----------------------------- ------- calculate fc2 ------- ----------------------------- _ _ __ | |__ ___ _ __ ___ _ __ _ _ | '_ \| '_ \ / _ \| '_ \ / _ \ | '_ \| | | | | |_) | | | | (_) | | | | (_) || |_) | |_| | | .__/|_| |_|\___/|_| |_|\___(_) .__/ \__, | |_| |_| |___/ 2.47.1 -------------------------[time 2026-01-08 12:21:49]------------------------- Compiled with OpenMP support (max 128 threads). Running in phonopy.load mode. Python version 3.14.2 Spglib version 2.6.1 Crystal structure was read from "phonopy_mlp_eval_fc2_dataset.yaml.xz". Unit of length: angstrom Settings: Supercell: [1 2 1] Primitive matrix: [0.5 0.5 0. ] [-0.5 0.5 0. ] [0. 0. 1.] Spacegroup: C2/c (15) Number of symmetry operations in supercell: 16 ------------------------------ primitive cell ------------------------------ Lattice vectors: a 7.166446015001886 -3.317851634999999 0.000000000000000 b 7.166446015001886 3.317851634999999 0.000000000000000 c -5.462180259819114 0.000000000000000 8.654610456623876 Atomic positions (fractional): *1 Er 0.76720253475828 0.51224616479349 0.83437145506469 167.259 *2 Er 0.29237359156747 0.77941432586238 0.96380478758248 167.259 3 Er 0.23279746524172 0.48775383520651 0.16562854493531 167.259 4 Er 0.51224616479349 0.76720253475828 0.33437145506469 167.259 5 Er 0.48775383520651 0.23279746524172 0.66562854493531 167.259 6 Er 0.70762640843253 0.22058567413762 0.03619521241752 167.259 7 Er 0.77941432586239 0.29237359156747 0.46380478758248 167.259 8 Er 0.22058567413762 0.70762640843253 0.53619521241752 167.259 *9 Si 0.09046008696349 0.27418343933974 0.30857317190562 28.085 10 Si 0.90953991303651 0.72581656066026 0.69142682809438 28.085 11 Si 0.72581656066026 0.90953991303651 0.19142682809438 28.085 12 Si 0.27418343933974 0.09046008696349 0.80857317190562 28.085 *13 O 0.84978843765674 0.55307510529781 0.67428612535376 15.999 *14 O 0.59013120988850 0.17404123321284 0.18051695437333 15.999 *15 O 0.08760433613834 0.08841163953607 0.64018672928053 15.999 *16 O 0.86648917986322 0.73042624823592 0.05758419857646 15.999 17 O 0.15021156234326 0.44692489470219 0.32571387464624 15.999 *18 O 0.42127666349450 0.61548473107053 0.39871763221785 15.999 19 O 0.55307510529781 0.84978843765674 0.17428612535376 15.999 20 O 0.17404123321284 0.59013120988850 0.68051695437333 15.999 21 O 0.13351082013678 0.26957375176408 0.94241580142354 15.999 22 O 0.61548473107053 0.42127666349450 0.89871763221785 15.999 23 O 0.38451526892947 0.57872333650550 0.10128236778215 15.999 24 O 0.91158836046393 0.91239566386166 0.85981327071947 15.999 25 O 0.40986879011150 0.82595876678716 0.81948304562667 15.999 26 O 0.26957375176408 0.13351082013678 0.44241580142354 15.999 27 O 0.08841163953607 0.08760433613834 0.14018672928053 15.999 28 O 0.44692489470219 0.15021156234326 0.82571387464624 15.999 29 O 0.91239566386166 0.91158836046393 0.35981327071947 15.999 30 O 0.57872333650550 0.38451526892947 0.60128236778215 15.999 31 O 0.82595876678716 0.40986879011150 0.31948304562667 15.999 32 O 0.73042624823592 0.86648917986322 0.55758419857646 15.999 -------------------------------- unit cell --------------------------------- Lattice vectors: a 14.332892030003771 0.000000000000000 0.000000000000000 b 0.000000000000000 6.635703269999999 0.000000000000000 c -5.462180259819114 0.000000000000000 8.654610456623876 Atomic positions (fractional): *1 Er 0.13972434977588 0.37252181501760 0.83437145506469 167.259 > 1 *2 Er 0.03589395871492 0.74352036714746 0.96380478758248 167.259 > 2 3 Er 0.86027565022412 0.62747818498240 0.16562854493531 167.259 > 3 4 Er 0.13972434977588 0.62747818498240 0.33437145506469 167.259 > 4 5 Er 0.86027565022412 0.37252181501760 0.66562854493531 167.259 > 5 6 Er 0.96410604128508 0.25647963285254 0.03619521241752 167.259 > 6 7 Er 0.03589395871492 0.25647963285254 0.46380478758248 167.259 > 7 8 Er 0.96410604128508 0.74352036714746 0.53619521241752 167.259 > 8 9 Er 0.63972434977588 0.87252181501760 0.83437145506469 167.259 > 1 10 Er 0.53589395871492 0.24352036714746 0.96380478758248 167.259 > 2 11 Er 0.36027565022412 0.12747818498240 0.16562854493531 167.259 > 3 12 Er 0.63972434977588 0.12747818498240 0.33437145506469 167.259 > 4 13 Er 0.36027565022412 0.87252181501760 0.66562854493531 167.259 > 5 14 Er 0.46410604128507 0.75647963285254 