876 0.000 5.847) 15.983 6.336 ( -2.460 0.000 -3.015) 3.891 6.336 ( 7.893 0.000 4.467) 9.070 6.370 ( -1.397 0.000 7.585) 7.712 6.527 ( 7.272 0.000 -6.519) 9.766 6.603 ( 4.830 0.000 -6.101) 7.781 6.945 ( 8.604 0.000 1.198) 8.687 6.969 ( 1.848 0.000 8.645) 8.841 7.094 ( 11.662 0.000 13.614) 17.926 7.302 ( 2.605 0.000 1.406) 2.960 7.385 ( -9.532 0.000 -3.187) 10.050 7.395 ( -4.686 0.000 -4.324) 6.376 7.539 ( 2.565 0.000 3.729) 4.526 7.605 ( -3.891 0.000 6.348) 7.446 7.715 ( -5.107 0.000 -2.085) 5.517 7.724 ( -0.120 0.000 -7.193) 7.194 7.831 ( -1.877 0.000 -12.569) 12.709 8.096 ( -11.602 0.000 -6.312) 13.208 8.166 ( -3.307 0.000 0.340) 3.324 8.284 ( 0.075 0.000 -0.459) 0.465 8.344 ( 3.996 0.000 8.956) 9.807 8.414 ( -0.093 0.000 0.804) 0.810 8.550 ( -9.443 0.000 0.362) 9.450 8.671 ( -9.147 0.000 -3.380) 9.751 8.840 ( 5.124 0.000 -3.302) 6.096 8.916 ( 2.889 0.000 2.504) 3.823 9.201 ( 10.029 0.000 -5.494) 11.435 9.267 ( 2.396 0.000 4.863) 5.421 9.721 ( 11.673 0.000 -9.751) 15.210 9.776 ( 4.237 0.000 19.983) 20.427 9.874 ( 14.212 0.000 4.444) 14.890 9.901 ( 8.451 0.000 2.187) 8.729 10.045 ( 0.745 0.000 -2.875) 2.970 10.059 ( 5.771 0.000 -5.091) 7.696 10.110 ( -0.166 0.000 -2.584) 2.590 10.110 ( -1.059 0.000 6.357) 6.445 10.436 ( 2.579 0.000 -7.200) 7.648 10.523 ( -0.306 0.000 8.694) 8.699 10.692 ( 4.884 0.000 -1.316) 5.058 10.707 ( 6.301 0.000 -2.041) 6.624 10.773 ( 12.831 0.000 0.514) 12.842 10.935 ( 8.540 0.000 -2.352) 8.858 11.209 ( 2.852 0.000 -10.918) 11.284 11.325 ( -0.692 0.000 6.011) 6.050 11.830 ( 5.849 0.000 -2.500) 6.361 11.890 ( -0.566 0.000 -0.758) 0.946 12.082 ( 4.640 0.000 -6.891) 8.308 12.152 ( 1.797 0.000 10.012) 10.172 12.608 ( 11.228 0.000 -0.987) 11.271 12.720 ( 9.328 0.000 0.784) 9.361 12.858 ( 17.578 0.000 0.047) 17.578 12.920 ( 19.250 0.000 -3.646) 19.593 13.049 ( -7.234 0.000 5.911) 9.342 13.063 ( -3.276 0.000 -4.421) 5.502 13.544 ( -11.930 0.000 0.267) 11.933 13.652 ( -14.010 0.000 3.483) 14.436 14.046 ( -0.690 0.000 -2.677) 2.764 14.099 ( -3.775 0.000 0.858) 3.871 14.510 ( 2.859 0.000 -0.606) 2.922 14.630 ( 2.549 0.000 -0.383) 2.577 14.664 ( -3.358 0.000 2.221) 4.026 14.698 ( -0.129 0.000 -0.412) 0.432 14.830 ( 3.300 0.000 -0.174) 3.305 14.962 ( 2.016 0.000 -0.417) 2.058 14.977 ( -3.107 0.000 5.120) 5.989 15.070 ( 0.015 0.000 -8.421) 8.421 15.103 ( -3.090 0.000 5.316) 6.149 15.211 ( -3.141 0.000 -1.553) 3.504 17.713 ( 1.508 0.000 -1.849) 2.386 17.779 ( -1.987 0.000 1.853) 2.717 18.541 ( -0.079 0.000 -2.787) 2.788 18.569 ( -2.053 0.000 2.739) 3.423 18.738 ( 1.595 0.000 1.981) 2.543 18.868 ( -3.634 0.000 -1.853) 4.079 18.925 ( 3.300 0.000 -0.912) 3.424 19.091 ( -4.443 0.000 0.946) 4.543 20.191 ( 3.135 0.000 0.094) 3.136 20.219 ( 1.710 0.000 -0.046) 1.711 20.329 ( 1.708 0.000 -0.814) 1.892 20.345 ( 0.657 0.000 0.845) 1.070 21.756 ( 7.451 0.000 3.473) 8.220 21.836 ( 5.016 0.000 -3.618) 6.185 21.851 ( 6.504 0.000 2.347) 6.914 21.885 ( 4.428 0.000 -1.865) 4.804 22.476 ( 5.900 0.000 -1.543) 6.098 22.513 ( 3.366 0.000 1.464) 3.670 22.907 ( 4.565 0.000 -4.989) 6.762 22.956 ( 1.316 0.000 4.443) 4.634 24.412 ( 0.162 0.000 5.759) 5.761 24.422 ( 0.815 0.000 -5.538) 5.597 24.546 ( 2.288 0.000 -2.465) 3.363 24.581 ( 0.109 0.000 2.451) 2.454 28.876 ( 2.233 0.000 1.207) 2.538 28.903 ( 1.995 0.000 -1.763) 2.662 28.957 ( -0.250 0.000 -0.832) 0.868 29.002 ( -1.768 0.000 1.076) 2.070 29.287 ( -1.620 0.000 3.498) 3.854 29.288 ( -0.799 0.000 -3.559) 3.647 29.384 ( -0.543 0.000 2.021) 2.092 29.403 ( -0.984 0.000 -1.760) 2.016 33.632 ( 2.059 0.000 0.414) 2.100 33.633 ( 2.073 0.000 -0.416) 2.114 33.921 ( 2.185 0.000 0.885) 2.357 33.923 ( 2.294 0.000 -0.903) 2.465 35.761 ( 3.573 0.000 1.865) 4.031 35.836 ( 2.536 0.000 -1.606) 3.001 36.072 ( -6.459 0.000 -4.924) 8.122 36.126 ( -7.705 0.000 4.740) 9.046 37.569 ( -0.872 0.000 0.976) 1.309 37.628 ( -2.869 0.000 -1.227) 3.120 38.744 ( 0.504 0.000 0.366) 0.623 38.797 ( -1.756 0.000 -0.004) 1.756 38.841 ( -0.161 0.000 0.469) 0.496 38.990 ( -6.297 0.000 -2.099) 6.637 39.135 ( 1.108 0.000 2.224) 2.485 39.284 ( -5.501 0.000 -0.862) 5.569 39.966 ( 0.666 0.000 0.576) 0.880 40.235 ( -11.500 0.000 1.764) 11.634 40.388 ( -2.169 0.000 -4.530) 5.022 40.565 ( -10.784 0.000 2.262) 11.018 42.937 ( -1.442 0.000 -3.723) 3.992 43.020 ( -6.366 0.000 4.257) 7.658 43.697 ( -2.886 0.000 -3.359) 4.428 43.742 ( -5.732 0.000 2.793) 6.376 69.108 ( -2.903 0.000 -1.865) 3.451 69.170 ( -6.371 0.000 2.846) 6.978 69.431 ( -6.023 0.000 -2.541) 6.537 69.471 ( -8.709 0.000 1.565) 8.848 104.929 ( -0.744 0.000 0.917) 1.181 104.950 ( -1.867 0.000 -0.854) 2.053 104.951 ( -0.973 0.000 0.663) 1.178 104.985 ( -2.265 0.000 -0.734) 2.381 ======================= Grid point 174 (84/102) ======================= q-point: ( 0.50 0.00 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 Number of triplets: 54 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 4.952 ( -11.481 0.000 -0.611) 11.497 4.952 ( 11.481 0.000 0.611) 11.497 5.175 ( -0.597 0.000 -3.250) 3.305 5.175 ( 0.597 0.000 3.250) 3.305 5.468 ( -1.674 0.000 -11.381) 11.503 5.468 ( 1.674 0.000 11.381) 11.503 5.545 ( -6.318 0.000 -2.850) 6.931 5.545 ( 6.318 0.000 2.850) 6.931 5.932 ( -1.339 0.000 -7.006) 7.132 5.932 ( 1.339 0.000 7.006) 7.132 6.078 ( 4.416 0.000 -5.666) 7.183 6.078 ( -4.416 0.000 5.666) 7.183 6.276 ( 1.769 0.000 -6.389) 6.630 6.276 ( -1.769 0.000 6.389) 6.630 6.500 ( 4.830 0.000 -2.832) 5.600 6.500 ( -4.830 0.000 2.832) 5.600 6.613 ( 5.531 0.000 -4.733) 7.279 6.613 ( -5.531 0.000 4.733) 7.279 7.101 ( -4.355 0.000 -1.027) 4.474 7.101 ( 4.355 0.000 1.027) 4.474 7.184 ( -5.167 0.000 -2.546) 5.760 7.184 ( 5.167 0.000 2.546) 5.760 7.380 ( -11.507 0.000 -0.051) 11.507 7.380 ( 11.507 0.000 0.051) 11.507 7.473 ( 8.510 0.000 -8.817) 12.254 7.473 ( -8.510 0.000 8.817) 12.254 7.713 ( -0.202 0.000 -6.406) 6.409 7.713 ( 0.202 0.000 6.406) 6.409 7.849 ( -8.757 0.000 0.036) 8.757 7.849 ( 8.757 0.000 -0.036) 8.757 8.235 ( 6.467 0.000 -2.732) 7.020 8.235 ( -6.467 0.000 2.732) 7.020 8.399 ( 0.620 0.000 -1.801) 1.905 8.399 ( -0.620 0.000 1.801) 1.905 8.504 ( -5.946 0.000 -4.659) 7.554 8.504 ( 5.946 0.000 4.659) 7.554 8.928 ( 2.693 0.000 -2.182) 3.466 8.928 ( -2.693 0.000 2.182) 3.466 9.295 ( 1.410 0.000 -6.350) 6.505 9.295 ( -1.410 0.000 6.350) 6.505 9.848 ( 2.782 0.000 -20.347) 20.536 9.848 ( -2.782 0.000 20.347) 20.536 9.979 ( -0.129 0.000 -5.029) 5.030 9.979 ( 0.129 0.000 5.029) 5.030 10.075 ( 1.405 0.000 -14.566) 14.634 10.075 ( -1.405 0.000 14.566) 14.634 10.133 ( -1.870 0.000 -1.671) 2.507 10.133 ( 1.870 0.000 1.671) 2.507 10.473 ( 3.519 0.000 -5.184) 6.265 10.473 ( -3.519 0.000 5.184) 6.265 10.754 ( -0.875 0.000 -1.942) 2.130 10.754 ( 0.875 0.000 1.942) 2.130 10.969 ( -4.600 0.000 -3.879) 6.017 10.969 ( 4.600 0.000 3.879) 6.017 11.278 ( 4.942 0.000 -6.839) 8.438 11.278 ( -4.942 0.000 6.839) 8.438 11.883 ( 0.978 0.000 -2.816) 2.981 11.883 ( -0.978 0.000 2.816) 2.981 12.151 ( 3.230 0.000 -7.417) 8.089 12.151 ( -3.230 0.000 7.417) 8.089 12.817 ( 7.817 0.000 -5.472) 9.542 12.817 ( -7.817 0.000 5.472) 9.542 12.938 ( -4.600 0.000 0.249) 4.607 12.938 ( 4.600 0.000 -0.249) 4.607 13.233 ( -13.788 0.000 -0.144) 13.789 13.233 ( 13.788 0.000 0.144) 13.789 13.336 ( -15.300 0.000 3.543) 15.705 13.336 ( 15.300 0.000 -3.543) 15.705 14.047 ( 1.547 0.000 -2.307) 2.778 14.047 ( -1.547 0.000 2.307) 2.778 14.582 ( -4.211 0.000 0.879) 4.301 14.582 ( 4.211 0.000 -0.879) 4.301 14.678 ( -1.696 0.000 0.087) 1.698 14.678 ( 1.696 0.000 -0.087) 1.698 14.907 ( 4.346 0.000 -2.894) 5.222 14.907 ( -4.346 0.000 2.894) 5.222 15.013 ( -2.974 0.000 -1.092) 3.168 15.013 ( 2.974 0.000 1.092) 3.168 15.138 ( -3.538 0.000 -0.598) 3.588 15.138 ( 3.538 0.000 0.598) 3.588 17.744 ( 1.890 0.000 -1.850) 2.645 17.744 ( -1.890 0.000 1.850) 2.645 18.544 ( 0.979 0.000 -2.703) 2.875 18.544 ( -0.979 0.000 2.703) 2.875 18.791 ( -3.215 0.000 -1.789) 3.679 18.791 ( 3.215 0.000 1.789) 3.679 19.004 ( -4.370 0.000 0.870) 4.456 19.004 ( 4.370 0.000 -0.870) 4.456 20.229 ( -0.686 0.000 -0.132) 0.699 20.229 ( 0.686 0.000 0.132) 0.699 20.349 ( 0.516 0.000 -1.002) 1.127 20.349 ( -0.516 0.000 1.002) 1.127 21.858 ( -1.859 0.000 -3.492) 3.956 21.858 ( 1.859 0.000 3.492) 3.956 21.925 ( -0.385 0.000 -2.107) 2.142 21.925 ( 0.385 0.000 2.107) 2.142 22.540 ( 1.016 0.000 -1.619) 1.911 22.540 ( -1.016 0.000 1.619) 1.911 22.960 ( 1.871 0.000 -5.758) 6.054 22.960 ( -1.871 0.000 5.758) 6.054 24.422 ( 0.418 0.000 -6.015) 6.030 24.422 ( -0.418 0.000 6.015) 6.030 24.576 ( 1.169 0.000 -2.409) 2.678 24.576 ( -1.169 0.000 2.409) 2.678 28.907 ( -0.668 0.000 -1.672) 1.800 28.907 ( 0.668 0.000 1.672) 1.800 28.974 ( 1.450 0.000 -0.779) 1.646 28.974 ( -1.450 0.000 0.779) 1.646 29.274 ( 0.254 0.000 -3.162) 3.172 29.274 ( -0.254 0.000 3.162) 3.172 29.386 ( -0.239 0.000 -2.249) 2.262 29.386 ( 0.239 0.000 2.249) 2.262 33.653 ( 0.024 0.000 -0.475) 0.475 33.653 ( -0.024 0.000 0.475) 0.475 33.945 ( 0.026 0.000 -0.982) 0.982 33.945 ( -0.026 0.000 0.982) 0.982 35.839 ( -2.806 0.000 -1.888) 3.382 35.839 ( 2.806 0.000 1.888) 3.382 36.019 ( 2.963 0.000 -4.156) 5.104 36.019 ( -2.963 0.000 4.156) 5.104 37.580 ( -1.485 0.000 -1.704) 2.260 37.580 ( 1.485 0.000 1.704) 2.260 38.764 ( -1.416 0.000 0.080) 1.418 38.764 ( 1.416 0.000 -0.080) 1.418 38.882 ( -3.716 0.000 -2.230) 4.334 38.882 ( 3.716 0.000 2.230) 4.334 39.189 ( -3.608 0.000 -2.046) 4.147 39.189 ( 3.608 0.000 2.046) 4.147 40.043 ( -7.106 0.000 1.624) 7.289 40.043 ( 7.106 0.000 -1.624) 7.289 40.414 ( 4.943 0.000 -4.182) 6.475 40.414 ( -4.943 0.000 4.182) 6.475 42.939 ( 2.435 0.000 -3.367) 4.155 42.939 ( -2.435 0.000 3.367) 4.155 43.676 ( 1.441 0.000 -2.840) 3.184 43.676 ( -1.441 0.000 2.840) 3.184 69.093 ( 1.815 0.000 -2.167) 2.826 69.093 ( -1.815 0.000 2.167) 2.826 69.377 ( 1.161 0.000 -2.350) 2.621 69.377 ( -1.161 0.000 2.350) 2.621 104.926 ( -0.350 0.000 -1.075) 1.130 104.926 ( 0.350 0.000 1.075) 1.130 104.952 ( -0.834 0.000 -0.702) 1.090 104.952 ( 0.834 0.000 0.702) 1.090 ======================= Grid point 183 (85/102) ======================= q-point: ( 0.00 0.20 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 Number of triplets: 86 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.504 ( -5.746 17.808 -27.563) 33.314 1.504 ( 5.746 17.808 27.563) 33.314 2.502 ( 1.499 18.188 -43.414) 47.094 2.502 ( -1.499 18.188 43.414) 47.094 2.880 ( -0.443 -11.051 -10.609) 15.326 2.880 ( 0.443 -11.051 10.609) 15.326 3.777 ( -0.619 4.511 -16.885) 17.488 3.777 ( 0.619 4.511 16.885) 17.488 3.934 ( -1.917 -6.007 -1.200) 6.418 3.934 ( 1.917 -6.007 1.200) 6.418 4.338 ( 0.391 12.850 -27.791) 30.621 4.338 ( -0.391 12.850 27.791) 30.621 4.652 ( 0.019 -11.038 -22.270) 24.856 4.652 ( -0.019 -11.038 22.270) 24.856 4.798 ( 0.051 12.137 -25.174) 27.948 4.798 ( -0.051 12.137 25.174) 27.948 5.333 ( -1.158 -2.728 -3.304) 4.438 5.333 ( 1.158 -2.728 3.304) 4.438 5.659 ( -2.546 3.433 -8.377) 9.404 5.659 ( 2.546 3.433 8.377) 9.404 6.143 ( 1.971 -4.399 -11.923) 12.861 6.143 ( -1.971 -4.399 11.923) 12.861 6.376 ( 2.377 1.175 -3.532) 4.417 6.376 ( -2.377 1.175 3.532) 4.417 6.591 ( 2.423 4.144 -5.581) 7.362 6.591 ( -2.423 4.144 5.581) 7.362 6.715 ( 0.838 1.008 -3.411) 3.654 6.715 ( -0.838 1.008 3.411) 3.654 7.067 ( 2.589 -11.219 -8.091) 14.073 7.067 ( -2.589 -11.219 8.091) 14.073 7.339 ( 0.415 -0.191 -3.949) 3.975 7.339 ( -0.415 -0.191 3.949) 3.975 7.491 ( -2.706 0.049 -3.856) 4.711 7.491 ( 2.706 0.049 3.856) 4.711 7.716 ( -2.848 -2.749 -9.411) 10.210 7.716 ( 2.848 -2.749 9.411) 10.210 7.870 ( -0.333 2.701 -6.983) 7.495 7.870 ( 0.333 2.701 6.983) 7.495 8.125 ( 1.593 -6.926 -9.277) 11.686 8.125 ( -1.593 -6.926 9.277) 11.686 8.634 ( -5.405 -4.203 -5.516) 8.792 8.634 ( 5.405 -4.203 5.516) 8.792 8.782 ( -2.505 4.028 -7.177) 8.603 8.782 ( 2.505 4.028 7.177) 8.603 9.001 ( 2.778 7.154 -2.539) 8.084 9.001 ( -2.778 7.154 2.539) 8.084 9.420 ( -0.189 -7.700 -7.410) 10.688 9.420 ( 0.189 -7.700 7.410) 10.688 9.660 ( -0.897 8.386 -12.797) 15.326 9.660 ( 0.897 8.386 12.797) 15.326 10.121 ( -7.462 -17.864 -12.035) 22.795 10.121 ( 7.462 -17.864 12.035) 22.795 10.647 ( -1.340 -7.521 -16.149) 17.865 10.647 ( 1.340 -7.521 16.149) 17.865 11.089 ( -2.593 0.455 -21.221) 21.384 11.089 ( 2.593 0.455 21.221) 21.384 11.854 ( 1.162 9.336 -3.774) 10.136 11.854 ( -1.162 9.336 3.774) 10.136 12.142 ( -1.090 0.514 -0.581) 1.337 12.142 ( 1.090 0.514 0.581) 1.337 12.239 ( -2.282 -2.200 -1.181) 3.382 12.239 ( 2.282 -2.200 1.181) 3.382 12.500 ( -1.772 4.377 -8.322) 9.568 12.500 ( 1.772 4.377 8.322) 9.568 13.148 ( -1.046 -4.479 -9.211) 10.296 13.148 ( 1.046 -4.479 9.211) 10.296 13.527 ( -1.743 12.424 -15.094) 19.627 13.527 ( 1.743 12.424 15.094) 19.627 14.277 ( 0.502 -3.531 -1.750) 3.972 14.277 ( -0.502 -3.531 1.750) 3.972 14.491 ( -0.979 1.346 -5.416) 5.666 14.491 ( 0.979 1.346 5.416) 5.666 14.880 ( -0.716 1.679 -2.315) 2.948 14.880 ( 0.716 1.679 2.315) 2.948 15.406 ( 4.388 -9.128 -3.380) 10.677 15.406 ( -4.388 -9.128 3.380) 10.677 15.712 ( 3.704 8.095 -13.252) 15.964 15.712 ( -3.704 8.095 13.252) 15.964 16.262 ( -4.005 -4.038 -13.625) 14.764 16.262 ( 4.005 -4.038 13.625) 14.764 17.964 ( -7.258 4.325 -5.350) 10.000 17.964 ( 7.258 4.325 5.350) 10.000 18.235 ( -4.009 -1.649 -0.783) 4.405 18.235 ( 4.009 -1.649 0.783) 4.405 18.771 ( -0.507 1.911 -2.342) 3.065 18.771 ( 0.507 1.911 2.342) 3.065 19.283 ( -1.097 -7.697 -1.511) 7.920 19.283 ( 1.097 -7.697 1.511) 7.920 19.434 ( -0.992 3.306 -2.609) 4.326 19.434 ( 0.992 3.306 2.609) 4.326 19.816 ( 4.124 -7.253 -5.672) 10.089 19.816 ( -4.124 -7.253 5.672) 10.089 20.217 ( 0.086 2.318 -2.413) 3.347 20.217 ( -0.086 2.318 2.413) 3.347 20.315 ( 2.464 -0.884 -1.413) 2.975 20.315 ( -2.464 -0.884 1.413) 2.975 20.427 ( -4.468 0.708 0.636) 4.569 20.427 ( 4.468 0.708 -0.636) 4.569 20.563 ( -10.124 -0.010 -0.545) 10.139 20.563 ( 10.124 -0.010 0.545) 10.139 24.519 ( -0.029 2.396 -2.606) 3.541 24.519 ( 0.029 2.396 2.606) 3.541 24.633 ( -0.353 0.345 -1.708) 1.778 24.633 ( 0.353 0.345 1.708) 1.778 28.605 ( -0.116 8.383 -1.646) 8.544 28.605 ( 0.116 8.383 1.646) 8.544 29.187 ( -1.059 -7.887 -5.406) 9.620 29.187 ( 1.059 -7.887 5.406) 9.620 29.532 ( 1.098 0.590 -1.983) 2.342 29.532 ( -1.098 0.590 1.983) 2.342 29.658 ( 0.872 1.664 -0.459) 1.933 29.658 ( -0.872 1.664 0.459) 1.933 32.947 ( 0.138 0.939 -0.503) 1.074 32.947 ( -0.138 0.939 0.503) 1.074 33.050 ( -0.221 -0.904 -1.261) 1.567 33.050 ( 0.221 -0.904 1.261) 1.567 36.212 ( 0.748 19.555 -9.888) 21.926 36.212 ( -0.748 19.555 9.888) 21.926 38.048 ( -8.201 -22.315 -10.615) 26.037 38.048 ( 8.201 -22.315 10.615) 26.037 38.242 ( -2.001 6.035 -0.253) 6.363 38.242 ( 2.001 6.035 0.253) 6.363 39.168 ( -1.197 -1.635 -2.940) 3.571 39.168 ( 1.197 -1.635 2.940) 3.571 39.612 ( -0.879 8.158 -4.847) 9.530 39.612 ( 0.879 8.158 4.847) 9.530 40.012 ( -2.171 0.899 -0.221) 2.360 40.012 ( 2.171 0.899 0.221) 2.360 41.375 ( 6.675 19.993 -9.774) 23.234 41.375 ( -6.675 19.993 9.774) 23.234 43.129 ( 0.139 -3.502 -14.870) 15.277 43.129 ( -0.139 -3.502 14.870) 15.277 44.864 ( -1.702 -7.532 -7.337) 10.652 44.864 ( 1.702 -7.532 7.337) 10.652 45.539 ( -3.477 -2.931 -5.357) 7.027 45.539 ( 3.477 -2.931 5.357) 7.027 70.604 ( 0.199 19.125 -18.079) 26.318 70.604 ( -0.199 19.125 18.079) 26.318 72.889 ( -19.753 -6.338 -10.774) 23.376 72.889 ( 19.753 -6.338 10.774) 23.376 105.331 ( -1.116 1.146 -3.595) 3.934 105.331 ( 1.116 1.146 3.595) 3.934 105.606 ( -3.559 -3.330 -2.304) 5.391 105.606 ( 3.559 -3.330 2.304) 5.391 ======================= Grid point 185 (86/102) ======================= q-point: ( 0.06 0.20 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 Number of triplets: 160 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.835 ( 37.301 11.710 -21.221) 44.484 2.094 ( 39.501 11.953 20.554) 46.105 2.542 ( 11.920 17.131 -40.188) 45.284 2.671 ( 9.625 18.753 37.033) 42.612 3.072 ( 20.436 -10.660 -5.992) 23.815 3.147 ( 21.563 -7.760 8.192) 24.337 3.836 ( 9.624 3.280 -14.639) 17.823 3.951 ( 13.919 3.702 13.585) 19.799 4.033 ( 10.835 -10.010 0.066) 14.751 4.146 ( 18.833 -3.488 -3.871) 19.540 4.379 ( 9.577 10.548 -32.784) 35.746 4.499 ( 10.500 11.342 23.544) 28.164 4.642 ( 4.705 -14.804 -13.742) 20.740 4.769 ( 7.339 -6.547 21.346) 23.503 4.910 ( 16.265 16.154 -12.836) 26.273 5.020 ( 13.923 10.927 7.590) 19.257 5.511 ( 15.327 -2.279 0.770) 15.515 5.560 ( 17.977 -0.950 4.348) 18.520 5.630 ( 6.780 5.173 -4.290) 9.546 5.798 ( 9.783 -1.758 5.975) 11.598 6.141 ( -0.523 -4.224 12.808) 13.497 6.178 ( 3.294 -3.071 -6.655) 8.036 6.357 ( 0.688 1.742 0.484) 1.934 6.437 ( 4.120 1.970 -5.588) 7.217 6.576 ( -0.650 4.397 4.452) 6.291 6.671 ( 4.436 3.365 -6.958) 8.912 6.834 ( 13.032 -1.959 1.632) 13.279 6.866 ( 13.727 1.250 0.999) 13.820 7.101 ( 4.418 -14.294 8.435) 17.175 7.162 ( 8.321 -9.228 -8.446) 15.024 7.396 ( 7.324 1.316 0.629) 7.468 7.442 ( 7.085 0.910 -4.929) 8.679 7.528 ( 7.215 -4.562 2.419) 8.872 7.620 ( 7.080 2.776 5.200) 9.213 7.693 ( 3.669 -0.810 -5.587) 6.733 7.796 ( 3.637 7.164 -3.877) 8.921 7.889 ( 4.547 -8.256 12.056) 15.303 7.955 ( 6.643 2.366 -0.366) 7.061 8.119 ( 1.395 -6.242 4.285) 7.698 8.167 ( 3.741 -4.985 -3.784) 7.292 8.590 ( 1.174 0.109 -6.185) 6.296 8.703 ( -1.944 2.503 -3.431) 4.670 8.773 ( 2.794 -6.103 8.085) 10.508 8.901 ( 6.410 1.819 1.638) 6.861 8.955 ( -0.679 5.423 1.983) 5.814 9.089 ( 5.661 11.177 -5.091) 13.523 9.427 ( 2.955 -7.012 -5.764) 9.546 9.461 ( 2.276 -6.049 4.765) 8.030 9.637 ( 2.471 3.843 -4.387) 6.334 9.781 ( 6.922 8.342 5.000) 11.937 9.971 ( -4.319 -18.242 -3.263) 19.028 10.278 ( 4.758 -15.608 11.932) 20.215 10.556 ( -3.678 -7.608 -8.137) 11.731 10.705 ( 0.746 -10.312 6.123) 12.016 10.937 ( -6.719 3.007 -10.382) 12.727 11.150 ( -1.537 2.977 15.734) 16.087 11.777 ( -7.500 15.563 1.494) 17.341 11.814 ( -3.738 2.998 -3.642) 6.018 12.143 ( 4.015 -1.128 -0.249) 4.178 12.231 ( 0.278 2.038 -2.247) 3.047 12.244 ( 5.712 1.470 -3.472) 6.844 12.323 ( 3.739 -1.940 -1.541) 4.486 12.508 ( 5.051 1.999 -5.414) 7.670 12.599 ( 7.294 1.047 5.534) 9.216 13.025 ( -6.562 -2.879 -3.997) 8.205 13.165 ( -1.922 -4.525 -0.456) 4.937 13.414 ( -5.896 11.250 -7.085) 14.544 13.545 ( -3.253 9.467 15.215) 18.212 14.258 ( -1.478 -3.686 1.586) 4.277 14.285 ( 0.287 -2.796 -0.263) 2.823 14.456 ( -1.266 0.887 -5.488) 5.702 14.516 ( 0.452 1.367 4.066) 4.313 14.835 ( -2.345 1.181 -1.110) 2.851 14.903 ( 0.207 1.046 0.507) 1.180 15.275 ( -8.737 -8.984 2.698) 12.819 15.434 ( -1.045 -8.222 -4.973) 9.666 15.578 ( -11.584 8.219 13.322) 19.473 15.662 ( -7.426 5.037 -11.414) 14.520 15.908 ( -18.369 3.870 -13.137) 22.912 16.095 ( -16.757 -1.140 9.644) 19.368 17.943 ( 2.894 5.913 -6.615) 9.332 18.164 ( 7.318 3.101 6.479) 10.254 18.286 ( 7.496 0.047 -1.739) 7.695 18.438 ( 8.377 -2.779 5.959) 10.650 18.764 ( 0.887 0.187 3.292) 3.414 18.797 ( 1.762 1.911 0.644) 2.678 19.243 ( -1.461 -9.289 -1.597) 9.537 19.374 ( -0.281 5.097 -0.036) 5.104 19.400 ( 6.249 -6.138 -0.848) 8.801 19.499 ( 3.684 -2.749 0.674) 4.646 19.704 ( -5.369 -3.234 3.897) 7.381 19.868 ( 3.159 -7.066 -3.918) 8.675 20.249 ( 3.892 1.776 0.659) 4.328 20.309 ( 6.902 -0.117 -1.512) 7.067 20.361 ( 6.142 1.232 -0.843) 6.321 20.438 ( 11.757 -0.859 1.439) 11.876 20.503 ( 8.465 -0.542 0.150) 8.483 20.581 ( 20.022 -2.638 2.744) 20.381 20.728 ( 18.432 3.860 0.578) 18.841 21.037 ( 32.138 -8.383 -10.287) 34.770 24.498 ( -1.439 2.171 -1.930) 3.242 24.512 ( -1.311 2.494 2.180) 3.562 24.602 ( -2.194 0.816 -1.231) 2.645 24.620 ( -1.856 -0.125 1.123) 2.172 28.592 ( -0.129 7.699 -0.102) 7.701 28.630 ( 1.426 8.283 0.392) 8.414 29.148 ( -1.519 -7.510 -5.684) 9.540 29.209 ( -0.016 -7.832 4.685) 9.126 29.501 ( -2.307 1.200 2.514) 3.617 29.536 ( -0.346 1.035 -1.808) 2.112 29.622 ( -2.297 1.195 1.046) 2.793 29.662 ( -0.758 1.289 -0.517) 1.582 32.977 ( 3.244 1.001 0.319) 3.410 32.982 ( 3.204 1.029 -0.305) 3.379 33.101 ( 5.192 -1.941 -0.692) 5.586 33.118 ( 5.954 -1.807 0.455) 6.239 36.163 ( -3.780 18.525 -2.639) 19.090 36.187 ( -3.434 19.829 3.441) 20.416 37.728 ( -19.117 -20.205 -6.407) 28.544 38.074 ( -9.078 -13.154 5.727) 16.977 38.157 ( -5.708 -0.098 0.216) 5.713 38.285 ( 0.953 6.685 -0.426) 6.766 38.944 ( -9.894 10.638 3.900) 15.042 39.243 ( -1.458 -6.538 -4.047) 7.826 39.490 ( -5.567 -5.889 3.570) 8.855 39.712 ( 1.296 10.926 3.562) 11.565 39.946 ( -3.662 1.083 -0.761) 3.894 40.023 ( -1.542 0.392 -0.830) 1.794 41.186 ( -13.804 15.813 13.293) 24.845 41.393 ( -3.262 19.287 -7.716) 21.028 42.968 ( -12.898 -4.104 -8.769) 16.128 43.037 ( -12.131 -2.049 8.951) 15.215 44.627 ( -19.605 -6.218 -6.046) 21.438 44.683 ( -18.702 -5.557 -4.695) 20.067 45.295 ( -14.689 1.851 -3.443) 15.200 45.393 ( -16.461 -1.090 5.764) 17.475 70.486 ( -7.834 17.149 -11.898) 22.294 70.574 ( -6.484 18.015 12.263) 22.737 72.270 ( -35.864 1.430 2.646) 35.990 72.918 ( -20.112 -13.387 13.100) 27.483 105.283 ( -2.689 1.303 -3.632) 4.703 105.339 ( -0.992 0.561 2.528) 2.772 105.481 ( -6.964 -0.557 -3.894) 7.998 105.609 ( -3.468 -3.529 1.583) 5.195 ======================= Grid point 186 (87/102) ======================= q-point: ( 0.12 0.20 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 Number of triplets: 162 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.581 ( 34.825 5.475 -21.603) 41.346 2.791 ( 28.067 13.180 -32.565) 44.966 2.906 ( 23.823 10.250 26.873) 37.346 3.090 ( 28.291 13.720 24.287) 39.730 3.576 ( 28.641 -8.041 -4.616) 30.104 3.671 ( 27.527 -1.438 4.305) 27.899 4.085 ( 17.069 -2.378 -9.054) 19.467 4.288 ( 13.657 -19.965 -3.201) 24.400 4.399 ( 26.419 6.954 10.573) 29.293 4.545 ( 19.758 7.192 -25.649) 33.166 4.669 ( 26.743 -5.546 -14.622) 30.980 4.817 ( 13.214 1.809 28.344) 31.325 4.841 ( 22.052 -3.050 -9.398) 24.164 5.055 ( 16.201 -3.395 14.504) 22.008 5.252 ( 16.012 15.809 -7.284) 23.651 5.361 ( 20.161 12.678 0.743) 23.828 5.639 ( 5.895 6.254 2.041) 8.833 5.931 ( 13.917 -4.392 4.248) 15.200 6.115 ( 27.641 -1.354 0.364) 27.677 6.159 ( 17.603 2.787 8.604) 19.791 6.235 ( 16.207 -5.178 2.786) 17.241 6.244 ( 5.303 -0.356 2.020) 5.685 6.427 ( 9.049 2.739 -0.624) 9.475 6.556 ( 10.428 1.573 -4.365) 11.414 6.607 ( 4.298 4.104 1.973) 6.262 6.740 ( 4.963 -1.631 -3.951) 6.550 7.088 ( 8.256 -9.804 3.440) 13.270 7.159 ( 9.945 6.291 -0.262) 11.771 7.297 ( 14.532 -13.584 1.868) 19.980 7.386 ( 16.836 -5.269 -6.929) 18.953 7.537 ( 4.876 0.851 -10.772) 11.854 7.584 ( 7.116 3.271 -1.944) 8.069 7.746 ( 14.022 -1.985 6.669) 15.653 7.803 ( 14.319 3.031 3.640) 15.082 7.859 ( 11.526 -1.775 4.552) 12.519 7.940 ( 10.201 2.202 5.892) 11.984 8.056 ( 9.241 -5.276 6.987) 12.730 8.156 ( 13.337 -1.066 -1.551) 13.469 8.242 ( 10.587 -1.996 2.536) 11.068 8.296 ( 10.686 -1.243 -3.413) 11.287 8.584 ( -0.982 7.672 -6.097) 9.849 8.680 ( 0.628 -3.416 -8.096) 8.810 8.804 ( 1.233 -6.720 4.499) 8.181 8.938 ( 1.229 4.144 3.831) 5.776 9.040 ( 3.606 0.633 2.408) 4.382 9.167 ( 3.276 12.121 -7.517) 14.634 9.502 ( 1.525 -2.962 -7.564) 8.266 9.533 ( 7.179 -1.413 1.357) 7.441 9.726 ( 4.713 -4.517 2.984) 7.178 9.875 ( 3.025 -5.457 0.824) 6.294 10.036 ( 8.904 -8.787 10.467) 16.312 10.316 ( -2.106 -7.803 -4.134) 9.078 10.495 ( -2.344 -9.289 2.500) 9.901 10.676 ( -1.761 -12.428 -12.502) 17.716 10.857 ( -0.199 7.338 12.141) 14.187 11.134 ( -1.932 4.993 13.202) 14.246 11.584 ( -10.839 17.732 -1.616) 20.845 11.709 ( -5.660 1.612 -3.377) 6.785 12.175 ( -2.998 0.636 -4.917) 5.794 12.239 ( 1.640 2.663 -4.549) 5.520 12.294 ( 1.328 4.281 -4.762) 6.539 12.414 ( 3.996 -1.217 -0.294) 4.188 12.584 ( 1.006 -1.698 -0.480) 2.031 12.799 ( 8.736 0.429 2.698) 9.153 12.929 ( -1.218 -3.862 -1.553) 4.337 13.114 ( -2.379 -6.962 -0.803) 7.401 13.323 ( 1.423 8.266 -7.095) 10.986 13.501 ( -2.714 4.773 12.895) 14.015 14.225 ( -2.052 -3.153 1.415) 4.019 14.294 ( 0.782 -1.986 0.421) 2.176 14.419 ( -1.442 0.738 -4.451) 4.737 14.529 ( 0.387 0.890 1.820) 2.063 14.782 ( -2.753 -0.031 -0.837) 2.877 14.879 ( -2.880 -1.696 -0.396) 3.366 15.101 ( -7.854 -5.495 0.231) 9.588 15.291 ( -11.850 1.369 1.751) 12.057 15.385 ( -8.329 5.451 -3.671) 10.609 15.440 ( -8.191 1.292 -1.609) 8.447 15.653 ( -8.680 -0.369 -6.203) 10.675 15.802 ( -13.471 -0.389 7.833) 15.587 17.960 ( -0.067 8.819 -6.609) 11.021 18.253 ( -0.838 7.578 5.190) 9.223 18.423 ( 6.059 -0.661 -3.007) 6.797 18.535 ( 3.816 0.252 3.331) 5.072 18.776 ( -0.317 -0.637 1.665) 1.811 18.847 ( 1.271 1.654 3.707) 4.254 19.198 ( -2.640 -9.172 -1.617) 9.680 19.402 ( 4.917 4.634 -0.830) 6.807 19.499 ( -4.099 -8.774 0.148) 9.685 19.555 ( 7.712 1.053 0.575) 7.805 19.729 ( 6.722 -3.186 3.485) 8.215 19.949 ( 5.415 -5.965 -2.608) 8.467 20.386 ( 9.759 1.214 1.399) 9.933 20.494 ( 11.216 -1.443 0.584) 11.323 20.542 ( 12.337 1.802 -2.795) 12.777 20.690 ( 13.211 -2.476 -2.212) 13.622 20.812 ( 20.505 2.324 2.961) 20.847 21.078 ( 24.026 0.920 -2.372) 24.160 21.227 ( 28.802 -6.789 16.945) 34.099 21.641 ( 29.039 -11.853 -16.722) 35.544 24.459 ( -1.964 1.889 -1.555) 3.138 24.481 ( -2.014 2.406 2.177) 3.818 24.552 ( -2.442 0.602 0.297) 2.533 24.572 ( -2.759 -0.290 -0.277) 2.788 28.602 ( 1.095 6.568 -0.159) 6.660 28.663 ( 1.817 7.438 0.488) 7.673 29.106 ( -1.514 -6.837 -5.467) 8.884 29.205 ( -1.248 -7.351 3.771) 8.356 29.455 ( -2.815 2.069 3.118) 4.683 29.511 ( -1.695 2.338 -2.121) 3.582 29.578 ( -2.279 -0.402 1.359) 2.683 29.630 ( -2.081 0.735 -0.795) 2.346 33.071 ( 5.628 1.328 -0.221) 5.787 33.071 ( 5.872 1.244 0.403) 6.015 33.236 ( 7.937 -3.639 -0.310) 8.737 33.266 ( 8.235 -3.189 -0.028) 8.831 36.062 ( -5.695 16.890 -0.091) 17.824 36.100 ( -5.370 18.465 1.213) 19.268 37.316 ( -20.026 -15.957 -2.644) 25.742 37.733 ( -22.531 -12.011 0.885) 25.548 38.052 ( -4.882 9.042 1.559) 10.394 38.262 ( -3.250 7.381 -0.737) 8.098 38.831 ( -3.426 6.070 4.085) 8.079 39.154 ( -5.423 -4.589 -1.690) 7.302 39.370 ( -7.343 -15.249 -0.447) 16.931 39.663 ( -6.522 11.742 5.097) 14.366 39.866 ( -4.621 -2.252 -2.300) 5.631 39.951 ( -4.751 1.527 -1.326) 5.163 40.909 ( -15.938 10.649 13.269) 23.313 41.233 ( -9.946 13.586 -9.695) 19.429 42.597 ( -22.130 -3.869 -3.567) 22.747 42.693 ( -22.793 -0.807 3.632) 23.095 44.129 ( -22.464 1.016 -19.805) 29.965 44.290 ( -19.285 -2.107 5.940) 20.289 45.003 ( -15.285 0.170 3.069) 15.591 45.018 ( -20.279 -0.054 2.260) 20.404 70.261 ( -11.889 13.536 -9.394) 20.318 70.410 ( -11.958 14.597 11.096) 21.890 71.573 ( -33.797 0.592 4.388) 34.086 72.279 ( -40.605 -12.384 3.208) 42.573 105.215 ( -3.330 1.195 -2.973) 4.621 105.299 ( -3.308 -0.759 -0.777) 3.481 105.349 ( -5.266 1.639 -0.580) 5.546 105.503 ( -6.757 -2.281 1.742) 7.341 ======================= Grid point 187 (88/102) ======================= q-point: ( 0.19 0.20 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 Number of triplets: 160 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.113 ( 28.348 5.232 -32.084) 43.132 3.322 ( 26.850 8.912 -25.395) 38.017 3.409 ( 23.646 12.509 28.368) 38.991 3.694 ( 23.739 7.024 23.355) 34.034 4.126 ( 25.935 -7.891 -3.762) 27.369 4.232 ( 26.779 -1.630 2.045) 26.907 4.443 ( 18.225 -12.384 0.137) 22.034 4.547 ( 14.087 -18.809 -3.932) 23.826 4.846 ( 18.986 0.936 -14.752) 24.062 4.965 ( 20.282 -1.306 -8.598) 22.068 5.165 ( 19.158 5.708 8.200) 21.606 5.261 ( 27.485 7.640 16.242) 32.826 5.422 ( 30.266 -7.113 -3.066) 31.242 5.450 ( 22.817 4.767 1.954) 23.391 5.510 ( 17.075 12.183 -6.319) 21.907 5.774 ( 17.014 0.046 -3.092) 17.293 5.822 ( 12.991 7.020 1.408) 14.834 6.163 ( 9.703 3.119 4.765) 11.251 6.255 ( 1.120 -0.494 6.926) 7.034 6.370 ( 9.931 4.791 2.889) 11.399 6.509 ( 10.984 6.008 3.967) 13.133 6.685 ( 16.571 -0.898 -6.639) 17.874 6.725 ( 9.157 1.065 5.172) 10.570 6.846 ( 16.520 -0.359 2.458) 16.706 6.960 ( 18.177 -2.406 -2.327) 18.483 7.001 ( 32.617 -2.678 -0.883) 32.739 7.229 ( 11.317 1.107 5.464) 12.616 7.296 ( 7.257 5.481 -1.266) 9.182 7.531 ( 4.981 4.907 -12.650) 14.454 7.634 ( 13.071 -13.631 -4.556) 19.427 7.706 ( 15.552 -3.880 -3.074) 16.321 7.767 ( 8.994 -5.319 8.183) 13.272 8.030 ( 5.584 0.258 2.929) 6.311 8.090 ( 14.294 -2.602 13.390) 19.759 8.194 ( 17.453 -2.407 4.591) 18.206 8.232 ( 17.836 -3.671 -0.020) 18.210 8.324 ( 19.250 3.702 -0.761) 19.617 8.417 ( 10.545 2.099 -0.196) 10.754 8.507 ( 1.532 3.956 -8.366) 9.380 8.518 ( 14.888 0.229 -3.471) 15.289 8.590 ( 14.419 -1.810 0.954) 14.564 8.788 ( 11.670 2.756 -0.237) 11.993 8.883 ( 7.902 -5.529 1.290) 9.730 8.991 ( 2.957 3.902 -2.569) 5.529 9.113 ( 5.240 -1.248 -0.054) 5.387 9.240 ( 6.776 6.658 -5.324) 10.890 9.496 ( 1.112 -2.855 -9.765) 10.235 9.663 ( 3.572 -0.211 4.265) 5.568 9.784 ( 0.232 -5.276 8.845) 10.301 9.925 ( -0.100 -8.726 2.802) 9.165 10.243 ( 1.249 -6.004 1.382) 6.286 10.291 ( 9.477 -3.401 7.067) 12.301 10.435 ( -0.483 -6.870 -10.263) 12.360 10.648 ( -0.615 -0.972 -2.202) 2.484 10.945 ( 4.943 2.298 10.209) 11.573 11.149 ( 0.750 5.153 7.652) 9.256 11.374 ( -8.472 16.826 -3.973) 19.253 11.609 ( -2.529 -0.695 0.889) 2.769 12.073 ( -5.133 1.884 -7.086) 8.951 12.216 ( -1.659 5.996 -7.766) 9.950 12.305 ( -0.278 1.184 -2.195) 2.509 12.382 ( -5.408 -0.321 -1.445) 5.607 12.572 ( -3.406 -6.201 1.015) 7.147 12.797 ( -6.731 -1.376 -1.932) 7.136 12.977 ( 3.218 -0.099 0.564) 3.268 13.146 ( 7.373 0.887 0.928) 7.484 13.480 ( 11.598 -2.945 -4.213) 12.686 13.533 ( 4.237 0.677 9.442) 10.371 14.183 ( -2.376 -2.471 1.090) 3.597 14.322 ( 1.836 -1.719 1.085) 2.739 14.380 ( -1.579 1.197 -3.278) 3.830 14.543 ( 0.846 0.579 -0.463) 1.125 14.720 ( -3.502 -2.345 0.942) 4.319 14.790 ( -4.820 -4.270 -3.209) 7.195 14.984 ( -4.355 -0.962 -0.147) 4.463 15.100 ( -8.065 3.483 5.751) 10.499 15.200 ( -7.728 4.769 1.065) 9.144 15.332 ( -3.617 -1.634 -4.032) 5.657 15.460 ( -9.237 -4.205 -7.243) 12.468 15.589 ( -9.766 -1.895 7.590) 12.513 17.922 ( -2.153 10.848 -4.792) 12.053 18.185 ( -5.339 10.444 3.606) 12.271 18.514 ( 3.281 -2.436 -2.185) 4.634 18.614 ( 2.779 0.058 1.981) 3.413 18.768 ( -0.523 -0.438 0.750) 1.014 18.851 ( -1.107 3.567 1.834) 4.161 19.141 ( -2.693 -7.438 -1.046) 7.980 19.400 ( -5.096 -6.476 0.764) 8.276 19.559 ( 10.053 3.232 -0.596) 10.576 19.723 ( 8.883 1.784 0.435) 9.071 19.893 ( 8.261 -3.293 2.417) 9.215 20.060 ( 5.785 -4.418 -2.002) 7.549 20.637 ( 14.454 1.059 2.379) 14.686 20.754 ( 14.327 -1.663 1.244) 14.477 20.822 ( 15.714 1.608 -3.231) 16.123 20.971 ( 14.989 -2.370 -2.587) 15.394 21.260 ( 22.640 3.358 2.594) 23.034 21.529 ( 21.842 4.973 -3.705) 22.706 21.805 ( 23.644 -11.486 17.404) 31.525 22.109 ( 21.219 -10.366 -14.403) 27.661 24.419 ( -1.668 1.571 -0.454) 2.336 24.448 ( -1.580 2.057 1.906) 3.219 24.512 ( -1.781 -0.587 0.471) 1.934 24.518 ( -1.951 0.139 -0.736) 2.090 28.636 ( 2.312 5.346 -0.130) 5.826 28.704 ( 2.206 6.127 0.296) 6.519 29.065 ( -1.464 -5.893 -4.583) 7.607 29.177 ( -2.173 -6.454 2.632) 7.300 29.406 ( -2.638 2.341 3.434) 4.922 29.465 ( -2.242 2.953 -2.396) 4.415 29.535 ( -2.343 -1.351 1.305) 3.003 29.580 ( -2.618 0.128 -0.833) 2.751 33.200 ( 7.095 1.660 -0.072) 7.287 33.206 ( 7.256 1.627 0.274) 7.442 33.402 ( 8.491 -4.406 -0.309) 9.571 33.433 ( 8.190 -3.762 -0.014) 9.012 35.945 ( -5.864 14.849 1.897) 16.077 35.993 ( -5.049 14.885 -0.927) 15.745 36.938 ( -17.223 -13.467 -1.000) 21.886 37.271 ( -22.506 -7.671 -0.180) 23.778 37.964 ( -4.232 8.962 1.543) 10.031 38.159 ( -6.450 9.975 -1.537) 11.978 38.784 ( -2.441 1.070 3.048) 4.049 39.045 ( -5.162 -6.072 0.028) 7.969 39.199 ( -8.834 -15.229 -3.093) 17.876 39.507 ( -9.382 11.209 4.910) 15.420 39.728 ( -8.372 -4.564 -3.846) 10.282 39.850 ( -5.240 2.022 -0.435) 5.633 40.622 ( -15.021 6.719 11.282) 19.952 40.989 ( -11.546 7.214 -11.001) 17.504 42.099 ( -26.946 -2.542 4.384) 27.418 42.186 ( -26.583 -1.294 -3.440) 26.836 43.719 ( -14.925 5.116 -16.497) 22.827 43.953 ( -16.195 0.345 10.865) 19.505 44.618 ( -19.222 -1.329 -2.648) 19.449 44.687 ( -16.841 -2.255 4.501) 17.577 69.986 ( -13.583 10.129 -6.731) 18.232 70.159 ( -14.850 10.497 9.227) 20.392 70.940 ( -29.991 -2.173 1.688) 30.117 71.447 ( -40.533 -9.731 -1.202) 41.702 105.140 ( -3.546 0.956 -2.042) 4.202 105.212 ( -4.521 -0.783 -2.151) 5.067 105.261 ( -4.257 1.308 2.029) 4.894 105.364 ( -7.070 -1.281 1.074) 7.265 ======================= Grid point 188 (89/102) ======================= q-point: ( 0.25 0.20 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 Number of triplets: 162 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.597 ( 25.120 4.164 -29.982) 39.336 3.802 ( 28.245 8.030 -20.704) 35.929 3.962 ( 25.510 8.251 20.638) 33.834 4.162 ( 19.249 5.691 22.069) 29.832 4.574 ( 19.438 -10.808 -5.546) 22.922 4.699 ( 17.549 -7.674 7.013) 20.397 4.766 ( 15.753 -21.658 -2.529) 26.900 4.879 ( 18.346 -5.998 1.742) 19.380 5.171 ( 16.498 -0.636 -11.549) 20.148 5.296 ( 15.286 -1.509 -6.189) 16.560 5.443 ( 8.710 6.920 12.491) 16.727 5.580 ( 7.457 8.674 3.991) 12.115 5.825 ( 12.756 -0.568 -1.966) 12.919 5.921 ( 15.346 2.304 -2.365) 15.697 6.041 ( 18.739 -0.844 -6.064) 19.713 6.099 ( 26.009 7.796 -2.498) 27.267 6.215 ( 16.462 5.081 1.014) 17.258 6.286 ( 8.033 -0.369 2.996) 8.581 6.353 ( 13.218 2.481 7.321) 15.313 6.631 ( 11.862 5.046 3.974) 13.489 6.795 ( 8.747 -0.701 1.389) 8.884 6.844 ( 16.276 11.211 -2.757) 19.955 7.007 ( 4.631 13.011 2.688) 14.070 7.048 ( 7.192 1.582 7.607) 10.587 7.142 ( 13.170 -10.406 -2.199) 16.928 7.333 ( 0.783 5.531 -2.907) 6.298 7.599 ( 10.766 6.366 7.157) 14.410 7.647 ( 17.526 3.779 -0.887) 17.951 7.728 ( 18.038 -6.576 -5.445) 19.956 7.906 ( 17.948 -9.548 -7.136) 21.546 7.952 ( 9.627 -6.869 3.043) 12.211 8.074 ( 4.267 2.850 0.547) 5.160 8.086 ( 18.272 -4.684 1.453) 18.919 8.288 ( 4.310 -4.862 11.126) 12.884 8.468 ( 1.433 5.086 -2.645) 5.909 8.489 ( 12.814 -2.351 -6.571) 14.591 8.544 ( 10.502 -5.839 4.869) 12.965 8.626 ( 11.324 -3.207 -3.992) 12.428 8.791 ( 15.376 0.846 0.853) 15.423 8.801 ( 17.460 1.964 -4.400) 18.113 8.959 ( 11.977 1.019 -2.919) 12.370 9.006 ( 14.091 3.230 3.232) 14.813 9.086 ( 11.872 -0.378 -2.973) 12.244 9.175 ( 15.415 1.445 -2.604) 15.700 9.263 ( 11.398 -1.922 -4.847) 12.534 9.427 ( 12.242 -2.193 -1.695) 12.552 9.569 ( 3.430 -4.327 4.823) 7.332 9.653 ( 2.022 -3.782 2.712) 5.075 9.862 ( 6.883 4.210 6.529) 10.379 9.949 ( 5.288 -3.586 -1.380) 6.537 10.273 ( 2.381 -1.815 8.259) 8.785 10.457 ( 5.591 1.324 -5.903) 8.238 10.516 ( 4.134 -6.847 7.518) 10.977 10.653 ( 4.037 3.526 -2.580) 5.949 10.998 ( -1.454 1.382 -1.959) 2.804 11.185 ( 1.348 3.851 3.717) 5.519 11.288 ( 2.910 11.390 -6.821) 13.592 11.656 ( 5.490 -3.281 10.681) 12.449 11.959 ( -4.210 0.522 -7.949) 9.011 12.153 ( -3.286 5.528 -7.289) 9.720 12.270 ( -3.388 -1.756 -0.322) 3.830 12.296 ( -0.033 1.520 -4.114) 4.386 12.469 ( -5.081 -4.748 1.629) 7.143 12.618 ( -8.384 -6.557 -2.172) 10.863 13.087 ( 6.398 6.627 -2.630) 9.580 13.285 ( 4.689 3.970 3.153) 6.906 13.627 ( 4.824 -2.744 6.490) 8.539 13.724 ( 9.720 -6.148 -1.237) 11.568 14.138 ( -2.210 -1.749 0.944) 2.973 14.340 ( -1.721 0.653 -3.162) 3.659 14.370 ( 2.329 -1.499 1.595) 3.196 14.558 ( 0.516 2.484 -1.513) 2.954 14.652 ( -2.937 -7.038 2.429) 8.004 14.703 ( -2.781 -2.874 -4.839) 6.278 14.893 ( -5.258 -0.080 3.229) 6.171 14.989 ( -3.771 3.742 2.865) 6.036 15.100 ( -3.443 2.298 4.491) 6.108 15.254 ( -6.643 -5.788 -3.148) 9.356 15.282 ( -3.171 -2.239 -8.862) 9.675 15.429 ( -7.876 -2.585 6.105) 10.295 17.868 ( -2.088 11.754 -3.130) 12.341 18.086 ( -4.852 11.639 2.331) 12.824 18.545 ( 0.458 -3.855 -1.322) 4.101 18.647 ( 0.317 -1.339 1.212) 1.834 18.763 ( -0.277 0.209 1.434) 1.475 18.822 ( -1.722 4.272 -0.391) 4.623 19.082 ( -3.080 -6.036 -0.753) 6.818 19.303 ( -4.784 -5.765 0.827) 7.537 19.774 ( 10.835 2.728 -0.141) 11.174 19.903 ( 8.689 1.625 0.258) 8.843 20.055 ( 7.284 -2.096 1.463) 7.720 20.165 ( 4.963 -2.886 -1.341) 5.895 20.955 ( 16.224 0.949 3.268) 16.577 21.061 ( 15.673 -1.561 1.717) 15.844 21.138 ( 16.138 1.256 -3.326) 16.525 21.266 ( 14.672 -2.059 -2.595) 15.042 21.702 ( 20.534 4.020 1.338) 20.967 21.927 ( 18.176 5.592 -2.319) 19.158 22.238 ( 16.939 -9.632 10.260) 22.022 22.444 ( 15.046 -7.846 -8.929) 19.174 24.394 ( -0.813 1.293 1.354) 2.041 24.430 ( -0.526 1.412 1.085) 1.856 24.474 ( -1.110 -0.072 -3.111) 3.304 24.506 ( 0.047 -0.958 2.013) 2.230 28.692 ( 3.249 4.148 0.015) 5.269 28.752 ( 2.545 4.604 -0.083) 5.261 29.028 ( -1.444 -4.629 -3.314) 5.873 29.132 ( -2.743 -5.069 1.649) 5.995 29.366 ( -2.059 1.896 3.262) 4.299 29.416 ( -2.110 2.696 -2.293) 4.121 29.488 ( -2.568 -1.406 1.098) 3.127 29.525 ( -2.701 -0.353 -0.795) 2.838 33.346 ( 7.295 1.938 0.031) 7.548 33.354 ( 7.338 2.012 0.099) 7.609 33.567 ( 7.916 -4.220 -0.427) 8.980 33.589 ( 7.292 -3.660 0.177) 8.161 35.844 ( -4.514 12.100 2.194) 13.099 35.903 ( -3.600 10.659 -1.513) 11.352 36.623 ( -14.012 -11.498 -1.176) 18.164 36.854 ( -18.859 -5.828 0.616) 19.748 37.884 ( -4.135 8.510 0.396) 9.470 38.019 ( -6.684 12.299 -0.757) 14.019 38.741 ( -2.312 -1.691 1.953) 3.467 38.938 ( -5.963 -11.067 -0.534) 12.583 39.033 ( -6.189 -9.233 -2.689) 11.436 39.330 ( -9.006 8.238 5.194) 13.264 39.532 ( -10.073 -4.300 -3.997) 11.659 39.731 ( -6.637 1.366 -0.463) 6.792 40.363 ( -12.760 4.430 8.922) 16.188 40.743 ( -10.458 2.589 -10.558) 15.085 41.562 ( -27.411 0.081 8.177) 28.605 41.655 ( -24.730 -2.940 -5.840) 25.580 43.438 ( -10.709 6.781 -11.095) 16.845 43.677 ( -13.864 2.701 11.025) 17.918 44.251 ( -16.235 -2.989 -5.376) 17.361 44.362 ( -16.186 -3.850 4.264) 17.175 69.702 ( -13.289 7.393 -4.507) 15.861 69.870 ( -15.253 6.874 7.025) 18.145 70.386 ( -25.329 -3.339 -0.291) 25.550 70.697 ( -33.591 -7.117 -1.472) 34.368 105.066 ( -3.428 0.708 -1.132) 3.679 105.120 ( -4.214 -0.585 -0.689) 4.310 105.177 ( -4.506 0.686 1.337) 4.750 105.232 ( -6.124 -0.650 0.123) 6.159 ======================= Grid point 189 (90/102) ======================= q-point: ( 0.31 0.20 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 Number of triplets: 160 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.998 ( 21.476 6.570 -23.957) 32.838 4.359 ( 29.559 0.950 -14.419) 32.902 4.482 ( 21.789 3.126 13.797) 25.978 4.585 ( 19.212 4.898 15.294) 25.040 4.876 ( 12.208 -12.115 -7.104) 18.608 4.980 ( 11.035 -14.153 8.589) 19.896 5.083 ( 14.832 -10.769 -2.056) 18.444 5.244 ( 16.773 -2.142 4.130) 17.406 5.448 ( 12.741 -1.578 -7.793) 15.018 5.562 ( 11.917 -1.363 -2.399) 12.233 5.628 ( 8.301 5.603 8.938) 13.423 5.705 ( 6.416 4.581 -2.785) 8.361 6.032 ( 9.514 0.393 -1.452) 9.633 6.101 ( 5.690 4.278 0.527) 7.138 6.254 ( 4.362 3.000 1.327) 5.458 6.304 ( 3.758 6.163 3.201) 7.897 6.456 ( 10.383 3.916 -3.398) 11.606 6.534 ( 11.694 -1.675 1.870) 11.961 6.784 ( 11.394 5.578 3.928) 13.281 6.812 ( 2.786 4.944 -3.786) 6.822 6.943 ( 7.213 5.916 0.624) 9.350 7.031 ( 12.206 12.335 4.463) 17.918 7.199 ( 7.684 6.557 -0.366) 10.108 7.223 ( 8.466 0.146 0.226) 8.471 7.393 ( 9.795 -3.821 -3.161) 10.979 7.448 ( 13.789 -1.524 3.252) 14.249 7.676 ( -1.146 0.015 7.281) 7.370 7.769 ( -1.199 1.428 4.381) 4.761 7.916 ( -1.751 -2.397 -2.774) 4.063 8.050 ( 10.584 -7.835 -5.900) 14.430 8.180 ( 1.984 -3.914 5.807) 7.278 8.301 ( 12.114 1.346 -6.057) 13.611 8.347 ( 3.774 -2.937 -0.672) 4.829 8.413 ( 8.455 -1.379 -2.339) 8.880 8.551 ( 5.173 1.637 -0.519) 5.451 8.673 ( 2.043 -7.467 -2.354) 8.092 8.724 ( 3.288 2.978 -6.076) 7.523 8.806 ( 14.910 -2.585 4.549) 15.802 9.009 ( 11.888 3.608 -2.145) 12.607 9.092 ( -1.733 -4.854 -0.510) 5.179 9.112 ( 17.336 -1.811 -2.626) 17.627 9.229 ( 2.666 -1.281 -1.687) 3.404 9.277 ( 15.127 0.451 1.395) 15.198 9.522 ( 11.409 -2.874 1.455) 11.855 9.553 ( 18.758 1.450 1.020) 18.841 9.662 ( 15.327 1.166 2.194) 15.527 9.786 ( 20.280 -1.419 6.886) 21.464 9.898 ( 14.158 -2.230 4.380) 14.987 10.058 ( 11.266 3.742 0.537) 11.883 10.161 ( 13.585 4.972 -3.311) 14.840 10.348 ( 3.184 -1.645 8.342) 9.079 10.514 ( -2.275 2.450 12.456) 12.897 10.594 ( 8.496 0.279 -7.722) 11.485 10.745 ( 2.794 7.470 -8.493) 11.651 11.000 ( 4.728 -8.371 -7.563) 12.232 11.208 ( 2.017 0.613 0.423) 2.150 11.438 ( 10.131 6.782 1.062) 12.238 11.816 ( 6.711 -4.855 12.276) 14.810 11.890 ( -0.494 -1.821 -8.799) 8.999 12.061 ( -3.445 2.742 -6.929) 8.209 12.241 ( 0.744 -2.708 0.508) 2.854 12.323 ( 3.007 -0.685 -2.404) 3.910 12.451 ( 4.068 -0.716 0.803) 4.208 12.522 ( 1.006 -3.535 -2.960) 4.719 13.182 ( 3.381 7.804 -4.077) 9.431 13.330 ( -1.031 6.427 4.799) 8.087 13.702 ( 1.011 -3.304 3.881) 5.197 13.854 ( 2.878 -6.273 0.529) 6.922 14.101 ( -1.669 -0.578 0.663) 1.886 14.295 ( -2.074 2.041 -3.922) 4.883 14.408 ( 0.506 -4.068 3.111) 5.146 14.547 ( -0.215 2.556 -1.689) 3.071 14.649 ( 1.897 -7.697 1.074) 7.999 14.659 ( -0.614 -1.699 -4.322) 4.684 14.810 ( -3.608 0.211 5.339) 6.447 14.940 ( -2.254 2.494 -0.130) 3.364 15.049 ( -3.552 -0.605 7.330) 8.168 15.110 ( -4.603 -6.237 -6.167) 9.905 15.248 ( -0.540 -2.749 -5.727) 6.376 15.297 ( -6.376 -1.972 4.362) 7.973 17.832 ( -0.951 12.124 -2.011) 12.327 18.005 ( -3.556 12.111 1.488) 12.710 18.540 ( -0.492 -4.294 -0.805) 4.396 18.642 ( -0.936 -1.486 1.389) 2.239 18.755 ( -1.102 1.476 1.886) 2.636 18.795 ( -0.250 1.540 -2.024) 2.555 19.012 ( -3.794 -4.873 -0.755) 6.222 19.212 ( -4.509 -5.439 0.892) 7.122 19.973 ( 8.755 2.223 -0.012) 9.033 20.060 ( 6.807 1.297 0.220) 6.933 20.186 ( 5.434 -1.202 0.489) 5.587 20.250 ( 3.674 -1.703 -0.501) 4.080 21.280 ( 15.118 0.951 3.658) 15.584 21.375 ( 14.851 -1.341 2.189) 15.071 21.440 ( 14.321 0.865 -3.329) 14.728 21.536 ( 12.574 -1.594 -2.471) 12.913 22.073 ( 16.192 4.122 -0.117) 16.708 22.238 ( 13.108 5.345 -0.560) 14.167 22.540 ( 12.066 -7.090 3.283) 14.375 22.683 ( 10.155 -5.866 -3.422) 12.217 24.392 ( 0.020 1.173 3.337) 3.537 24.427 ( 0.094 1.001 -1.325) 1.663 24.465 ( 0.993 -0.103 -3.055) 3.214 24.522 ( 0.938 -1.507 2.073) 2.729 28.762 ( 3.682 3.020 0.236) 4.768 28.805 ( 2.783 3.008 -0.497) 4.128 28.994 ( -1.352 -3.121 -2.154) 4.026 29.077 ( -2.867 -3.450 1.155) 4.632 29.338 ( -1.413 1.178 2.562) 3.154 29.372 ( -1.872 2.004 -1.706) 3.230 29.439 ( -2.512 -1.044 0.912) 2.869 29.471 ( -2.417 -0.643 -0.900) 2.658 33.484 ( 6.285 2.196 0.041) 6.657 33.492 ( 6.232 2.379 0.007) 6.671 33.713 ( 6.609 -3.621 -0.527) 7.555 33.723 ( 5.970 -3.287 0.390) 6.826 35.779 ( -2.300 8.865 1.933) 9.360 35.846 ( -1.689 6.985 -1.471) 7.335 36.370 ( -10.953 -9.192 -2.055) 14.446 36.521 ( -14.691 -4.796 1.794) 15.558 37.797 ( -4.408 9.316 -0.978) 10.352 37.903 ( -4.822 12.903 0.680) 13.791 38.701 ( -1.936 -3.741 0.628) 4.259 38.811 ( -5.704 -13.654 -1.138) 14.841 38.946 ( -2.640 -4.406 -1.352) 5.312 39.178 ( -7.051 4.181 5.982) 10.148 39.320 ( -9.934 -3.307 -3.962) 11.194 39.583 ( -7.793 0.817 -0.861) 7.883 40.156 ( -9.301 3.218 6.342) 11.709 40.535 ( -8.169 -0.337 -8.980) 12.145 41.058 ( -23.981 1.803 6.200) 24.835 41.186 ( -21.021 -3.100 -2.930) 21.449 43.233 ( -7.911 7.490 -7.262) 13.093 43.440 ( -11.957 4.848 8.951) 15.703 43.955 ( -12.007 -4.524 -5.669) 14.028 44.070 ( -13.630 -4.798 3.640) 14.901 69.446 ( -11.199 5.231 -2.883) 12.693 69.591 ( -13.605 4.216 5.093) 15.127 69.933 ( -19.536 -3.142 -1.490) 19.843 70.107 ( -25.006 -4.845 -0.554) 25.477 105.002 ( -2.825 0.471 -0.296) 2.879 105.042 ( -3.571 -0.534 0.178) 3.615 105.089 ( -4.366 0.512 0.471) 4.421 105.123 ( -4.689 -0.360 -0.459) 4.725 ======================= Grid point 190 (91/102) ======================= q-point: ( 0.38 0.20 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 Number of triplets: 162 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 4.368 ( 19.487 6.069 -15.344) 25.535 4.840 ( 17.494 -1.645 2.592) 17.761 4.902 ( 18.751 -2.163 -4.896) 19.500 4.950 ( 14.403 0.572 5.471) 15.418 5.052 ( 7.392 -9.522 -5.075) 13.079 5.203 ( 9.379 -4.680 10.272) 14.676 5.337 ( 10.828 -5.654 -3.567) 12.726 5.511 ( 7.800 2.877 1.090) 8.384 5.659 ( 10.683 -4.247 0.420) 11.504 5.767 ( 8.937 -3.701 -0.970) 9.721 5.816 ( 9.631 1.983 -6.346) 11.703 5.887 ( 12.099 2.210 7.652) 14.485 6.166 ( 1.168 4.213 4.188) 6.054 6.218 ( 8.803 0.188 -1.983) 9.026 6.312 ( 2.171 8.883 4.073) 10.010 6.429 ( 6.582 2.602 -0.284) 7.084 6.526 ( 0.767 6.689 1.473) 6.892 6.710 ( -2.141 8.145 -7.617) 11.356 6.809 ( 10.166 4.056 -0.800) 10.975 6.947 ( 1.468 3.786 6.713) 7.845 7.009 ( 3.649 5.804 8.212) 10.698 7.223 ( 2.218 4.014 -1.198) 4.740 7.307 ( 5.875 -1.255 3.728) 7.070 7.442 ( 10.641 -1.469 -3.321) 11.243 7.522 ( -4.797 -5.160 -3.296) 7.778 7.590 ( 4.842 -3.302 -2.472) 6.361 7.667 ( 0.453 -3.427 -2.999) 4.576 7.718 ( -4.252 1.115 1.452) 4.629 7.866 ( -3.526 -3.278 5.908) 7.622 8.156 ( -0.684 -7.836 -1.565) 8.020 8.204 ( 1.412 0.598 1.350) 2.043 8.296 ( -3.763 -2.120 -0.657) 4.369 8.382 ( -2.781 -3.487 -0.406) 4.479 8.491 ( -4.907 4.178 -7.448) 9.849 8.631 ( 7.962 2.542 -3.638) 9.115 8.693 ( 2.269 -6.345 0.268) 6.744 8.822 ( 2.794 -1.463 3.228) 4.513 8.936 ( -6.295 -0.018 -3.875) 7.392 9.004 ( 8.960 5.115 -2.518) 10.620 9.194 ( 4.630 -0.038 1.433) 4.847 9.480 ( 19.155 0.331 -6.280) 20.160 9.520 ( 19.978 3.256 4.992) 20.848 9.596 ( 15.093 2.699 4.058) 15.860 9.717 ( 7.672 0.508 11.020) 13.437 9.886 ( 12.149 2.280 -0.857) 12.391 9.904 ( 8.664 -3.758 3.882) 10.211 10.096 ( 4.344 -1.359 -0.647) 4.598 10.165 ( 9.496 0.623 5.103) 10.799 10.304 ( 9.498 0.343 -3.667) 10.187 10.374 ( 12.290 5.242 2.145) 13.533 10.489 ( 9.708 0.002 3.558) 10.339 10.545 ( 4.599 -0.223 7.196) 8.543 10.737 ( 4.906 4.590 -11.648) 13.446 10.785 ( 6.667 5.247 -4.992) 9.844 11.095 ( 4.803 -7.310 -9.437) 12.867 11.266 ( 2.481 -2.506 3.674) 5.092 11.644 ( 8.961 0.616 1.417) 9.094 11.866 ( -0.069 -4.863 -2.527) 5.481 11.977 ( 5.830 -4.174 6.641) 9.773 12.023 ( 1.336 -1.094 -7.268) 7.470 12.321 ( 7.695 -4.346 1.196) 8.918 12.427 ( 8.668 -5.346 -0.351) 10.191 12.616 ( 11.460 4.097 -0.564) 12.183 12.679 ( 14.132 3.136 -1.466) 14.549 13.201 ( -0.545 7.879 -4.284) 8.985 13.269 ( -5.854 7.580 4.583) 10.617 13.670 ( -4.943 -3.005 1.610) 6.005 13.835 ( -4.879 -3.505 1.621) 6.222 14.074 ( -1.066 1.003 0.503) 1.548 14.236 ( -3.114 4.157 -3.180) 6.090 14.413 ( 0.430 -5.322 2.208) 5.778 14.569 ( 2.304 0.131 -1.697) 2.864 14.649 ( -0.027 -1.871 -2.592) 3.197 14.710 ( 3.607 -4.963 0.580) 6.163 14.774 ( -1.086 -0.921 4.743) 4.952 14.874 ( -3.806 -1.690 -1.215) 4.338 14.999 ( -2.290 -2.298 5.737) 6.591 15.043 ( -2.237 -5.190 -3.322) 6.556 15.185 ( -4.776 -0.909 2.116) 5.302 15.227 ( -1.384 -2.930 -4.010) 5.156 17.823 ( 0.420 12.214 -1.386) 12.300 17.948 ( -2.457 12.242 1.101) 12.534 18.530 ( -0.140 -3.687 -1.037) 3.833 18.617 ( -1.884 -0.409 2.159) 2.894 18.731 ( -1.083 2.090 0.716) 2.460 18.808 ( 1.611 -3.213 -1.651) 3.955 18.931 ( -3.828 -3.544 -0.745) 5.269 19.125 ( -4.388 -5.274 0.890) 6.918 20.119 ( 5.776 1.766 0.001) 6.040 20.172 ( 4.247 1.104 0.132) 4.390 20.274 ( 3.448 -0.639 -0.262) 3.517 20.309 ( 2.242 -0.933 0.282) 2.444 21.562 ( 11.947 0.985 3.603) 12.518 21.649 ( 11.710 -1.154 2.410) 12.011 21.686 ( 10.725 0.563 -3.234) 11.216 21.749 ( 8.978 -1.003 -2.331) 9.330 22.344 ( 11.024 3.854 -1.175) 11.738 22.447 ( 7.783 4.842 0.862) 9.207 22.742 ( 8.165 -5.220 -1.641) 9.829 22.839 ( 5.696 -4.630 0.922) 7.398 24.406 ( 0.394 1.148 4.879) 5.028 24.428 ( 0.636 1.111 -3.893) 4.098 24.494 ( 2.227 -0.630 -2.353) 3.300 24.547 ( 0.995 -1.703 1.912) 2.747 28.835 ( 3.280 2.072 0.629) 3.930 28.860 ( 2.770 1.412 -1.014) 3.271 28.966 ( -1.034 -1.626 -1.391) 2.377 29.026 ( -2.383 -2.092 1.073) 3.347 29.317 ( -1.168 0.806 1.817) 2.305 29.332 ( -1.747 1.272 -1.275) 2.509 29.397 ( -1.744 -0.662 1.250) 2.246 29.426 ( -1.815 -0.771 -1.317) 2.372 33.592 ( 4.447 2.510 -0.064) 5.107 33.599 ( 4.312 2.724 0.072) 5.100 33.826 ( 4.717 -3.041 -0.594) 5.643 33.827 ( 4.297 -2.904 0.545) 5.214 35.761 ( 0.130 5.695 1.807) 5.977 35.830 ( 0.349 3.926 -1.445) 4.198 36.174 ( -8.176 -6.456 -3.059) 10.858 36.271 ( -10.813 -4.021 2.794) 11.870 37.718 ( -3.006 10.727 -0.218) 11.143 37.820 ( -3.778 12.327 -0.057) 12.893 38.669 ( -1.158 -6.670 -0.359) 6.780 38.724 ( -2.841 -11.732 0.083) 12.071 38.905 ( -1.523 -2.001 -1.258) 2.812 39.080 ( -4.151 1.260 6.872) 8.126 39.128 ( -7.856 -3.377 -4.365) 9.600 39.422 ( -7.868 -0.336 -1.349) 7.990 40.025 ( -4.667 2.903 3.832) 6.700 40.381 ( -5.656 -2.049 -6.669) 8.981 40.643 ( -18.087 2.950 3.590) 18.675 40.809 ( -16.094 -2.482 -0.257) 16.287 43.091 ( -4.970 7.743 -4.832) 10.393 43.240 ( -9.446 6.356 6.205) 12.966 43.750 ( -7.408 -5.489 -4.551) 10.282 43.839 ( -9.985 -5.334 3.069) 11.729 69.250 ( -7.732 3.616 -1.950) 8.755 69.356 ( -10.575 2.581 3.727) 11.506 69.603 ( -12.868 -2.488 -2.270) 13.301 69.693 ( -16.411 -3.192 0.527) 16.727 104.955 ( -1.841 0.262 0.380) 1.898 104.980 ( -2.537 -0.462 0.496) 2.626 105.011 ( -3.344 0.536 -0.273) 3.398 105.041 ( -3.452 -0.292 -0.631) 3.521 ======================= Grid point 191 (92/102) ======================= q-point: ( 0.44 0.20 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 Number of triplets: 160 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 4.702 ( 15.759 3.835 -6.274) 17.390 5.062 ( 0.421 -2.779 -4.608) 5.397 5.091 ( 6.311 -2.096 -0.251) 6.655 5.117 ( 5.261 -4.686 -2.413) 7.447 5.289 ( 11.051 -1.204 5.383) 12.351 5.394 ( 8.719 0.964 7.619) 11.619 5.475 ( 3.510 -0.141 -6.627) 7.500 5.613 ( 3.073 1.859 -0.694) 3.658 5.852 ( 6.233 -2.514 4.352) 8.007 5.890 ( 3.756 -3.126 -2.963) 5.715 5.974 ( 7.977 1.586 -5.766) 9.969 6.166 ( -0.782 4.772 4.330) 6.491 6.186 ( 11.383 -3.261 3.863) 12.455 6.316 ( 0.779 -0.258 -3.666) 3.757 6.418 ( 8.502 7.544 6.382) 13.036 6.504 ( 0.375 8.115 5.835) 10.003 6.567 ( 3.802 5.158 -2.657) 6.937 6.686 ( 1.803 8.313 -4.739) 9.737 6.961 ( 4.174 1.803 1.201) 4.703 7.007 ( 4.345 2.018 6.354) 7.958 7.145 ( 8.294 2.167 7.579) 11.443 7.260 ( 3.317 -2.339 -2.014) 4.531 7.316 ( -8.828 -3.904 -3.122) 10.145 7.414 ( -3.610 -2.525 1.976) 4.828 7.495 ( -3.396 -1.436 -0.786) 3.770 7.579 ( -2.323 -5.668 -1.522) 6.312 7.607 ( -0.636 -3.628 -3.818) 5.305 7.724 ( 1.525 -5.721 -8.513) 10.370 7.788 ( -5.213 -1.091 1.001) 5.419 8.008 ( -17.532 -8.852 -1.063) 19.669 8.122 ( 0.735 -2.209 0.799) 2.461 8.261 ( -1.084 -3.738 6.160) 7.286 8.383 ( 4.708 3.588 0.846) 5.980 8.471 ( -1.147 6.236 -3.978) 7.485 8.604 ( -5.849 2.735 0.225) 6.460 8.654 ( -5.260 -0.094 -3.272) 6.195 8.888 ( 3.472 3.490 -3.087) 5.811 8.927 ( 4.474 1.830 3.733) 6.108 9.211 ( 8.914 0.698 -5.295) 10.391 9.274 ( 2.568 0.502 3.772) 4.591 9.740 ( 10.042 1.798 -10.404) 14.571 9.794 ( 3.118 1.639 16.286) 16.663 9.880 ( 10.672 1.085 3.491) 11.281 9.938 ( 9.950 1.976 10.329) 14.478 10.000 ( 3.161 -2.330 -3.190) 5.059 10.077 ( 7.854 3.506 -4.681) 9.792 10.128 ( 0.837 2.684 -3.150) 4.222 10.252 ( 1.730 8.526 7.689) 11.611 10.397 ( 2.862 -2.496 -4.252) 5.701 10.514 ( -1.092 -0.136 1.647) 1.981 10.691 ( 6.753 -0.952 1.295) 6.942 10.745 ( 11.427 0.887 3.511) 11.987 10.785 ( 4.348 3.369 -7.622) 9.399 10.952 ( 7.299 1.650 -3.345) 8.197 11.143 ( 2.918 -5.978 -7.067) 9.705 11.293 ( -0.999 -3.585 3.563) 5.152 11.770 ( 3.958 -3.717 -1.695) 5.688 11.862 ( -0.624 -4.316 0.797) 4.433 12.041 ( 3.148 -3.762 -7.522) 8.980 12.087 ( 1.816 -6.198 7.677) 10.033 12.552 ( 14.205 -2.115 -0.184) 14.362 12.659 ( 12.970 -4.898 0.692) 13.881 12.881 ( 13.621 3.378 0.014) 14.034 12.989 ( 12.082 1.442 -0.308) 12.172 13.128 ( -7.740 8.209 1.659) 11.404 13.165 ( 0.933 8.272 -2.487) 8.688 13.512 ( -10.753 -0.956 0.329) 10.801 13.676 ( -10.990 0.466 1.440) 11.094 14.065 ( 0.156 2.890 1.108) 3.099 14.160 ( -3.648 5.395 -2.305) 6.909 14.454 ( 3.248 -4.909 0.841) 5.946 14.600 ( -0.735 -2.945 -0.818) 3.144 14.641 ( 0.945 -0.807 -2.352) 2.660 14.738 ( -2.966 1.523 5.614) 6.529 14.801 ( 3.718 -3.973 -0.209) 5.445 14.843 ( 2.368 -7.443 -3.545) 8.577 14.957 ( -3.662 -2.204 5.299) 6.808 14.989 ( -2.807 -7.719 -1.278) 8.313 15.121 ( -1.409 0.688 0.937) 1.827 15.182 ( -2.288 -2.495 -3.105) 4.593 17.840 ( 1.446 12.195 -1.106) 12.330 17.908 ( -1.957 12.243 1.005) 12.439 18.532 ( 0.654 -2.164 -1.722) 2.842 18.581 ( -2.080 0.159 2.502) 3.257 18.726 ( 0.547 -0.065 0.573) 0.795 18.813 ( -2.084 -5.005 -1.437) 5.608 18.894 ( 1.613 -2.755 -0.576) 3.244 19.039 ( -4.329 -5.074 0.800) 6.717 20.206 ( 3.019 1.443 0.031) 3.346 20.231 ( 1.730 1.094 -0.004) 2.047 20.325 ( 1.798 -0.343 -0.713) 1.965 20.341 ( 0.823 -0.492 0.772) 1.231 21.764 ( 7.341 0.868 3.402) 8.137 21.834 ( 5.540 -0.485 -0.876) 5.630 21.848 ( 6.111 -0.035 -0.089) 6.112 21.880 ( 4.628 -0.461 -2.085) 5.097 22.510 ( 5.918 3.616 -1.657) 7.130 22.557 ( 3.029 4.275 1.613) 5.482 22.865 ( 4.852 -4.154 -4.297) 7.699 22.916 ( 1.612 -3.967 3.708) 5.664 24.424 ( 0.195 1.168 5.696) 5.818 24.434 ( 0.795 1.209 -5.224) 5.421 24.534 ( 2.038 -1.098 -2.097) 3.123 24.564 ( 0.248 -1.652 1.812) 2.465 28.888 ( 1.765 1.184 1.070) 2.380 28.906 ( 1.806 0.365 -1.615) 2.450 28.950 ( -0.036 -0.643 -0.800) 1.027 28.990 ( -1.472 -1.249 1.062) 2.203 29.296 ( -1.400 0.906 3.212) 3.619 29.300 ( -0.869 1.132 -3.193) 3.497 29.377 ( -0.631 -0.710 2.124) 2.327 29.394 ( -0.986 -0.827 -1.949) 2.336 33.659 ( 2.296 2.840 -0.214) 3.659 33.663 ( 2.079 2.979 0.216) 3.639 33.895 ( 2.295 -2.654 0.568) 3.555 33.896 ( 2.424 -2.673 -0.582) 3.655 35.790 ( 2.191 2.838 1.829) 4.025 35.849 ( 1.461 1.431 -1.396) 2.476 36.032 ( -4.954 -3.606 -3.773) 7.196 36.096 ( -7.368 -3.151 3.346) 8.684 37.682 ( -0.592 11.404 1.124) 11.474 37.749 ( -3.072 11.936 -1.355) 12.399 38.659 ( 0.251 -9.808 0.276) 9.815 38.690 ( -0.921 -10.028 -0.018) 10.070 38.876 ( -0.985 0.319 -0.371) 1.100 38.967 ( -5.977 1.484 -1.124) 6.260 39.078 ( 1.306 -4.759 3.026) 5.789 39.270 ( -6.850 -2.193 -1.846) 7.426 39.993 ( 0.937 3.070 1.741) 3.652 40.243 ( -8.739 -0.140 -1.531) 8.873 40.397 ( -4.918 1.168 -1.387) 5.241 40.544 ( -10.414 -1.943 1.448) 10.692 43.016 ( -1.514 7.743 -3.519) 8.638 43.094 ( -6.096 7.167 4.139) 10.279 43.639 ( -2.906 -5.824 -3.405) 7.345 43.686 ( -5.838 -5.638 2.747) 8.568 69.134 ( -3.320 2.550 -1.698) 4.518 69.190 ( -6.512 1.903 2.739) 7.317 69.410 ( -5.865 -2.009 -2.505) 6.686 69.448 ( -8.404 -2.257 1.472) 8.825 104.930 ( -0.774 0.125 0.861) 1.165 104.944 ( -1.220 -0.320 0.134) 1.269 104.959 ( -1.640 0.449 -0.289) 1.724 104.983 ( -2.223 -0.231 -0.713) 2.346 ======================= Grid point 192 (93/102) ======================= q-point: ( 0.50 0.20 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 Number of triplets: 86 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 4.954 ( -8.674 0.267 -1.889) 8.882 4.954 ( 8.674 0.267 1.889) 8.882 5.161 ( -0.868 -1.639 -1.123) 2.169 5.161 ( 0.868 -1.639 1.123) 2.169 5.439 ( -3.621 -1.053 -9.252) 9.991 5.439 ( 3.621 -1.053 9.252) 9.991 5.587 ( -4.601 3.096 -5.520) 7.825 5.587 ( 4.601 3.096 5.520) 7.825 5.916 ( 0.093 -2.710 -4.152) 4.959 5.916 ( -0.093 -2.710 4.152) 4.959 6.107 ( 2.291 3.472 -3.081) 5.176 6.107 ( -2.291 3.472 3.081) 5.176 6.296 ( 0.474 0.977 -4.670) 4.795 6.296 ( -0.474 0.977 4.670) 4.795 6.566 ( 0.741 7.020 -2.553) 7.507 6.566 ( -0.741 7.020 2.553) 7.507 6.642 ( -3.590 3.049 -1.823) 5.051 6.642 ( 3.590 3.049 1.823) 5.051 7.054 ( -4.785 -2.483 -3.374) 6.360 7.054 ( 4.785 -2.483 3.374) 6.360 7.189 ( -7.764 -1.075 -6.665) 10.288 7.189 ( 7.764 -1.075 6.665) 10.288 7.388 ( 1.780 -2.901 -7.031) 7.812 7.388 ( -1.780 -2.901 7.031) 7.812 7.461 ( -2.447 1.008 -6.271) 6.807 7.461 ( 2.447 1.008 6.271) 6.807 7.685 ( -1.881 -3.484 -4.170) 5.750 7.685 ( 1.881 -3.484 4.170) 5.750 7.726 ( -3.331 -9.318 -3.649) 10.547 7.726 ( 3.331 -9.318 3.649) 10.547 8.213 ( 2.454 -1.596 -3.311) 4.420 8.213 ( -2.454 -1.596 3.311) 4.420 8.445 ( -0.245 3.206 -4.556) 5.576 8.445 ( 0.245 3.206 4.556) 5.576 8.551 ( -2.386 4.309 -2.192) 5.392 8.551 ( 2.386 4.309 2.192) 5.392 8.957 ( 2.007 3.121 -2.790) 4.643 8.957 ( -2.007 3.121 2.790) 4.643 9.300 ( 1.110 0.070 -7.686) 7.766 9.300 ( -1.110 0.070 7.686) 7.766 9.839 ( 2.272 -0.331 -17.361) 17.512 9.839 ( -2.272 -0.331 17.361) 17.512 9.979 ( -0.548 -1.191 -2.111) 2.485 9.979 ( 0.547 -1.191 2.111) 2.485 10.094 ( -0.113 3.759 -9.382) 10.108 10.094 ( 0.113 3.759 9.382) 10.108 10.253 ( 4.087 10.569 -3.918) 11.990 10.253 ( -4.087 10.569 3.918) 11.990 10.443 ( 1.870 -3.070 -5.541) 6.605 10.443 ( -1.870 -3.070 5.541) 6.605 10.780 ( -1.491 2.067 -4.628) 5.284 10.780 ( 1.491 2.067 4.628) 5.284 10.954 ( -5.191 -1.798 -4.505) 7.105 10.954 ( 5.191 -1.798 4.505) 7.105 11.233 ( 3.389 -4.226 -4.726) 7.189 11.233 ( -3.389 -4.226 4.726) 7.189 11.829 ( -0.264 -4.570 -0.876) 4.661 11.829 ( 0.264 -4.570 0.876) 4.661 12.091 ( 2.438 -5.587 -7.303) 9.513 12.091 ( -2.438 -5.587 7.303) 9.513 12.813 ( 5.354 0.101 -3.286) 6.283 12.813 ( -5.354 0.101 3.286) 6.283 12.951 ( -3.150 -0.465 -0.436) 3.214 12.951 ( 3.150 -0.465 0.436) 3.214 13.234 ( -10.137 3.596 -1.308) 10.835 13.234 ( 10.137 3.596 1.308) 10.835 13.418 ( -9.074 4.797 -2.057) 10.468 13.418 ( 9.074 4.797 2.057) 10.468 14.093 ( -0.653 4.783 -5.298) 7.168 14.093 ( 0.653 4.783 5.298) 7.168 14.535 ( -4.109 -4.172 -0.636) 5.891 14.535 ( 4.109 -4.172 0.636) 5.891 14.682 ( 2.927 0.005 -3.600) 4.640 14.682 ( -2.927 0.005 3.600) 4.640 14.879 ( 2.924 -2.785 -2.717) 4.867 14.879 ( -2.924 -2.785 2.717) 4.867 14.917 ( 1.196 -8.202 -6.969) 10.829 14.917 ( -1.196 -8.202 6.969) 10.829 15.132 ( -0.557 -0.749 -4.218) 4.320 15.132 ( 0.557 -0.749 4.218) 4.320 17.872 ( 0.720 12.202 -1.468) 12.311 17.872 ( -0.720 12.202 1.468) 12.311 18.549 ( 1.258 -0.518 -2.781) 3.095 18.549 ( -1.258 -0.518 2.781) 3.095 18.758 ( -2.027 -2.607 -1.315) 3.554 18.758 ( 2.027 -2.607 1.315) 3.554 18.957 ( -3.361 -4.501 0.389) 5.630 18.957 ( 3.361 -4.500 -0.389) 5.630 20.242 ( -0.401 1.224 -0.247) 1.312 20.242 ( 0.401 1.224 0.247) 1.312 20.346 ( 0.466 -0.300 -0.911) 1.067 20.346 ( -0.466 -0.300 0.911) 1.067 21.863 ( -1.628 0.488 -3.251) 3.668 21.863 ( 1.628 0.488 3.251) 3.668 21.921 ( -0.451 -0.438 -2.149) 2.239 21.921 ( 0.451 -0.438 2.149) 2.239 22.578 ( 1.120 3.772 -2.026) 4.425 22.578 ( -1.120 3.772 2.026) 4.425 22.922 ( 1.743 -3.781 -5.315) 6.752 22.922 ( -1.743 -3.781 5.315) 6.752 24.435 ( 0.369 1.207 -5.798) 5.934 24.435 ( -0.369 1.207 5.798) 5.934 24.561 ( 0.752 -1.437 -3.073) 3.475 24.561 ( -0.752 -1.437 3.073) 3.475 28.912 ( -0.361 0.520 -1.590) 1.712 28.912 ( 0.361 0.520 1.590) 1.712 28.966 ( 1.191 -0.785 -0.863) 1.668 28.966 ( -1.191 -0.785 0.863) 1.668 29.285 ( 0.182 1.142 -3.062) 3.273 29.285 ( -0.182 1.142 3.062) 3.273 29.378 ( -0.208 -0.833 -2.337) 2.490 29.378 ( 0.208 -0.833 2.337) 2.490 33.683 ( 0.109 3.031 -0.692) 3.111 33.683 ( -0.109 3.031 0.692) 3.111 33.920 ( 0.070 -2.563 -1.002) 2.752 33.920 ( -0.070 -2.563 1.002) 2.752 35.845 ( -1.811 0.674 -2.083) 2.842 35.845 ( 1.811 0.674 2.083) 2.842 35.996 ( 2.680 -2.188 -3.843) 5.170 35.996 ( -2.680 -2.188 3.843) 5.170 37.697 ( -1.621 11.686 -1.812) 11.936 37.697 ( 1.621 11.686 1.812) 11.936 38.674 ( -0.519 -10.649 -1.116) 10.720 38.674 ( 0.519 -10.649 1.116) 10.720 38.882 ( -0.824 1.691 -2.373) 3.028 38.882 ( 0.824 1.691 2.373) 3.029 39.147 ( -4.488 -3.949 -2.729) 6.571 39.147 ( 4.488 -3.949 2.729) 6.571 40.072 ( -5.009 2.697 -1.656) 5.925 40.072 ( 5.009 2.697 1.656) 5.925 40.400 ( 1.924 -1.374 -3.548) 4.264 40.400 ( -1.924 -1.374 3.548) 4.264 43.017 ( 2.249 7.563 -3.308) 8.556 43.017 ( -2.249 7.563 3.308) 8.556 43.618 ( 1.475 -5.809 -2.866) 6.643 43.618 ( -1.475 -5.809 2.866) 6.643 69.113 ( 1.607 1.975 -2.040) 3.263 69.113 ( -1.607 1.975 2.040) 3.263 69.357 ( 1.091 -1.920 -2.191) 3.111 69.357 ( -1.091 -1.920 2.191) 3.111 104.927 ( -0.312 0.075 -0.916) 0.971 104.927 ( 0.312 0.075 0.916) 0.971 104.951 ( -0.704 -0.067 -0.615) 0.937 104.951 ( 0.704 -0.067 0.615) 0.937 ======================= Grid point 201 (94/102) ======================= q-point: ( 0.00 0.40 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 Number of triplets: 86 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.929 ( -4.232 23.950 -20.335) 31.702 1.929 ( 4.232 23.950 20.335) 31.702 2.441 ( -2.380 -21.587 -14.061) 25.872 2.441 ( 2.380 -21.587 14.061) 25.872 3.057 ( -0.440 25.934 -32.335) 41.453 3.057 ( 0.440 25.934 32.335) 41.453 3.587 ( 0.717 -20.592 -19.818) 28.589 3.587 ( -0.717 -20.592 19.818) 28.589 4.043 ( 2.469 12.895 -14.690) 19.702 4.043 ( -2.469 12.895 14.690) 19.702 4.328 ( -0.302 -16.377 -19.226) 25.257 4.328 ( 0.302 -16.377 19.226) 25.257 4.615 ( 0.495 9.726 -17.844) 20.329 4.615 ( -0.495 9.726 17.844) 20.329 5.121 ( 0.897 14.524 -11.345) 18.451 5.121 ( -0.897 14.524 11.345) 18.451 5.251 ( -1.699 -4.363 -5.949) 7.570 5.251 ( 1.699 -4.363 5.949) 7.570 5.748 ( -0.523 4.104 -0.785) 4.211 5.748 ( 0.523 4.104 0.785) 4.211 6.121 ( 3.750 3.575 -20.289) 20.940 6.121 ( -3.750 3.575 20.289) 20.940 6.377 ( 2.181 -2.306 -5.305) 6.182 6.377 ( -2.181 -2.306 5.305) 6.182 6.604 ( 2.759 -7.755 -6.849) 10.708 6.604 ( -2.759 -7.755 6.849) 10.708 6.698 ( -0.061 1.995 -4.494) 4.917 6.698 ( 0.061 1.995 4.494) 4.917 6.893 ( 3.114 -5.247 -13.927) 15.205 6.893 ( -3.114 -5.247 13.927) 15.205 7.243 ( -0.694 -7.377 -5.446) 9.196 7.243 ( 0.694 -7.377 5.446) 9.196 7.495 ( -4.074 0.602 -2.177) 4.659 7.495 ( 4.074 0.602 2.177) 4.659 7.571 ( 0.549 -3.727 -2.512) 4.528 7.571 ( -0.549 -3.727 2.512) 4.528 7.990 ( -0.089 5.761 -0.434) 5.778 7.990 ( 0.089 5.761 0.434) 5.778 8.114 ( 1.708 0.950 -8.326) 8.552 8.114 ( -1.708 0.950 8.326) 8.552 8.574 ( -1.466 -0.974 -5.049) 5.346 8.574 ( 1.466 -0.974 5.049) 5.346 8.811 ( -1.827 -0.723 -5.548) 5.886 8.811 ( 1.827 -0.723 5.548) 5.886 9.079 ( -0.389 0.128 -6.998) 7.010 9.079 ( 0.389 0.128 6.998) 7.010 9.315 ( 0.865 -1.479 -5.302) 5.572 9.315 ( -0.865 -1.479 5.302) 5.572 9.788 ( -0.091 -2.802 -4.579) 5.369 9.788 ( 0.091 -2.802 4.579) 5.369 9.936 ( 0.586 5.183 -2.215) 5.667 9.936 ( -0.586 5.183 2.215) 5.667 10.481 ( -1.054 -8.168 -9.550) 12.611 10.481 ( 1.054 -8.168 9.550) 12.611 11.015 ( -1.167 -3.485 -9.251) 9.955 11.015 ( 1.167 -3.485 9.251) 9.955 12.082 ( -2.226 6.393 -1.231) 6.880 12.082 ( 2.226 6.393 1.231) 6.880 12.161 ( -2.354 1.211 -0.370) 2.673 12.161 ( 2.354 1.211 0.370) 2.673 12.236 ( 0.609 2.664 -2.107) 3.450 12.236 ( -0.609 2.664 2.107) 3.450 12.624 ( 0.292 6.644 -6.393) 9.225 12.624 ( -0.292 6.644 6.393) 9.225 13.005 ( 1.372 -6.447 -4.250) 7.843 13.005 ( -1.372 -6.447 4.250) 7.843 13.596 ( -0.479 -3.812 -9.137) 9.912 13.596 ( 0.479 -3.812 9.137) 9.912 14.271 ( -0.302 1.528 -1.857) 2.424 14.271 ( 0.302 1.528 1.857) 2.424 14.466 ( -0.586 -1.738 -2.723) 3.284 14.466 ( 0.586 -1.738 2.723) 3.284 14.967 ( -1.052 5.805 -4.141) 7.208 14.967 ( 1.052 5.805 4.141) 7.208 15.227 ( -2.100 -7.360 -1.752) 7.852 15.227 ( 2.100 -7.360 1.752) 7.852 15.931 ( 1.836 11.947 -15.710) 19.822 15.931 ( -1.836 11.947 15.710) 19.822 16.147 ( -0.817 -7.893 -17.424) 19.145 16.147 ( 0.817 -7.893 17.424) 19.145 18.071 ( -4.528 5.911 -2.093) 7.735 18.071 ( 4.528 5.911 2.093) 7.735 18.184 ( -3.393 -3.719 -0.687) 5.081 18.184 ( 3.393 -3.719 0.687) 5.081 18.837 ( -0.917 4.913 -3.405) 6.047 18.837 ( 0.917 4.913 3.405) 6.047 19.059 ( -1.526 -10.905 -2.395) 11.269 19.059 ( 1.526 -10.905 2.395) 11.269 19.561 ( 0.825 7.183 -4.026) 8.276 19.561 ( -0.825 7.183 4.026) 8.276 19.694 ( 1.697 -5.913 -5.070) 7.972 19.694 ( -1.697 -5.913 5.070) 7.972 20.246 ( -0.220 0.818 -1.081) 1.374 20.246 ( 0.220 0.818 1.081) 1.374 20.296 ( 0.504 -0.807 -0.543) 1.096 20.296 ( -0.504 -0.807 0.543) 1.096 20.438 ( -1.361 0.336 0.110) 1.406 20.438 ( 1.361 0.336 -0.110) 1.406 20.564 ( -2.753 0.077 -0.235) 2.764 20.564 ( 2.753 0.077 0.235) 2.764 24.557 ( -0.086 1.257 -1.285) 1.800 24.557 ( 0.086 1.257 1.285) 1.800 24.633 ( -0.022 -0.273 -0.617) 0.675 24.633 ( 0.022 -0.273 0.617) 0.675 28.786 ( -0.519 9.449 -3.026) 9.935 28.786 ( 0.519 9.449 3.026) 9.935 29.010 ( -0.818 -9.373 -4.103) 10.264 29.010 ( 0.818 -9.373 4.103) 10.264 29.547 ( 0.499 0.606 -0.851) 1.157 29.547 ( -0.499 0.606 0.851) 1.157 29.680 ( 0.497 0.540 -0.277) 0.785 29.680 ( -0.497 0.540 0.277) 0.785 32.968 ( -0.109 0.986 -0.072) 0.995 32.968 ( 0.109 0.986 0.072) 0.995 33.029 ( -0.168 -0.962 -0.610) 1.151 33.029 ( 0.168 -0.962 0.610) 1.151 36.578 ( -0.218 14.286 -7.099) 15.954 36.578 ( 0.218 14.286 7.099) 15.954 37.578 ( -2.974 -17.357 -6.017) 18.609 37.578 ( 2.974 -17.357 6.017) 18.609 38.547 ( 3.001 16.819 -3.464) 17.432 38.547 ( -3.001 16.819 3.464) 17.432 38.998 ( 3.412 -12.633 -4.492) 13.835 38.998 ( -3.412 -12.633 4.492) 13.835 39.706 ( -2.212 1.860 -2.069) 3.555 39.706 ( 2.212 1.860 2.069) 3.555 40.011 ( 0.568 -0.521 -1.078) 1.325 40.011 ( -0.568 -0.521 1.078) 1.325 41.777 ( -3.494 15.270 -3.286) 16.005 41.777 ( 3.494 15.270 3.286) 16.005 43.032 ( -0.592 -4.915 -8.357) 9.713 43.032 ( 0.592 -4.915 8.357) 9.713 44.732 ( -0.648 -4.320 -2.079) 4.838 44.732 ( 0.648 -4.320 2.079) 4.838 45.498 ( -1.129 -1.125 -2.455) 2.927 45.498 ( 1.129 -1.125 2.455) 2.927 70.915 ( 0.228 9.682 -10.092) 13.987 70.915 ( -0.228 9.682 10.092) 13.987 72.777 ( -7.270 -3.832 -4.422) 9.332 72.777 ( 7.270 -3.832 4.422) 9.332 105.353 ( -0.561 0.819 -1.793) 2.050 105.353 ( 0.561 0.819 1.793) 2.050 105.550 ( -1.356 -1.821 -1.626) 2.793 105.550 ( 1.356 -1.821 1.626) 2.793 ======================= Grid point 203 (95/102) ======================= q-point: ( 0.06 0.40 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 Number of triplets: 160 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.171 ( 28.809 21.383 -16.313) 39.412 2.382 ( 31.653 14.359 16.415) 38.439 2.655 ( 24.407 -16.557 -10.336) 31.252 2.772 ( 23.576 -10.629 6.147) 26.582 3.087 ( 11.448 18.929 -24.202) 32.789 3.218 ( 9.189 23.258 29.199) 38.444 3.622 ( 6.464 -24.252 -15.703) 29.606 3.696 ( 7.617 -17.974 16.338) 25.456 4.160 ( 11.412 11.195 7.653) 17.723 4.227 ( 18.664 10.956 -13.354) 25.430 4.376 ( 9.843 -11.885 -11.942) 19.513 4.492 ( 12.706 -14.818 2.771) 19.715 4.680 ( 8.518 13.811 -18.389) 24.525 4.749 ( 8.364 6.783 21.495) 24.041 5.202 ( 13.269 11.512 -1.542) 17.634 5.279 ( 12.600 8.325 0.588) 15.113 5.457 ( 20.780 0.010 0.776) 20.795 5.525 ( 21.308 -1.854 5.591) 22.107 5.768 ( 2.337 4.098 1.526) 4.958 5.789 ( 4.329 3.688 3.817) 6.849 6.094 ( -0.076 2.086 10.546) 10.750 6.208 ( 7.727 3.201 -8.731) 12.091 6.355 ( 0.998 -0.648 -4.436) 4.593 6.452 ( 4.038 -0.256 -5.120) 6.526 6.584 ( -1.535 -8.699 6.440) 10.931 6.649 ( 0.940 -7.129 -7.921) 10.698 6.765 ( 4.281 -4.192 9.026) 10.834 6.784 ( 10.675 -2.758 -6.786) 12.947 6.967 ( 10.429 0.033 4.812) 11.485 7.004 ( 11.088 -5.204 -7.900) 14.575 7.309 ( 8.305 -4.378 0.953) 9.437 7.373 ( 9.463 -8.728 3.710) 13.397 7.510 ( 6.255 6.204 0.022) 8.810 7.655 ( 9.092 -7.764 6.589) 13.651 7.675 ( 9.847 0.536 -2.849) 10.265 7.679 ( 10.978 0.198 0.899) 11.016 7.965 ( -0.710 6.914 -1.271) 7.065 8.022 ( 2.330 2.820 -0.071) 3.658 8.104 ( 0.805 1.623 7.291) 7.513 8.147 ( 3.406 -0.953 -3.614) 5.057 8.600 ( 3.208 1.436 -2.838) 4.517 8.637 ( 0.819 -4.342 8.732) 9.787 8.759 ( -0.976 3.036 -8.216) 8.813 8.874 ( 3.933 -5.776 -0.504) 7.006 9.075 ( 1.899 6.945 -2.925) 7.772 9.208 ( 10.029 -4.171 -1.462) 10.960 9.334 ( 1.387 0.766 6.514) 6.704 9.371 ( 5.046 -2.030 2.750) 6.095 9.741 ( -2.653 -2.892 -0.042) 3.925 9.789 ( -0.462 3.203 -4.168) 5.277 9.872 ( -1.140 5.771 8.865) 10.640 10.078 ( 7.854 -5.811 -1.328) 9.859 10.381 ( -5.383 -4.976 -12.803) 14.753 10.488 ( -1.068 -11.187 -7.930) 13.754 10.978 ( -1.123 3.075 6.865) 7.606 11.073 ( 1.154 -6.342 13.663) 15.108 12.000 ( -5.182 9.228 -4.099) 11.349 12.054 ( -5.233 5.685 -1.977) 7.976 12.169 ( 1.480 6.331 0.757) 6.545 12.256 ( 4.798 -0.584 -0.941) 4.924 12.266 ( 4.693 1.265 -0.756) 4.919 12.296 ( 4.989 -1.477 0.434) 5.221 12.627 ( 1.863 7.669 -6.832) 10.439 12.651 ( 2.723 3.716 4.032) 6.122 12.925 ( -5.432 -3.909 0.929) 6.756 12.994 ( -2.280 -9.347 -3.972) 10.408 13.521 ( -4.900 -0.068 -5.435) 7.318 13.573 ( -4.426 -5.238 10.013) 12.136 14.251 ( -1.137 2.552 -0.105) 2.795 14.283 ( 0.229 0.591 2.060) 2.155 14.438 ( -1.561 -0.800 -2.670) 3.195 14.471 ( -0.644 -3.491 2.997) 4.646 14.907 ( -3.247 5.206 -4.568) 7.649 14.966 ( -2.425 2.230 -0.046) 3.295 15.152 ( -3.804 -0.905 1.018) 4.041 15.261 ( -0.119 -8.710 0.818) 8.750 15.800 ( -11.663 10.865 1.842) 16.045 15.804 ( -11.846 8.678 -0.288) 14.687 15.916 ( -14.884 -2.348 -13.392) 20.159 16.013 ( -14.485 -7.567 12.956) 20.855 18.089 ( 5.094 8.156 -2.902) 10.045 18.203 ( 6.974 -2.068 0.841) 7.323 18.304 ( 11.440 3.354 0.222) 11.924 18.378 ( 11.324 -3.437 2.740) 12.147 18.808 ( -1.303 5.062 -0.102) 5.228 18.866 ( 1.707 4.832 3.778) 6.367 19.018 ( -1.811 -10.229 -4.100) 11.168 19.112 ( 4.214 -14.638 0.239) 15.234 19.512 ( -2.787 6.600 1.936) 7.422 19.582 ( -0.165 3.742 0.130) 3.748 19.644 ( -0.708 -1.423 2.673) 3.110 19.735 ( 3.019 -6.521 -2.028) 7.467 20.277 ( 3.980 1.219 0.509) 4.193 20.298 ( 5.108 -0.916 0.232) 5.194 20.385 ( 7.814 1.265 -1.758) 8.109 20.412 ( 9.766 -1.557 -0.873) 9.927 20.511 ( 11.246 1.112 1.776) 11.440 20.539 ( 14.488 -1.781 1.968) 14.729 20.802 ( 20.018 4.031 -1.971) 20.515 20.894 ( 24.755 -5.910 -4.876) 25.914 24.536 ( -1.587 1.621 -1.042) 2.496 24.548 ( -1.218 0.782 0.487) 1.527 24.608 ( -2.188 0.002 0.411) 2.226 24.614 ( -1.887 -0.378 0.309) 1.949 28.767 ( -0.572 9.479 -2.021) 9.709 28.808 ( 0.822 8.959 2.145) 9.249 28.982 ( -1.030 -8.483 -4.091) 9.474 29.031 ( 0.297 -9.775 3.571) 10.411 29.529 ( -1.489 1.396 1.565) 2.572 29.546 ( -0.519 -0.196 -0.114) 0.566 29.651 ( -2.251 1.491 0.035) 2.700 29.670 ( -1.339 -0.391 -0.669) 1.547 33.002 ( 3.464 1.255 0.019) 3.685 33.005 ( 3.598 1.114 -0.109) 3.768 33.067 ( 3.897 -1.107 -0.364) 4.067 33.078 ( 4.425 -1.938 0.539) 4.861 36.518 ( -4.149 15.205 -5.486) 16.688 36.560 ( -3.442 13.577 6.426) 15.410 37.385 ( -13.475 -9.800 -5.477) 17.538 37.545 ( -7.937 -23.616 3.330) 25.136 38.473 ( -5.009 18.678 3.438) 19.642 38.575 ( 0.373 15.234 -3.271) 15.585 38.904 ( -6.515 -9.773 4.440) 12.556 39.026 ( -0.002 -15.929 -3.500) 16.309 39.536 ( -11.230 9.130 -0.945) 14.504 39.706 ( -3.794 -6.896 -0.555) 7.890 39.984 ( -2.230 1.746 1.005) 3.005 40.017 ( -0.770 -1.307 -0.331) 1.553 41.573 ( -15.486 18.908 2.169) 24.536 41.708 ( -10.818 7.411 4.726) 13.939 42.893 ( -11.660 -1.672 -4.344) 12.555 42.950 ( -10.854 -5.964 7.198) 14.325 44.541 ( -15.763 -1.743 -5.772) 16.877 44.572 ( -14.793 -4.589 -4.703) 16.186 45.332 ( -13.470 1.885 -0.255) 13.604 45.366 ( -13.908 -1.637 3.097) 14.343 70.795 ( -9.535 11.664 -5.664) 16.095 70.851 ( -8.075 6.882 4.648) 11.583 72.361 ( -30.860 9.086 2.276) 32.250 72.616 ( -23.674 -16.090 6.892) 29.442 105.314 ( -2.586 1.666 -3.241) 4.468 105.339 ( -1.963 -0.744 -1.071) 2.357 105.486 ( -4.374 1.453 0.301) 4.618 105.536 ( -3.118 -3.505 2.424) 5.280 ======================= Grid point 204 (96/102) ======================= q-point: ( 0.12 0.40 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 Number of triplets: 162 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.809 ( 33.459 16.467 -13.668) 39.718 3.037 ( 27.663 3.744 -2.680) 28.043 3.157 ( 22.114 15.415 -10.449) 28.910 3.261 ( 30.540 -2.211 -1.872) 30.677 3.498 ( 21.984 -0.666 17.140) 27.884 3.579 ( 25.379 5.086 11.584) 28.358 3.775 ( 11.668 -21.417 -9.372) 26.128 3.955 ( 14.662 -16.081 15.053) 26.461 4.504 ( 20.520 5.202 -0.884) 21.187 4.641 ( 16.723 -8.273 -13.901) 23.266 4.698 ( 28.666 6.822 -16.253) 33.651 4.805 ( 22.031 3.075 -19.941) 29.874 4.927 ( 19.183 5.607 3.074) 20.221 5.034 ( 16.581 1.957 25.303) 30.315 5.534 ( 14.729 11.995 5.783) 19.856 5.601 ( 16.641 9.815 2.739) 19.513 5.793 ( 5.520 6.236 6.833) 10.772 5.864 ( 13.338 -2.462 3.103) 13.914 6.066 ( 25.337 -3.062 -1.352) 25.557 6.114 ( 25.188 -5.717 0.911) 25.844 6.207 ( 14.197 7.931 4.329) 16.829 6.369 ( 6.881 10.934 -7.569) 14.973 6.480 ( 17.765 -2.685 -0.240) 17.968 6.520 ( 5.631 -4.322 -2.925) 7.678 6.603 ( 3.943 -7.133 1.829) 8.353 6.680 ( 5.177 -3.570 -5.582) 8.409 6.853 ( 3.704 -4.456 10.535) 12.024 6.968 ( 9.272 -17.679 -13.060) 23.855 7.291 ( 17.761 4.835 3.086) 18.664 7.340 ( 20.387 -0.116 -1.690) 20.457 7.526 ( 10.751 -1.026 1.885) 10.963 7.591 ( 11.090 -3.511 -4.118) 12.340 7.740 ( 15.096 5.580 2.930) 16.359 7.859 ( 9.115 4.532 -1.702) 10.321 7.903 ( 11.927 -5.387 6.448) 14.589 7.938 ( 14.138 -1.725 2.758) 14.507 7.998 ( 4.791 6.560 2.810) 8.596 8.132 ( 9.589 -3.602 5.459) 11.607 8.232 ( 11.420 0.830 3.322) 11.922 8.267 ( 9.737 -2.215 -3.007) 10.428 8.621 ( 0.751 -1.583 -2.432) 2.998 8.656 ( 1.355 -4.652 3.481) 5.966 8.757 ( 2.329 8.807 -8.520) 12.473 8.939 ( 2.705 -6.952 -3.459) 8.223 9.113 ( 1.323 8.936 1.539) 9.163 9.325 ( -0.240 -8.749 2.184) 9.021 9.445 ( 6.975 3.857 -1.693) 8.149 9.504 ( 5.952 2.254 3.385) 7.209 9.741 ( 2.816 0.965 3.881) 4.891 9.778 ( 1.151 5.030 -2.535) 5.749 9.937 ( 6.070 -2.385 11.616) 13.322 10.173 ( -2.534 -20.187 -2.820) 20.540 10.296 ( 4.823 3.977 -12.060) 13.583 10.438 ( 0.287 -9.981 -17.950) 20.540 11.005 ( 1.349 7.140 16.206) 17.761 11.125 ( 1.384 -4.675 15.872) 16.604 11.846 ( -8.927 8.617 -6.418) 13.970 11.874 ( -11.059 8.058 -3.590) 14.147 12.214 ( 0.656 4.617 -0.080) 4.664 12.302 ( 0.612 2.323 -2.818) 3.703 12.339 ( 0.997 -2.868 -0.093) 3.038 12.372 ( 1.974 -1.774 -2.208) 3.453 12.640 ( -1.985 8.761 -2.851) 9.424 12.792 ( 8.429 -2.861 -0.691) 8.928 12.850 ( -0.923 -1.773 0.110) 2.002 12.938 ( 1.432 -9.362 -3.497) 10.096 13.421 ( -2.664 2.662 -2.571) 4.560 13.498 ( -3.775 -4.649 8.564) 10.450 14.225 ( -1.522 3.406 0.443) 3.756 14.290 ( -0.080 -0.763 2.836) 2.938 14.401 ( -1.330 -0.451 -2.681) 3.026 14.459 ( -1.027 -5.261 2.798) 6.047 14.826 ( -3.761 3.132 -4.648) 6.750 14.875 ( -5.650 -0.627 -1.835) 5.974 15.088 ( -3.211 4.806 2.652) 6.359 15.225 ( -3.591 -6.960 0.932) 7.888 15.514 ( -13.565 5.398 -7.165) 16.263 15.555 ( -12.700 10.696 6.873) 17.970 15.611 ( -12.876 -3.925 -8.485) 15.912 15.735 ( -14.197 -6.856 9.520) 18.417 18.172 ( 2.765 11.633 -3.639) 12.499 18.343 ( 5.698 -4.514 -0.720) 7.305 18.452 ( 1.727 7.138 -0.119) 7.345 18.534 ( 4.397 -1.117 2.352) 5.110 18.791 ( -0.590 3.836 2.517) 4.626 18.928 ( 2.507 2.436 4.388) 5.611 18.983 ( -0.296 -5.972 -4.045) 7.219 19.210 ( 3.291 -16.658 0.305) 16.983 19.507 ( 3.088 5.403 0.338) 6.232 19.586 ( 3.261 -1.672 0.916) 3.778 19.718 ( 6.245 3.437 1.068) 7.208 19.824 ( 6.072 -6.479 -1.325) 8.978 20.418 ( 9.863 2.000 1.420) 10.164 20.459 ( 10.502 -2.119 1.123) 10.772 20.583 ( 12.595 2.457 -2.599) 13.093 20.636 ( 13.012 -2.913 -2.257) 13.524 20.876 ( 22.356 4.359 4.580) 23.233 20.986 ( 26.368 -7.069 6.535) 28.071 21.247 ( 23.505 6.414 -2.777) 24.522 21.412 ( 26.641 -10.605 -8.976) 30.047 24.495 ( -2.128 1.781 -1.089) 2.981 24.516 ( -1.838 0.365 -0.055) 1.874 24.554 ( -3.184 0.234 1.480) 3.519 24.567 ( -2.682 -0.431 0.160) 2.721 28.758 ( 0.188 8.935 -1.804) 9.117 28.828 ( 0.768 8.192 2.011) 8.471 28.954 ( -0.865 -7.495 -4.001) 8.540 29.036 ( -0.447 -9.497 2.985) 9.965 29.496 ( -2.142 2.056 2.172) 3.679 29.527 ( -1.353 -0.872 0.375) 1.652 29.595 ( -3.097 2.007 -0.274) 3.701 29.628 ( -2.573 -1.019 -1.110) 2.982 33.100 ( 6.148 1.776 0.176) 6.402 33.108 ( 6.466 1.838 -0.034) 6.723 33.174 ( 6.586 -2.071 -0.376) 6.914 33.197 ( 6.964 -3.439 0.351) 7.775 36.396 ( -6.751 15.543 -4.323) 17.488 36.472 ( -6.529 13.430 6.025) 16.103 37.056 ( -17.261 -5.563 -5.652) 18.995 37.299 ( -16.215 -24.526 2.900) 29.544 38.368 ( -5.862 19.906 2.829) 20.943 38.547 ( -2.594 16.203 -2.970) 16.676 38.769 ( -7.366 -11.552 4.087) 14.297 38.977 ( -4.372 -19.622 -3.474) 20.401 39.303 ( -10.737 14.008 -0.853) 17.670 39.583 ( -7.769 -12.754 -0.147) 14.935 39.915 ( -5.032 3.591 0.888) 6.245 39.967 ( -4.101 -1.251 -0.423) 4.309 41.220 ( -19.357 17.700 5.440) 26.788 41.413 ( -17.843 0.686 2.267) 18.000 42.553 ( -21.090 0.766 -2.589) 21.263 42.628 ( -21.870 -5.249 3.482) 22.759 44.166 ( -17.571 2.874 -10.845) 20.847 44.232 ( -16.488 -3.588 -2.097) 17.004 45.009 ( -18.286 0.415 2.696) 18.488 45.016 ( -20.200 -0.235 2.398) 20.344 70.535 ( -14.690 12.153 -4.497) 19.589 70.631 ( -14.269 4.144 4.634) 15.564 71.666 ( -36.835 10.894 2.892) 38.521 71.970 ( -38.467 -18.077 3.213) 42.625 105.244 ( -3.528 1.719 -3.074) 4.985 105.276 ( -3.649 -1.519 -2.786) 4.836 105.392 ( -5.073 2.709 2.044) 6.103 105.449 ( -5.673 -3.048 2.339) 6.852 ======================= Grid point 205 (97/102) ======================= q-point: ( 0.19 0.40 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 Number of triplets: 160 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.342 ( 24.474 17.605 -21.404) 36.973 3.521 ( 25.850 9.108 -15.691) 31.582 3.649 ( 23.762 7.469 10.224) 26.925 3.784 ( 21.544 -6.213 -2.988) 22.620 3.955 ( 21.972 -5.224 4.768) 23.082 4.034 ( 15.475 -13.743 10.434) 23.178 4.153 ( 24.826 -0.909 6.472) 25.672 4.325 ( 18.509 -12.379 13.658) 26.122 4.870 ( 16.927 1.920 -13.970) 22.031 4.931 ( 16.931 -3.502 -16.664) 24.013 5.240 ( 24.964 3.446 -0.090) 25.201 5.327 ( 24.990 -4.214 -1.537) 25.390 5.389 ( 25.547 7.234 5.381) 27.092 5.494 ( 20.972 -2.012 6.258) 21.978 5.816 ( 17.769 15.575 12.483) 26.723 5.887 ( 10.796 6.561 2.335) 12.847 6.001 ( 17.600 11.389 -10.059) 23.252 6.141 ( 11.415 -4.971 3.476) 12.927 6.292 ( 4.779 3.526 5.351) 7.994 6.372 ( 9.652 -6.241 -0.644) 11.512 6.572 ( 9.200 5.298 -0.072) 10.617 6.693 ( 12.461 -0.698 0.042) 12.481 6.763 ( 17.433 0.390 -2.034) 17.555 6.840 ( 12.342 -0.384 -2.611) 12.621 6.937 ( 30.394 -0.146 -1.396) 30.426 6.981 ( 23.730 2.497 4.780) 24.335 7.072 ( 24.281 -8.066 5.675) 26.208 7.166 ( 14.538 -19.088 -8.193) 25.354 7.587 ( 10.405 7.832 0.603) 13.038 7.667 ( 11.467 3.635 -3.797) 12.614 7.703 ( 3.493 2.215 -7.794) 8.824 7.723 ( 10.552 1.972 -0.079) 10.735 8.024 ( 8.382 -1.292 4.874) 9.782 8.053 ( 6.366 -1.188 9.220) 11.267 8.163 ( 14.132 0.651 5.176) 15.064 8.202 ( 15.148 0.356 0.274) 15.154 8.302 ( 17.667 -4.879 5.765) 19.213 8.340 ( 11.561 -6.816 -1.038) 13.461 8.526 ( 16.482 -0.032 1.545) 16.554 8.540 ( 17.500 0.891 -0.553) 17.532 8.728 ( 5.406 11.454 -6.628) 14.295 8.782 ( 12.037 -2.311 0.625) 12.273 8.802 ( 10.168 -0.310 -2.749) 10.538 8.971 ( 1.301 -8.184 -6.931) 10.803 9.159 ( 4.278 7.011 3.492) 8.925 9.312 ( -0.235 -4.536 4.669) 6.513 9.490 ( 0.315 2.511 -6.427) 6.907 9.561 ( -1.470 -1.973 4.295) 4.950 9.790 ( 3.535 0.073 -3.966) 5.313 9.848 ( 2.900 2.586 0.579) 3.928 10.125 ( 6.017 -5.512 5.928) 10.086 10.167 ( 8.338 -7.598 8.885) 14.359 10.388 ( 5.540 1.742 -11.938) 13.275 10.487 ( 6.641 -8.817 -10.626) 15.321 11.098 ( 4.121 8.558 16.243) 18.816 11.203 ( 2.871 -1.362 13.238) 13.614 11.631 ( -11.233 7.145 -4.086) 13.926 11.644 ( -8.570 3.839 -7.512) 12.026 12.150 ( -5.635 5.896 -3.074) 8.715 12.274 ( -5.387 -5.788 -2.339) 8.246 12.305 ( -0.319 3.652 -3.938) 5.380 12.383 ( -0.501 -2.664 -2.528) 3.707 12.527 ( -7.710 5.776 -0.848) 9.671 12.690 ( -9.776 -8.004 -1.170) 12.689 13.026 ( 10.921 3.687 -1.523) 11.627 13.107 ( 11.411 -4.184 -0.527) 12.166 13.448 ( 5.470 0.563 -0.992) 5.588 13.501 ( 2.804 -3.730 6.388) 7.911 14.191 ( -1.879 4.041 0.856) 4.538 14.289 ( -0.682 -3.448 2.619) 4.383 14.381 ( -0.051 0.471 -1.960) 2.016 14.448 ( -0.445 -6.330 1.692) 6.567 14.740 ( -4.017 1.680 -2.756) 5.153 14.759 ( -5.060 0.263 -2.495) 5.648 15.022 ( -4.076 5.009 2.369) 6.879 15.131 ( -5.618 -3.224 1.732) 6.705 15.278 ( -9.114 2.779 -1.216) 9.606 15.338 ( -10.194 1.354 -2.503) 10.584 15.379 ( -8.082 0.419 -2.769) 8.553 15.508 ( -10.173 -6.629 6.568) 13.805 18.180 ( -0.846 14.227 -2.879) 14.540 18.402 ( -0.391 -1.467 0.614) 1.637 18.426 ( -1.878 4.462 -1.260) 5.002 18.580 ( 0.087 -4.605 0.459) 4.629 18.797 ( 0.566 4.474 2.543) 5.178 18.946 ( -0.526 -7.658 2.410) 8.046 18.987 ( -0.070 6.996 -1.924) 7.256 19.210 ( -2.376 -12.339 0.089) 12.566 19.641 ( 9.339 4.857 0.258) 10.530 19.726 ( 9.034 -2.928 0.662) 9.519 19.870 ( 8.338 2.533 0.658) 8.739 19.958 ( 7.234 -5.515 -1.139) 9.168 20.668 ( 14.309 2.107 2.254) 14.638 20.713 ( 14.265 -2.431 1.750) 14.576 20.863 ( 15.443 2.544 -2.984) 15.933 20.917 ( 15.211 -2.958 -2.662) 15.723 21.360 ( 23.862 7.181 4.981) 25.412 21.535 ( 25.655 -9.859 6.588) 28.263 21.696 ( 21.337 7.011 -2.173) 22.564 21.886 ( 22.248 -11.500 -8.843) 26.560 24.453 ( -1.791 1.845 -0.544) 2.628 24.482 ( -1.296 -0.046 -0.981) 1.626 24.497 ( -2.744 0.307 2.045) 3.435 24.516 ( -2.233 -0.600 0.335) 2.336 28.768 ( 1.112 7.803 -1.538) 8.031 28.848 ( 0.798 7.459 1.770) 7.707 28.932 ( -0.508 -6.729 -3.614) 7.655 29.027 ( -0.968 -8.595 2.277) 8.944 29.455 ( -2.439 2.466 2.525) 4.290 29.495 ( -1.889 -1.405 0.765) 2.476 29.530 ( -3.236 2.166 -0.743) 3.964 29.568 ( -2.975 -1.406 -1.424) 3.585 33.241 ( 7.638 2.591 0.203) 8.068 33.254 ( 7.803 2.850 0.157) 8.309 33.320 ( 7.885 -3.378 -0.502) 8.593 33.347 ( 7.785 -4.468 0.221) 8.979 36.242 ( -7.645 14.582 -2.862) 16.711 36.334 ( -8.143 13.599 5.012) 16.624 36.705 ( -15.947 -5.482 -5.262) 17.665 36.952 ( -18.029 -21.299 2.652) 28.031 38.259 ( -5.392 19.871 1.817) 20.669 38.456 ( -5.753 18.695 -2.404) 19.707 38.645 ( -5.598 -16.793 3.723) 18.089 38.840 ( -7.971 -19.649 -4.113) 21.600 39.126 ( -6.977 13.220 -0.055) 14.948 39.411 ( -9.072 -14.035 0.144) 16.713 39.785 ( -8.003 5.345 0.884) 9.664 39.859 ( -6.377 -1.935 -0.294) 6.671 40.853 ( -17.899 14.824 5.053) 23.783 41.053 ( -17.508 -3.319 -0.510) 17.827 42.073 ( -25.434 0.903 -0.915) 25.467 42.131 ( -26.815 -3.960 -0.488) 27.110 43.838 ( -13.056 6.383 -9.110) 17.152 43.933 ( -13.227 -2.950 1.468) 13.631 44.604 ( -20.559 0.386 0.425) 20.567 44.636 ( -19.244 -2.623 3.603) 19.753 70.209 ( -16.573 11.111 -3.025) 20.181 70.320 ( -17.257 2.120 4.683) 18.006 70.959 ( -33.295 6.879 0.449) 34.001 71.197 ( -37.340 -14.923 0.418) 40.214 105.164 ( -3.844 1.418 -2.091) 4.600 105.191 ( -4.181 -1.290 -2.105) 4.855 105.294 ( -5.177 1.934 1.899) 5.844 105.332 ( -6.169 -1.949 1.540) 6.650 ======================= Grid point 206 (98/102) ======================= q-point: ( 0.25 0.40 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 Number of triplets: 162 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.779 ( 24.000 14.728 -22.027) 35.750 3.982 ( 23.298 8.247 -12.035) 27.489 4.119 ( 20.953 1.204 5.974) 21.822 4.168 ( 19.542 -9.707 -9.713) 23.884 4.360 ( 17.992 -6.019 -0.546) 18.980 4.400 ( 17.120 -6.012 21.090) 27.821 4.604 ( 19.162 -1.566 6.719) 20.366 4.731 ( 19.022 -9.934 12.159) 24.666 5.172 ( 16.166 1.561 -12.736) 20.639 5.232 ( 15.823 -4.206 -10.560) 19.482 5.553 ( 7.365 5.238 12.519) 15.440 5.632 ( 5.779 -2.008 10.640) 12.273 5.860 ( 18.727 3.245 -5.502) 19.786 5.932 ( 22.954 -3.153 -3.331) 23.408 6.094 ( 10.047 5.675 -0.743) 11.563 6.200 ( 9.592 -2.644 -2.833) 10.345 6.347 ( 15.316 10.630 -3.560) 18.980 6.370 ( 5.918 8.938 4.091) 11.474 6.490 ( 23.833 6.474 2.162) 24.791 6.638 ( 16.495 -6.444 1.147) 17.746 6.830 ( 14.210 6.622 5.479) 16.607 6.940 ( 8.518 -0.921 3.247) 9.163 6.973 ( 10.868 -1.184 -1.789) 11.078 7.054 ( 13.012 -1.725 -2.705) 13.401 7.310 ( 9.685 4.514 3.499) 11.243 7.414 ( 10.991 -5.812 -0.109) 12.434 7.490 ( 16.206 2.737 -3.355) 16.774 7.646 ( 12.317 -3.354 -7.825) 14.973 7.750 ( 6.449 3.428 -4.385) 8.519 7.784 ( 19.358 -1.286 4.377) 19.888 7.915 ( 8.483 5.444 3.463) 10.658 8.055 ( 21.077 -0.839 -0.579) 21.102 8.104 ( 7.756 -1.349 -4.229) 8.937 8.178 ( 7.258 -6.269 13.204) 16.320 8.415 ( 7.429 -4.077 -4.261) 9.485 8.425 ( 7.656 -4.603 0.814) 8.970 8.535 ( 10.011 3.015 3.699) 11.090 8.648 ( 6.029 -2.487 3.332) 7.324 8.735 ( 6.637 5.211 -3.252) 9.044 8.890 ( 19.110 3.188 -2.445) 19.528 8.918 ( 7.285 -4.348 -2.440) 8.827 8.987 ( 17.170 -4.090 -2.111) 17.776 9.119 ( 15.905 3.002 -1.233) 16.233 9.181 ( 16.443 -2.109 -0.460) 16.584 9.285 ( 4.475 3.404 -2.527) 6.164 9.345 ( 7.812 -3.942 0.770) 8.784 9.527 ( 5.486 -0.365 3.186) 6.354 9.561 ( 6.299 -4.106 3.142) 8.150 9.918 ( 10.653 2.561 -5.176) 12.118 9.956 ( 10.053 0.788 -0.524) 10.098 10.268 ( 6.029 2.168 8.384) 10.551 10.364 ( 7.227 -6.746 5.301) 11.218 10.509 ( 7.484 3.023 -1.181) 8.157 10.599 ( 6.770 -5.931 -3.682) 9.724 11.146 ( -4.895 9.749 2.148) 11.118 11.242 ( -1.756 0.426 4.121) 4.500 11.473 ( -0.767 6.570 -4.126) 7.796 11.573 ( 2.935 -4.884 5.603) 7.992 12.019 ( -5.777 5.651 -5.839) 9.970 12.145 ( -5.862 -6.117 -5.726) 10.226 12.295 ( -0.157 3.305 -2.298) 4.028 12.361 ( -7.199 3.694 -0.497) 8.107 12.370 ( 0.695 -2.378 -2.346) 3.412 12.494 ( -7.939 -6.356 -0.509) 10.182 13.221 ( 8.376 6.373 -1.507) 10.632 13.309 ( 8.030 -2.063 0.546) 8.309 13.576 ( 5.640 -1.062 2.181) 6.140 13.615 ( 6.541 -4.589 1.810) 8.193 14.157 ( -1.574 4.494 1.214) 4.915 14.273 ( -1.284 -5.441 1.790) 5.870 14.388 ( 0.792 1.046 -0.966) 1.629 14.451 ( 0.700 -6.736 0.060) 6.773 14.652 ( -4.074 2.254 -0.270) 4.664 14.676 ( -2.755 -0.486 -3.524) 4.499 14.933 ( -5.036 4.295 1.860) 6.875 15.031 ( -4.364 -2.419 1.840) 5.318 15.132 ( -6.602 -0.231 3.408) 7.433 15.146 ( -7.432 -1.312 -2.133) 7.842 15.265 ( -3.290 1.769 -4.610) 5.933 15.351 ( -6.784 -5.290 3.805) 9.407 18.146 ( -1.623 15.412 -1.644) 15.584 18.342 ( -3.737 12.400 0.542) 12.962 18.410 ( -0.752 -9.510 -0.691) 9.564 18.559 ( -1.534 -8.016 -0.900) 8.211 18.811 ( -0.041 4.723 2.296) 5.251 18.932 ( -1.353 -4.959 1.806) 5.448 18.958 ( -2.166 6.090 -1.662) 6.674 19.146 ( -3.686 -9.916 0.002) 10.579 19.843 ( 10.067 4.113 0.299) 10.879 19.911 ( 8.882 -1.945 0.425) 9.103 20.036 ( 7.743 1.387 0.329) 7.873 20.096 ( 6.459 -3.885 -0.806) 7.581 20.982 ( 16.102 1.860 3.004) 16.485 21.023 ( 15.870 -2.208 2.354) 16.195 21.172 ( 15.664 2.154 -3.175) 16.128 21.219 ( 15.139 -2.587 -2.855) 15.622 21.821 ( 20.723 8.324 3.343) 22.582 22.012 ( 20.568 -9.635 3.977) 23.059 22.079 ( 17.051 6.964 -1.328) 18.466 22.262 ( 16.864 -10.212 -6.046) 20.621 24.426 ( -0.851 1.881 0.987) 2.288 24.459 ( -1.431 0.286 2.178) 2.622 24.463 ( -0.325 -0.204 -2.673) 2.700 24.485 ( -0.818 -1.095 0.484) 1.450 28.795 ( 1.883 6.191 -1.265) 6.594 28.867 ( 0.820 6.733 1.309) 6.908 28.920 ( -0.010 -5.997 -2.819) 6.626 29.009 ( -1.145 -7.165 1.632) 7.437 29.411 ( -2.416 2.468 2.600) 4.323 29.455 ( -2.540 -2.039 2.039) 3.843 29.467 ( -2.585 2.465 -2.101) 4.144 29.506 ( -2.831 -1.561 -1.611) 3.612 33.398 ( 7.752 3.355 0.128) 8.448 33.411 ( 7.689 3.671 0.204) 8.523 33.480 ( 7.977 -4.320 -0.538) 9.088 33.502 ( 7.478 -4.788 0.234) 8.883 36.089 ( -6.878 12.378 -1.388) 14.228 36.178 ( -7.976 13.084 3.507) 15.719 36.410 ( -12.362 -6.922 -4.391) 14.833 36.616 ( -15.675 -16.939 2.104) 23.174 38.162 ( -4.576 19.126 0.611) 19.675 38.326 ( -6.314 18.234 -0.827) 19.314 38.555 ( -4.363 -19.095 2.311) 19.723 38.671 ( -7.513 -15.991 -3.063) 17.931 39.008 ( -4.977 8.441 -0.070) 9.799 39.232 ( -8.601 -12.288 0.077) 14.999 39.608 ( -9.631 7.066 1.137) 11.999 39.715 ( -7.937 -3.550 -0.148) 8.696 40.536 ( -14.487 12.142 3.564) 19.235 40.728 ( -14.408 -5.623 -2.198) 15.622 41.563 ( -25.038 0.577 1.933) 25.119 41.597 ( -25.374 -2.695 -2.973) 25.689 43.594 ( -9.947 8.209 -6.201) 14.310 43.701 ( -10.689 -1.774 3.274) 11.319 44.211 ( -18.234 0.166 -1.507) 18.297 44.270 ( -17.736 -4.980 3.307) 18.717 69.874 ( -16.021 9.180 -1.981) 18.571 69.979 ( -17.371 0.847 4.229) 17.898 70.355 ( -26.697 3.072 -1.223) 26.901 70.515 ( -30.424 -10.773 -0.279) 32.276 105.084 ( -3.733 1.073 -1.026) 4.017 105.105 ( -4.041 -0.991 -0.856) 4.248 105.195 ( -4.980 1.053 1.032) 5.193 105.215 ( -5.594 -1.038 0.562) 5.718 ======================= Grid point 207 (99/102) ======================= q-point: ( 0.31 0.40 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 Number of triplets: 160 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 4.192 ( 21.109 13.464 -18.820) 31.321 4.420 ( 22.659 4.553 -9.109) 24.842 4.499 ( 17.992 -13.101 -8.998) 24.007 4.541 ( 17.689 -3.576 -1.787) 18.135 4.689 ( 14.881 -0.934 4.235) 15.500 4.781 ( 16.202 -5.677 17.881) 24.788 4.979 ( 17.629 2.447 5.585) 18.654 5.131 ( 18.493 -9.424 9.057) 22.646 5.441 ( 12.125 2.053 -7.585) 14.449 5.507 ( 12.526 -3.981 -4.873) 14.017 5.691 ( 6.056 2.414 8.077) 10.380 5.729 ( 3.778 -1.027 4.622) 6.057 6.136 ( 9.824 7.596 -2.633) 12.694 6.218 ( 7.649 3.225 -0.854) 8.345 6.297 ( 8.368 1.805 0.958) 8.614 6.388 ( 9.282 -3.014 5.429) 11.168 6.485 ( 8.693 4.179 -0.702) 9.671 6.540 ( 6.988 1.812 -2.343) 7.590 6.902 ( 10.165 6.485 1.277) 12.124 6.941 ( 5.203 3.635 0.952) 6.418 7.012 ( 10.744 4.200 -3.253) 11.986 7.123 ( 6.854 -6.479 -1.903) 9.622 7.171 ( 12.504 2.870 -0.878) 12.859 7.289 ( 7.344 -5.012 1.794) 9.070 7.432 ( -0.727 5.986 -0.702) 6.070 7.546 ( 2.659 4.836 -0.176) 5.522 7.660 ( 7.749 3.395 1.059) 8.526 7.813 ( 0.997 7.697 -2.232) 8.076 7.880 ( 11.730 -8.954 -5.635) 15.796 7.935 ( -1.144 2.351 5.516) 6.105 8.070 ( 8.533 -4.487 7.706) 12.342 8.199 ( 0.368 -8.600 -2.895) 9.082 8.329 ( 0.173 0.803 -1.598) 1.796 8.444 ( 4.061 -9.111 -0.522) 9.989 8.527 ( 8.227 3.973 -1.440) 9.249 8.570 ( 6.233 -0.098 -3.100) 6.962 8.739 ( 8.343 2.148 -0.254) 8.619 8.823 ( 19.207 -1.349 5.234) 19.953 8.959 ( 5.930 -1.130 2.257) 6.445 9.043 ( 19.732 -4.702 2.321) 20.417 9.131 ( -1.082 3.651 -6.566) 7.591 9.187 ( 3.727 -2.394 -2.165) 4.930 9.330 ( 18.830 4.919 -2.143) 19.579 9.441 ( 16.282 -5.590 -2.125) 17.346 9.588 ( 17.012 2.780 0.121) 17.239 9.653 ( 14.816 -3.026 2.571) 15.338 9.778 ( 18.210 2.189 6.350) 19.409 9.841 ( 16.268 -3.490 5.203) 17.432 10.157 ( 13.015 5.459 -6.587) 15.575 10.229 ( 15.397 -0.531 -3.942) 15.902 10.361 ( 1.807 4.196 9.732) 10.751 10.464 ( 1.605 -5.052 9.884) 11.216 10.668 ( 9.068 5.111 -2.542) 10.715 10.779 ( 10.783 -5.931 -1.806) 12.438 11.003 ( -5.820 9.765 -6.589) 13.139 11.169 ( -2.715 -5.517 -3.059) 6.868 11.559 ( 5.939 6.044 3.582) 9.200 11.690 ( 4.998 -7.379 9.390) 12.946 11.916 ( -2.633 4.506 -8.176) 9.699 12.029 ( -4.013 -5.840 -8.531) 11.090 12.238 ( -1.859 2.951 1.587) 3.832 12.297 ( -1.131 -2.324 0.250) 2.597 12.450 ( 8.309 0.685 -1.359) 8.447 12.474 ( 6.999 -1.665 -1.879) 7.435 13.340 ( 3.604 7.317 -1.375) 8.271 13.413 ( 1.896 0.643 1.433) 2.462 13.657 ( 1.761 -0.137 1.645) 2.413 13.721 ( 3.179 -6.336 0.236) 7.093 14.139 ( -0.463 4.989 1.385) 5.198 14.254 ( -0.520 -5.428 0.739) 5.502 14.391 ( -0.691 1.807 0.213) 1.946 14.479 ( 2.111 -7.817 -1.407) 8.218 14.590 ( -1.733 2.144 -1.255) 3.029 14.629 ( -1.267 -1.710 -2.413) 3.217 14.844 ( -3.983 3.703 2.102) 5.831 14.954 ( -4.162 -6.692 1.726) 8.067 15.004 ( -5.145 2.803 1.798) 6.129 15.049 ( -4.229 -1.218 3.985) 5.937 15.209 ( -1.624 -0.283 -5.607) 5.844 15.245 ( -4.430 -3.080 1.150) 5.517 18.117 ( -0.966 15.795 -0.453) 15.831 18.274 ( -2.901 13.633 -0.191) 13.939 18.393 ( -0.672 -10.259 0.383) 10.289 18.528 ( -1.103 -10.155 -1.747) 10.363 18.802 ( -1.159 4.070 1.713) 4.565 18.899 ( -2.398 4.231 0.586) 4.898 18.902 ( -2.806 -2.126 -0.672) 3.585 19.069 ( -3.931 -8.795 0.185) 9.635 20.027 ( 7.981 3.034 0.133) 8.539 20.072 ( 6.913 -0.936 0.213) 6.980 20.173 ( 5.768 0.651 0.109) 5.806 20.208 ( 4.790 -2.386 -0.279) 5.358 21.306 ( 15.140 1.689 3.414) 15.612 21.342 ( 15.033 -1.900 2.815) 15.412 21.464 ( 13.839 1.592 -3.209) 14.295 21.499 ( 13.208 -2.013 -2.880) 13.667 22.192 ( 15.713 8.012 1.000) 17.666 22.365 ( 12.563 -4.068 2.851) 13.509 22.377 ( 14.447 2.467 -2.130) 14.810 22.538 ( 11.685 -8.541 -2.558) 14.698 24.423 ( 0.007 1.864 3.193) 3.697 24.448 ( -0.161 0.420 1.552) 1.616 24.459 ( 0.796 -0.010 -3.819) 3.901 24.486 ( 0.710 -1.962 -0.148) 2.092 28.835 ( 2.306 4.266 -1.038) 4.959 28.886 ( 0.802 5.019 0.472) 5.105 28.920 ( 0.456 -4.208 -1.568) 4.513 28.990 ( -1.085 -5.298 1.216) 5.543 29.371 ( -2.068 1.977 2.440) 3.760 29.402 ( -2.808 -0.265 1.192) 3.062 29.421 ( -1.834 0.570 -1.229) 2.280 29.450 ( -2.385 -1.492 -1.723) 3.299 33.544 ( 6.676 3.923 -0.051) 7.743 33.556 ( 6.523 4.034 0.211) 7.672 33.630 ( 6.920 -4.621 -0.520) 8.337 33.642 ( 6.376 -4.632 0.365) 7.889 35.967 ( -5.012 9.606 -0.219) 10.837 36.040 ( -6.214 10.713 1.958) 12.538 36.192 ( -8.657 -7.079 -3.371) 11.680 36.342 ( -12.006 -12.658 1.511) 17.511 38.077 ( -3.913 18.710 -0.258) 19.116 38.213 ( -4.870 18.073 0.353) 18.721 38.468 ( -4.533 -20.346 -0.140) 20.845 38.545 ( -4.524 -14.233 -0.292) 14.937 38.926 ( -3.161 4.625 -0.370) 5.614 39.078 ( -6.526 -9.452 -0.096) 11.486 39.414 ( -9.792 7.944 1.431) 12.690 39.544 ( -8.896 -4.971 -0.242) 10.193 40.293 ( -10.305 10.075 2.339) 14.600 40.472 ( -10.576 -6.807 -2.762) 12.877 41.092 ( -22.091 1.553 2.095) 22.245 41.127 ( -20.821 -2.457 -2.073) 21.068 43.408 ( -7.592 9.288 -4.228) 12.719 43.514 ( -8.769 0.238 3.953) 9.622 43.878 ( -14.310 -1.056 -2.817) 14.623 43.951 ( -14.582 -6.654 2.768) 16.266 69.572 ( -13.498 6.978 -1.319) 15.252 69.658 ( -15.143 0.146 3.377) 15.516 69.888 ( -19.593 0.864 -1.844) 19.699 69.985 ( -22.433 -7.089 -0.030) 23.526 105.014 ( -3.116 0.747 -0.170) 3.209 105.029 ( -3.414 -0.760 0.010) 3.498 105.101 ( -4.420 0.678 0.213) 4.477 105.114 ( -4.553 -0.610 -0.144) 4.596 ======================= Grid point 208 (100/102) ======================= q-point: ( 0.38 0.40 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 Number of triplets: 162 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 4.539 ( 16.806 11.440 -12.285) 23.754 4.790 ( 12.275 -13.453 -9.073) 20.346 4.822 ( 17.649 -0.365 -5.441) 18.472 4.852 ( 14.090 -2.953 -4.512) 15.086 4.994 ( 14.515 3.482 7.686) 16.789 5.103 ( 12.912 -6.531 10.586) 17.929 5.329 ( 15.366 5.645 2.088) 16.503 5.486 ( 14.797 -8.840 3.479) 17.584 5.606 ( 5.549 3.581 -1.551) 6.783 5.687 ( 6.548 -4.330 0.442) 7.862 5.852 ( 8.692 1.565 0.327) 8.838 5.884 ( 11.400 -1.675 4.800) 12.482 6.256 ( 2.283 5.039 3.318) 6.450 6.306 ( 2.460 2.138 -1.511) 3.592 6.460 ( 6.859 7.433 3.705) 10.771 6.516 ( 4.442 5.045 5.848) 8.910 6.642 ( 5.615 3.742 0.940) 6.813 6.735 ( 11.703 -6.448 -4.409) 14.070 6.928 ( -2.218 8.984 -2.666) 9.630 6.996 ( 1.559 1.634 1.427) 2.672 7.123 ( 0.284 5.782 2.408) 6.269 7.236 ( 4.410 -5.318 3.652) 7.815 7.327 ( 0.371 -3.074 -5.843) 6.613 7.363 ( -2.827 -7.789 -6.593) 10.590 7.418 ( 2.880 6.463 -6.243) 9.436 7.552 ( 3.478 -2.762 -2.291) 4.997 7.728 ( -8.270 4.927 0.474) 9.638 7.733 ( -2.703 3.080 -0.851) 4.186 7.853 ( -6.371 2.682 9.184) 11.495 7.996 ( -2.365 -9.653 -1.477) 10.048 8.150 ( -2.969 -2.573 4.640) 6.079 8.191 ( -2.136 -5.677 4.184) 7.368 8.380 ( 6.060 2.664 -5.105) 8.360 8.475 ( 4.781 -5.532 -5.069) 8.897 8.647 ( 4.519 1.679 -1.303) 4.994 8.674 ( 3.659 0.201 -1.720) 4.048 8.835 ( 3.391 3.069 4.938) 6.731 8.906 ( -1.625 -3.320 3.058) 4.797 9.113 ( 6.456 6.043 -7.068) 11.320 9.192 ( 5.401 -1.402 -4.559) 7.206 9.502 ( 24.012 2.268 0.103) 24.119 9.550 ( 22.686 -1.546 2.814) 22.912 9.666 ( 14.223 4.720 4.870) 15.758 9.723 ( 10.619 -0.513 8.532) 13.631 9.849 ( 8.509 -1.127 -0.768) 8.618 9.879 ( 9.370 -3.222 -1.808) 10.072 10.094 ( 8.477 2.353 2.415) 9.123 10.149 ( 12.771 -2.262 5.742) 14.184 10.352 ( 5.642 4.522 -4.759) 8.656 10.442 ( 9.428 -2.579 2.750) 10.154 10.494 ( 7.991 2.604 -2.273) 8.706 10.531 ( 5.939 -0.761 9.248) 11.017 10.828 ( 6.651 5.005 -7.571) 11.252 10.922 ( 2.083 0.412 -7.635) 7.925 10.976 ( 5.741 3.389 -1.650) 6.868 11.159 ( 1.423 -8.764 -0.572) 8.897 11.673 ( 4.175 3.018 4.336) 6.733 11.767 ( 0.550 -5.751 5.307) 7.845 11.903 ( 3.078 -0.477 -3.516) 4.697 11.961 ( -0.633 -4.732 -8.781) 9.995 12.303 ( 8.205 2.027 1.721) 8.625 12.355 ( 7.523 -2.901 1.174) 8.148 12.680 ( 13.825 2.412 -0.764) 14.055 12.705 ( 14.970 -0.135 -0.612) 14.983 13.354 ( -1.938 6.352 -0.904) 6.702 13.390 ( -4.306 3.094 1.063) 5.408 13.646 ( -2.981 1.443 -0.094) 3.313 13.732 ( -2.168 -6.336 -0.093) 6.697 14.144 ( 0.690 6.204 1.447) 6.408 14.263 ( 1.434 -4.171 -1.108) 4.548 14.365 ( -1.789 3.554 1.543) 4.267 14.510 ( 0.466 -10.047 -0.321) 10.063 14.588 ( 2.303 0.020 -3.193) 3.937 14.614 ( 0.295 -1.836 -2.973) 3.507 14.786 ( -2.472 2.727 2.983) 4.737 14.877 ( -3.672 -4.556 3.057) 6.602 14.924 ( -4.043 1.016 2.290) 4.756 14.975 ( -4.136 -2.611 4.526) 6.663 15.163 ( -2.110 -0.643 -3.821) 4.412 15.178 ( -2.134 -1.872 -2.145) 3.558 18.108 ( 0.128 15.685 0.412) 15.691 18.225 ( -2.016 14.282 -0.579) 14.435 18.390 ( 0.319 -10.032 0.751) 10.065 18.508 ( -0.715 -11.249 -1.935) 11.436 18.779 ( -1.267 2.849 1.160) 3.327 18.837 ( -2.981 4.601 -0.930) 5.561 18.856 ( -2.127 -2.173 0.693) 3.118 18.991 ( -3.912 -8.029 0.324) 8.937 20.159 ( 5.204 2.110 -0.036) 5.615 20.185 ( 4.409 -0.228 0.042) 4.415 20.267 ( 3.609 0.245 -0.056) 3.618 20.285 ( 2.951 -1.361 0.202) 3.256 21.588 ( 11.925 1.632 3.423) 12.513 21.621 ( 11.841 -1.697 2.959) 12.322 21.702 ( 10.351 1.038 -3.110) 10.858 21.725 ( 9.716 -1.318 -2.788) 10.194 22.452 ( 10.378 7.047 -0.883) 12.575 22.559 ( 7.018 3.952 1.307) 8.160 22.620 ( 9.817 -4.567 -1.837) 10.982 22.721 ( 6.793 -7.169 0.395) 9.884 24.436 ( 0.403 1.780 4.499) 4.855 24.453 ( 0.527 0.953 -0.738) 1.316 24.479 ( 1.745 -0.477 -2.638) 3.198 24.506 ( 1.203 -2.298 -0.693) 2.685 28.880 ( 2.248 2.294 -0.892) 3.333 28.902 ( 0.783 2.472 -0.250) 2.605 28.929 ( 0.567 -1.584 -0.510) 1.758 28.972 ( -0.909 -3.306 1.089) 3.597 29.340 ( -1.547 1.307 2.368) 3.116 29.354 ( -1.981 0.425 0.007) 2.026 29.385 ( -1.574 0.002 -0.069) 1.576 29.405 ( -1.771 -1.359 -1.886) 2.922 33.660 ( 4.822 4.300 -0.271) 6.466 33.669 ( 4.610 4.295 0.320) 6.309 33.748 ( 4.957 -4.619 -0.533) 6.796 33.755 ( 4.663 -4.375 0.485) 6.412 35.890 ( -2.735 6.735 0.501) 7.286 35.943 ( -3.693 6.766 0.969) 7.769 36.045 ( -5.497 -5.386 -2.855) 8.208 36.141 ( -8.318 -8.726 1.246) 12.120 38.010 ( -2.572 18.614 0.165) 18.792 38.127 ( -3.954 18.273 -0.420) 18.700 38.391 ( -2.780 -19.319 0.256) 19.520 38.475 ( -2.856 -16.024 0.049) 16.277 38.884 ( -0.845 2.424 -0.617) 2.640 38.981 ( -2.857 -6.629 -0.111) 7.220 39.228 ( -8.901 7.715 1.614) 11.889 39.363 ( -8.971 -5.633 -0.514) 10.606 40.139 ( -5.414 8.227 1.540) 9.969 40.296 ( -6.484 -6.886 -2.490) 9.780 40.703 ( -16.751 2.998 1.030) 17.048 40.757 ( -15.780 -2.718 -0.423) 16.018 43.274 ( -4.933 9.887 -3.056) 11.463 43.365 ( -6.932 3.521 3.925) 8.710 43.634 ( -9.230 -3.666 -3.334) 10.476 43.703 ( -10.529 -7.785 2.350) 13.304 69.338 ( -9.478 4.914 -0.937) 10.717 69.398 ( -11.242 0.077 2.461) 11.508 69.562 ( -12.661 -0.258 -1.883) 12.803 69.614 ( -14.697 -4.414 0.400) 15.351 104.961 ( -2.077 0.441 0.403) 2.161 104.971 ( -2.349 -0.511 0.435) 2.443 105.022 ( -3.364 0.610 -0.358) 3.438 105.033 ( -3.412 -0.513 -0.506) 3.487 ======================= Grid point 209 (101/102) ======================= q-point: ( 0.44 0.40 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 Number of triplets: 160 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 4.807 ( 11.456 6.811 -4.543) 14.080 4.951 ( 5.153 -7.643 -4.109) 10.092 5.056 ( 6.723 -0.711 -3.692) 7.703 5.066 ( 7.558 -1.378 -3.860) 8.598 5.283 ( 11.541 1.549 5.056) 12.695 5.345 ( 9.448 -4.118 4.188) 11.124 5.559 ( 7.630 7.178 -0.632) 10.495 5.686 ( 2.697 5.039 0.109) 5.716 5.721 ( 7.937 -8.812 -0.170) 11.861 5.794 ( 3.521 -5.788 0.107) 6.775 6.050 ( 9.630 4.294 1.364) 10.632 6.124 ( 10.482 -3.430 2.979) 11.424 6.263 ( -1.599 4.539 1.838) 5.151 6.318 ( -0.446 -0.737 -1.441) 1.679 6.602 ( 6.703 7.848 4.115) 11.111 6.633 ( 6.456 8.802 7.541) 13.267 6.707 ( -0.339 5.421 2.188) 5.856 6.845 ( -2.541 -2.563 -0.753) 3.687 6.938 ( 6.025 3.736 -3.427) 7.874 7.023 ( 1.591 1.120 2.583) 3.234 7.142 ( -1.089 -0.774 -0.292) 1.367 7.218 ( -1.594 -7.550 -4.182) 8.777 7.273 ( -3.432 -0.084 2.113) 4.031 7.327 ( -0.152 -3.787 -2.615) 4.605 7.442 ( 0.680 -0.699 -9.103) 9.156 7.506 ( -8.787 -0.781 -6.541) 10.982 7.576 ( -4.965 -0.038 1.058) 5.076 7.631 ( -0.930 -5.349 0.756) 5.481 7.761 ( -6.002 1.269 3.841) 7.238 7.845 ( -12.393 -6.717 0.409) 14.102 8.115 ( 1.811 1.266 1.587) 2.721 8.171 ( -0.344 -4.479 4.620) 6.444 8.461 ( 3.718 4.688 -0.904) 6.052 8.539 ( 0.673 -1.850 -2.621) 3.278 8.642 ( -2.986 2.712 -0.684) 4.092 8.668 ( -3.123 0.293 -1.738) 3.586 8.958 ( 6.535 3.706 1.403) 7.643 8.984 ( 6.004 2.105 3.102) 7.079 9.224 ( 4.999 1.115 -4.715) 6.962 9.263 ( 2.146 -2.006 -0.717) 3.023 9.792 ( 7.472 3.630 -7.491) 11.186 9.835 ( 3.329 1.816 6.366) 7.410 9.874 ( 6.035 -1.496 0.731) 6.261 9.911 ( 2.033 -3.462 4.375) 5.938 10.036 ( 13.362 5.046 6.738) 15.792 10.122 ( 15.186 -2.264 0.214) 15.355 10.204 ( 2.951 6.069 2.288) 7.126 10.310 ( 3.494 -3.695 10.928) 12.053 10.431 ( 3.589 7.589 -7.168) 11.039 10.564 ( 0.746 0.805 -8.488) 8.559 10.641 ( 8.108 -0.801 4.361) 9.241 10.718 ( 9.201 -3.244 3.809) 10.474 10.878 ( 0.448 4.887 -7.374) 8.857 10.963 ( 0.717 -2.954 -6.254) 6.953 11.066 ( 4.669 1.954 -0.438) 5.081 11.182 ( 0.171 -7.453 0.453) 7.468 11.731 ( 1.431 -0.019 0.970) 1.729 11.768 ( -0.499 -3.822 2.146) 4.412 11.963 ( 1.964 -3.215 -5.771) 6.892 11.970 ( 1.980 -4.126 2.607) 5.267 12.552 ( 15.125 1.427 0.569) 15.203 12.590 ( 14.385 -2.504 0.859) 14.626 12.939 ( 8.894 2.546 0.445) 9.262 12.981 ( 8.171 -1.681 0.540) 8.359 13.277 ( -4.215 5.341 -0.401) 6.816 13.295 ( -0.955 3.650 -0.630) 3.825 13.544 ( -6.918 4.070 -0.851) 8.071 13.637 ( -7.120 -4.365 -0.265) 8.356 14.174 ( 2.029 8.049 1.537) 8.442 14.280 ( -0.785 4.410 -3.030) 5.408 14.356 ( 1.746 -2.881 2.141) 3.992 14.492 ( -2.346 -9.487 1.296) 9.858 14.627 ( 2.229 -0.177 -4.360) 4.900 14.658 ( 4.448 -4.387 -4.085) 7.465 14.747 ( -2.734 1.173 5.044) 5.856 14.825 ( -2.645 -5.310 3.095) 6.691 14.845 ( -3.219 0.734 0.410) 3.327 14.902 ( -3.922 -3.244 3.913) 6.420 15.122 ( -1.022 0.037 -2.168) 2.397 15.138 ( -1.424 -1.661 -2.169) 3.080 18.123 ( 1.114 15.359 0.855) 15.423 18.188 ( -1.670 14.697 -0.787) 14.813 18.411 ( 1.497 -9.787 0.812) 9.934 18.485 ( -1.304 -10.997 -1.591) 11.187 18.760 ( -0.744 2.062 0.904) 2.372 18.784 ( -2.001 4.082 -0.791) 4.615 18.831 ( -0.155 -2.949 0.318) 2.970 18.916 ( -3.544 -7.057 0.242) 7.901 20.237 ( 2.624 1.428 -0.094) 2.989 20.249 ( 1.979 0.341 -0.018) 2.008 20.319 ( 1.766 -0.031 -0.245) 1.783 20.328 ( 1.247 -0.736 0.453) 1.518 21.787 ( 7.038 1.397 3.113) 7.821 21.814 ( 6.556 -1.341 2.356) 7.095 21.855 ( 5.359 0.612 -2.589) 5.983 21.868 ( 5.014 -0.722 -2.505) 5.652 22.608 ( 5.544 6.004 -1.813) 8.371 22.657 ( 2.576 4.625 1.681) 5.555 22.766 ( 5.355 -4.709 -2.767) 7.649 22.814 ( 2.370 -6.085 2.249) 6.906 24.454 ( 0.308 1.675 4.502) 4.814 24.462 ( 0.608 1.302 -2.473) 2.860 24.509 ( 1.491 -1.062 -1.298) 2.244 24.525 ( 0.710 -2.136 -0.575) 2.323 28.916 ( 0.816 0.956 -0.993) 1.602 28.918 ( 1.418 1.128 -0.085) 1.814 28.936 ( 0.231 -0.469 -0.290) 0.598 28.959 ( -0.655 -1.827 1.133) 2.248 29.318 ( -1.056 1.228 2.657) 3.112 29.325 ( -0.787 1.033 -1.728) 2.162 29.361 ( -0.923 -0.625 1.356) 1.755 29.372 ( -1.005 -1.326 -2.101) 2.680 33.733 ( 2.587 4.561 -0.458) 5.263 33.739 ( 2.258 4.560 0.482) 5.111 33.824 ( 2.628 -4.477 -0.459) 5.212 33.827 ( 2.392 -4.335 0.437) 4.970 35.859 ( -0.574 3.816 0.725) 3.926 35.893 ( -1.722 2.484 0.640) 3.089 35.959 ( -2.315 -2.638 -2.941) 4.579 36.011 ( -4.979 -5.138 1.473) 7.305 37.980 ( -0.468 18.404 1.176) 18.447 38.051 ( -3.246 18.020 -1.641) 18.383 38.363 ( -0.237 -18.416 1.544) 18.482 38.423 ( -2.304 -17.494 -0.995) 17.673 38.889 ( 1.576 2.713 -0.745) 3.225 38.969 ( 1.590 -4.890 -0.360) 5.155 39.071 ( -6.907 6.160 2.089) 9.488 39.191 ( -7.850 -5.652 -0.831) 9.709 40.085 ( -0.252 6.031 1.088) 6.133 40.196 ( -3.452 -4.712 -1.840) 6.124 40.440 ( -9.081 2.976 0.458) 9.567 40.497 ( -9.943 -2.812 0.151) 10.334 43.201 ( -1.736 9.960 -2.501) 10.415 43.255 ( -4.732 7.176 3.247) 9.188 43.498 ( -3.700 -6.709 -2.975) 8.219 43.541 ( -6.083 -8.376 2.184) 10.580 69.195 ( -4.517 3.219 -0.874) 5.615 69.225 ( -6.291 0.743 1.705) 6.560 69.372 ( -5.968 -1.060 -1.623) 6.275 69.394 ( -7.479 -2.786 0.801) 8.021 104.933 ( -0.862 0.219 0.699) 1.132 104.938 ( -1.008 -0.276 0.452) 1.139 104.968 ( -1.900 0.474 -0.513) 2.025 104.976 ( -2.099 -0.403 -0.644) 2.232 ======================= Grid point 210 (102/102) ======================= q-point: ( 0.50 0.40 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 Number of triplets: 86 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 4.962 ( -3.214 0.420 -1.852) 3.733 4.962 ( 3.214 0.420 1.852) 3.733 5.123 ( -0.528 -1.562 -1.522) 2.244 5.123 ( 0.528 -1.561 1.522) 2.244 5.436 ( -1.884 0.149 -3.262) 3.770 5.436 ( 1.884 0.149 3.262) 3.770 5.673 ( -1.026 6.154 -4.388) 7.627 5.673 ( 1.025 6.154 4.388) 7.627 5.813 ( -0.447 -7.146 -0.723) 7.196 5.813 ( 0.447 -7.146 0.723) 7.196 6.195 ( -4.288 4.213 -0.764) 6.060 6.195 ( 4.288 4.213 0.764) 6.060 6.287 ( -2.994 -1.573 -1.541) 3.717 6.287 ( 2.994 -1.573 1.541) 3.717 6.693 ( 0.379 3.303 -2.595) 4.218 6.693 ( -0.379 3.304 2.595) 4.218 6.763 ( -1.762 8.810 -3.139) 9.517 6.763 ( 1.762 8.810 3.139) 9.517 7.055 ( 3.624 2.737 -3.280) 5.601 7.055 ( -3.624 2.737 3.280) 5.601 7.111 ( -4.455 -5.686 -3.868) 8.194 7.111 ( 4.455 -5.686 3.868) 8.194 7.259 ( -3.381 -9.089 -4.499) 10.690 7.259 ( 3.381 -9.089 4.499) 10.690 7.481 ( -1.672 1.332 -3.846) 4.400 7.481 ( 1.672 1.332 3.846) 4.400 7.559 ( -5.261 -4.032 -2.063) 6.942 7.559 ( 5.261 -4.032 2.063) 6.942 7.671 ( 0.475 -0.536 -3.111) 3.192 7.671 ( -0.475 -0.536 3.111) 3.192 8.168 ( 1.824 -2.058 -2.280) 3.572 8.168 ( -1.824 -2.058 2.280) 3.572 8.518 ( -1.898 2.929 -1.106) 3.661 8.518 ( 1.898 2.929 1.106) 3.661 8.611 ( -0.484 1.504 -2.116) 2.641 8.611 ( 0.484 1.504 2.116) 2.641 9.043 ( 1.045 4.665 -2.073) 5.211 9.043 ( -1.045 4.665 2.073) 5.211 9.277 ( 0.624 -2.323 -4.441) 5.050 9.277 ( -0.624 -2.323 4.441) 5.050 9.859 ( 1.789 2.560 -9.785) 10.271 9.859 ( -1.789 2.560 9.785) 10.271 9.927 ( 0.703 -3.695 -3.112) 4.882 9.927 ( -0.703 -3.695 3.112) 4.882 10.209 ( -1.482 7.082 -5.573) 9.133 10.209 ( 1.482 7.082 5.573) 9.133 10.349 ( 3.433 -5.768 -3.872) 7.749 10.349 ( -3.433 -5.768 3.872) 7.749 10.490 ( 0.558 10.909 -6.695) 12.812 10.490 ( -0.558 10.909 6.695) 12.812 10.790 ( -4.157 -2.573 -3.220) 5.854 10.790 ( 4.157 -2.573 3.220) 5.854 10.898 ( -4.693 -2.543 -3.257) 6.253 10.898 ( 4.693 -2.543 3.257) 6.253 11.154 ( -1.350 -2.658 -0.676) 3.057 11.154 ( 1.350 -2.658 0.676) 3.057 11.756 ( 0.428 -2.162 -0.604) 2.285 11.756 ( -0.428 -2.162 0.604) 2.285 11.985 ( 0.932 -3.820 -3.712) 5.407 11.985 ( -0.932 -3.820 3.712) 5.407 12.820 ( 0.083 0.317 -0.587) 0.672 12.820 ( -0.083 0.317 0.587) 0.672 12.927 ( -2.543 -1.022 0.021) 2.741 12.927 ( 2.543 -1.022 -0.021) 2.741 13.346 ( -2.065 5.668 -4.359) 7.442 13.346 ( 2.065 5.668 4.359) 7.442 13.462 ( -3.104 -0.403 -4.702) 5.649 13.462 ( 3.104 -0.403 4.702) 5.649 14.229 ( -0.758 8.763 -5.910) 10.597 14.229 ( 0.758 8.763 5.910) 10.597 14.426 ( -1.039 -7.400 -2.510) 7.883 14.426 ( 1.039 -7.400 2.510) 7.883 14.681 ( 2.904 0.405 -5.762) 6.465 14.681 ( -2.904 0.405 5.762) 6.465 14.749 ( 2.131 -6.230 -5.291) 8.447 14.749 ( -2.131 -6.230 5.291) 8.447 14.844 ( 2.141 -1.284 -2.192) 3.322 14.844 ( -2.141 -1.284 2.192) 3.322 15.116 ( 0.124 -0.663 -1.672) 1.803 15.116 ( -0.124 -0.663 1.672) 1.803 18.153 ( -1.290 15.025 -1.296) 15.136 18.153 ( 1.290 15.025 1.296) 15.136 18.449 ( -1.224 -10.152 -2.035) 10.426 18.449 ( 1.224 -10.152 2.035) 10.426 18.757 ( -0.245 3.073 -1.255) 3.329 18.757 ( 0.245 3.073 1.255) 3.329 18.855 ( -1.464 -5.351 -0.720) 5.594 18.855 ( 1.464 -5.351 0.720) 5.594 20.266 ( -0.049 0.875 -0.230) 0.906 20.266 ( 0.049 0.875 0.230) 0.906 20.339 ( 0.234 -0.332 -0.464) 0.617 20.339 ( -0.234 -0.332 0.464) 0.617 21.874 ( -0.823 0.487 -1.888) 2.116 21.874 ( 0.823 0.487 1.888) 2.116 21.911 ( -0.383 -0.452 -1.479) 1.593 21.911 ( 0.383 -0.452 1.479) 1.593 22.672 ( 1.083 5.197 -2.517) 5.875 22.672 ( -1.083 5.197 2.517) 5.875 22.828 ( 1.293 -5.212 -3.744) 6.546 22.828 ( -1.293 -5.212 3.744) 6.546 24.464 ( 0.241 1.524 -4.145) 4.423 24.464 ( -0.242 1.524 4.145) 4.423 24.528 ( 0.338 -1.661 -3.188) 3.611 24.528 ( -0.338 -1.661 3.188) 3.611 28.927 ( 0.288 0.936 -1.380) 1.693 28.927 ( -0.288 0.936 1.380) 1.693 28.947 ( 0.849 -1.104 -1.113) 1.783 28.947 ( -0.849 -1.104 1.113) 1.783 29.313 ( 0.033 1.408 -2.366) 2.754 29.313 ( -0.033 1.408 2.366) 2.754 29.357 ( -0.111 -1.214 -2.097) 2.425 29.357 ( 0.111 -1.214 2.097) 2.425 33.760 ( 0.174 4.671 -0.946) 4.769 33.760 ( -0.174 4.671 0.946) 4.769 33.851 ( 0.148 -4.381 -1.025) 4.501 33.851 ( -0.148 -4.381 1.025) 4.501 35.866 ( -0.124 1.305 -1.845) 2.264 35.866 ( 0.124 1.305 1.845) 2.264 35.948 ( 1.500 -2.200 -2.471) 3.632 35.948 ( -1.500 -2.200 2.471) 3.632 37.997 ( -1.664 18.068 -1.884) 18.242 37.997 ( 1.664 18.068 1.884) 18.242 38.381 ( -1.455 -18.057 -1.746) 18.200 38.381 ( 1.455 -18.057 1.746) 18.200 38.947 ( -1.337 4.363 -2.539) 5.222 38.947 ( 1.337 4.363 2.539) 5.222 39.055 ( -3.754 -5.062 -2.915) 6.944 39.055 ( 3.754 -5.062 2.915) 6.944 40.124 ( -3.087 1.964 -1.387) 3.913 40.124 ( 3.087 1.964 1.387) 3.913 40.371 ( -0.473 -1.214 -1.743) 2.176 40.371 ( 0.473 -1.214 1.743) 2.176 43.195 ( 1.623 9.272 -2.675) 9.785 43.195 ( -1.623 9.272 2.675) 9.785 43.471 ( 1.343 -8.229 -2.497) 8.704 43.471 ( -1.343 -8.229 2.497) 8.704 69.156 ( 0.836 1.862 -1.199) 2.367 69.156 ( -0.836 1.862 1.199) 2.367 69.315 ( 0.646 -1.828 -1.258) 2.311 69.315 ( -0.646 -1.828 1.258) 2.311 104.928 ( -0.143 0.052 -0.387) 0.416 104.928 ( 0.143 0.052 0.387) 0.416 104.950 ( -0.292 -0.047 -0.273) 0.403 104.950 ( 0.292 -0.047 0.273) 0.403 =================== 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 3/46080 10.0 792.299 1056.122 645.346 0.000 178.511 0.000 3/46080 20.0 393.757 578.120 441.004 0.000 6.860 0.000 3/46080 30.0 208.213 244.035 226.347 0.000 -3.495 0.000 3/46080 40.0 123.426 118.040 119.635 0.000 -2.446 0.000 3/46080 50.0 82.950 66.739 70.740 0.000 -1.484 0.000 3/46080 60.0 60.859 42.805 46.649 0.000 -0.968 0.000 3/46080 70.0 47.349 30.137 33.484 0.000 -0.689 0.000 3/46080 80.0 38.373 22.703 25.580 0.000 -0.525 0.000 3/46080 90.0 32.046 17.971 20.459 0.000 -0.420 0.000 3/46080 100.0 27.387 14.762 16.937 0.000 -0.347 0.000 3/46080 110.0 23.838 12.472 14.398 0.000 -0.293 0.000 3/46080 120.0 21.061 10.772 12.495 0.000 -0.253 0.000 3/46080 130.0 18.837 9.468 11.025 0.000 -0.221 0.000 3/46080 140.0 17.024 8.440 9.859 0.000 -0.195 0.000 3/46080 150.0 15.520 7.611 8.914 0.000 -0.174 0.000 3/46080 160.0 14.257 6.931 8.135 0.000 -0.156 0.000 3/46080 170.0 13.181 6.363 7.481 0.000 -0.142 0.000 3/46080 180.0 12.256 5.882 6.925 0.000 -0.130 0.000 3/46080 190.0 11.454 5.470 6.448 0.000 -0.119 0.000 3/46080 200.0 10.751 5.113 6.033 0.000 -0.110 0.000 3/46080 210.0 10.130 4.802 5.669 0.000 -0.102 0.000 3/46080 220.0 9.579 4.527 5.348 0.000 -0.095 0.000 3/46080 230.0 9.087 4.284 5.062 0.000 -0.089 0.000 3/46080 240.0 8.644 4.066 4.805 0.000 -0.084 0.000 3/46080 250.0 8.244 3.871 4.575 0.000 -0.079 0.000 3/46080 260.0 7.881 3.694 4.366 0.000 -0.075 0.000 3/46080 270.0 7.550 3.534 4.176 0.000 -0.071 0.000 3/46080 280.0 7.247 3.388 4.002 0.000 -0.068 0.000 3/46080 290.0 6.969 3.254 3.843 0.000 -0.064 0.000 3/46080 300.0 6.713 3.131 3.696 0.000 -0.062 0.000 3/46080 310.0 6.475 3.018 3.561 0.000 -0.059 0.000 3/46080 320.0 6.255 2.913 3.435 0.000 -0.057 0.000 3/46080 330.0 6.051 2.816 3.319 0.000 -0.054 0.000 3/46080 340.0 5.860 2.726 3.210 0.000 -0.052 0.000 3/46080 350.0 5.682 2.641 3.109 0.000 -0.051 0.000 3/46080 360.0 5.515 2.563 3.014 0.000 -0.049 0.000 3/46080 370.0 5.358 2.489 2.925 0.000 -0.047 0.000 3/46080 380.0 5.210 2.419 2.842 0.000 -0.046 0.000 3/46080 390.0 5.071 2.354 2.763 0.000 -0.044 0.000 3/46080 400.0 4.940 2.292 2.688 0.000 -0.043 0.000 3/46080 410.0 4.816 2.234 2.618 0.000 -0.042 0.000 3/46080 420.0 4.698 2.179 2.552 0.000 -0.041 0.000 3/46080 430.0 4.587 2.127 2.489 0.000 -0.040 0.000 3/46080 440.0 4.481 2.077 2.429 0.000 -0.039 0.000 3/46080 450.0 4.380 2.030 2.372 0.000 -0.038 0.000 3/46080 460.0 4.284 1.985 2.318 0.000 -0.037 0.000 3/46080 470.0 4.192 1.943 2.266 0.000 -0.036 0.000 3/46080 480.0 4.105 1.902 2.217 0.000 -0.035 0.000 3/46080 490.0 4.021 1.863 2.170 0.000 -0.034 0.000 3/46080 500.0 3.941 1.825 2.125 0.000 -0.034 0.000 3/46080 510.0 3.864 1.790 2.082 0.000 -0.033 0.000 3/46080 520.0 3.791 1.755 2.040 0.000 -0.032 0.000 3/46080 530.0 3.720 1.722 2.001 0.000 -0.032 0.000 3/46080 540.0 3.652 1.691 1.963 0.000 -0.031 0.000 3/46080 550.0 3.587 1.660 1.926 0.000 -0.030 0.000 3/46080 560.0 3.524 1.631 1.891 0.000 -0.030 0.000 3/46080 570.0 3.464 1.603 1.857 0.000 -0.029 0.000 3/46080 580.0 3.405 1.576 1.825 0.000 -0.029 0.000 3/46080 590.0 3.349 1.550 1.793 0.000 -0.028 0.000 3/46080 600.0 3.295 1.524 1.763 0.000 -0.028 0.000 3/46080 610.0 3.242 1.500 1.733 0.000 -0.027 0.000 3/46080 620.0 3.192 1.476 1.705 0.000 -0.027 0.000 3/46080 630.0 3.143 1.453 1.678 0.000 -0.027 0.000 3/46080 640.0 3.095 1.431 1.651 0.000 -0.026 0.000 3/46080 650.0 3.049 1.410 1.626 0.000 -0.026 0.000 3/46080 660.0 3.005 1.389 1.601 0.000 -0.025 0.000 3/46080 670.0 2.961 1.369 1.577 0.000 -0.025 0.000 3/46080 680.0 2.920 1.349 1.554 0.000 -0.025 0.000 3/46080 690.0 2.879 1.331 1.531 0.000 -0.024 0.000 3/46080 700.0 2.839 1.312 1.509 0.000 -0.024 0.000 3/46080 710.0 2.801 1.294 1.488 0.000 -0.024 0.000 3/46080 720.0 2.764 1.277 1.467 0.000 -0.023 0.000 3/46080 730.0 2.727 1.260 1.447 0.000 -0.023 0.000 3/46080 740.0 2.692 1.244 1.428 0.000 -0.023 0.000 3/46080 750.0 2.658 1.228 1.409 0.000 -0.023 0.000 3/46080 760.0 2.624 1.212 1.390 0.000 -0.022 0.000 3/46080 770.0 2.592 1.197 1.372 0.000 -0.022 0.000 3/46080 780.0 2.560 1.182 1.355 0.000 -0.022 0.000 3/46080 790.0 2.529 1.168 1.338 0.000 -0.021 0.000 3/46080 800.0 2.499 1.154 1.321 0.000 -0.021 0.000 3/46080 810.0 2.470 1.140 1.305 0.000 -0.021 0.000 3/46080 820.0 2.441 1.127 1.289 0.000 -0.021 0.000 3/46080 830.0 2.413 1.113 1.274 0.000 -0.021 0.000 3/46080 840.0 2.386 1.101 1.259 0.000 -0.020 0.000 3/46080 850.0 2.359 1.088 1.244 0.000 -0.020 0.000 3/46080 860.0 2.333 1.076 1.230 0.000 -0.020 0.000 3/46080 870.0 2.307 1.064 1.216 0.000 -0.020 0.000 3/46080 880.0 2.282 1.053 1.202 0.000 -0.019 0.000 3/46080 890.0 2.258 1.041 1.189 0.000 -0.019 0.000 3/46080 900.0 2.234 1.030 1.176 0.000 -0.019 0.000 3/46080 910.0 2.211 1.019 1.163 0.000 -0.019 0.000 3/46080 920.0 2.188 1.009 1.150 0.000 -0.019 0.000 3/46080 930.0 2.166 0.998 1.138 0.000 -0.018 0.000 3/46080 940.0 2.144 0.988 1.126 0.000 -0.018 0.000 3/46080 950.0 2.122 0.978 1.114 0.000 -0.018 0.000 3/46080 960.0 2.101 0.968 1.103 0.000 -0.018 0.000 3/46080 970.0 2.081 0.959 1.092 0.000 -0.018 0.000 3/46080 980.0 2.061 0.949 1.081 0.000 -0.018 0.000 3/46080 990.0 2.041 0.940 1.070 0.000 -0.017 0.000 3/46080 1000.0 2.022 0.931 1.059 0.000 -0.017 0.000 3/46080 Thermal conductivity related properties were written into "kappa-m1654.hdf5". Summary of calculation was written in "phono3py.yaml". -------------------------[time 2026-01-08 06:16:33]------------------------- _ ___ _ __ __| | / _ \ '_ \ / _` | | __/ | | | (_| | \___|_| |_|\__,_|