0.03619521241752 167.259 > 6 15 Er 0.53589395871492 0.75647963285254 0.46380478758248 167.259 > 7 16 Er 0.46410604128507 0.24352036714746 0.53619521241752 167.259 > 8 *17 Si 0.68232176315161 0.59186167618812 0.30857317190562 28.085 > 9 18 Si 0.31767823684838 0.40813832381188 0.69142682809438 28.085 > 10 19 Si 0.81767823684839 0.09186167618812 0.19142682809438 28.085 > 11 20 Si 0.18232176315161 0.90813832381188 0.80857317190562 28.085 > 12 21 Si 0.18232176315161 0.09186167618812 0.30857317190562 28.085 > 9 22 Si 0.81767823684839 0.90813832381188 0.69142682809438 28.085 > 10 23 Si 0.31767823684838 0.59186167618812 0.19142682809438 28.085 > 11 24 Si 0.68232176315161 0.40813832381188 0.80857317190562 28.085 > 12 *25 O 0.20143177147727 0.35164333382054 0.67428612535376 15.999 > 13 *26 O 0.88208622155067 0.29195501166217 0.18051695437333 15.999 > 14 *27 O 0.08800798783720 0.00040365169887 0.64018672928053 15.999 > 15 *28 O 0.79845771404957 0.93196853418635 0.05758419857646 15.999 > 16 29 O 0.79856822852273 0.64835666617946 0.32571387464624 15.999 > 17 *30 O 0.01838069728252 0.59710403378802 0.39871763221785 15.999 > 18 31 O 0.70143177147727 0.14835666617946 0.17428612535376 15.999 > 19 32 O 0.88208622155067 0.70804498833783 0.68051695437333 15.999 > 20 33 O 0.20154228595043 0.06803146581365 0.94241580142354 15.999 > 21 34 O 0.01838069728252 0.40289596621198 0.89871763221785 15.999 > 22 35 O 0.98161930271748 0.59710403378802 0.10128236778215 15.999 > 23 36 O 0.41199201216280 0.50040365169887 0.85981327071947 15.999 > 24 37 O 0.11791377844933 0.70804498833783 0.81948304562667 15.999 > 25 38 O 0.20154228595043 0.93196853418635 0.44241580142354 15.999 > 26 39 O 0.58800798783720 0.49959634830113 0.14018672928053 15.999 > 27 40 O 0.29856822852273 0.85164333382054 0.82571387464624 15.999 > 28 41 O 0.91199201216280 0.99959634830113 0.35981327071947 15.999 > 29 42 O 0.98161930271748 0.40289596621198 0.60128236778215 15.999 > 30 43 O 0.11791377844933 0.29195501166217 0.31948304562667 15.999 > 31 44 O 0.79845771404957 0.06803146581365 0.55758419857646 15.999 > 32 45 O 0.70143177147727 0.85164333382054 0.67428612535376 15.999 > 13 46 O 0.38208622155067 0.79195501166217 0.18051695437333 15.999 > 14 47 O 0.58800798783720 0.50040365169887 0.64018672928053 15.999 > 15 48 O 0.29845771404957 0.43196853418635 0.05758419857646 15.999 > 16 49 O 0.29856822852273 0.14835666617946 0.32571387464624 15.999 > 17 50 O 0.51838069728252 0.09710403378802 0.39871763221785 15.999 > 18 51 O 0.20143177147727 0.64835666617946 0.17428612535376 15.999 > 19 52 O 0.38208622155067 0.20804498833783 0.68051695437333 15.999 > 20 53 O 0.70154228595043 0.56803146581365 0.94241580142354 15.999 > 21 54 O 0.51838069728252 0.90289596621198 0.89871763221785 15.999 > 22 55 O 0.48161930271748 0.09710403378802 0.10128236778215 15.999 > 23 56 O 0.91199201216280 0.00040365169887 0.85981327071947 15.999 > 24 57 O 0.61791377844933 0.20804498833783 0.81948304562667 15.999 > 25 58 O 0.70154228595043 0.43196853418635 0.44241580142354 15.999 > 26 59 O 0.08800798783720 0.99959634830113 0.14018672928053 15.999 > 27 60 O 0.79856822852273 0.35164333382054 0.82571387464624 15.999 > 28 61 O 0.41199201216280 0.49959634830113 0.35981327071947 15.999 > 29 62 O 0.48161930271748 0.90289596621198 0.60128236778215 15.999 > 30 63 O 0.61791377844933 0.79195501166217 0.31948304562667 15.999 > 31 64 O 0.29845771404957 0.56803146581365 0.55758419857646 15.999 > 32 -------------------------------- super cell -------------------------------- Lattice vectors: a 14.332892030003771 0.000000000000000 0.000000000000000 b 0.000000000000000 13.271406539999997 0.000000000000000 c -5.462180259819114 0.000000000000000 8.654610456623876 Atomic positions (fractional): *1 Er 0.13972434977588 0.18626090750880 0.83437145506469 167.259 > 1 2 Er 0.13972434977588 0.68626090750880 0.83437145506469 167.259 > 1 *3 Er 0.03589395871492 0.37176018357373 0.96380478758248 167.259 > 2 4 Er 0.03589395871492 0.87176018357373 0.96380478758248 167.259 > 2 5 Er 0.86027565022412 0.31373909249120 0.16562854493531 167.259 > 3 6 Er 0.86027565022412 0.81373909249120 0.16562854493531 167.259 > 3 7 Er 0.13972434977588 0.31373909249120 0.33437145506469 167.259 > 4 8 Er 0.13972434977588 0.81373909249120 0.33437145506469 167.259 > 4 9 Er 0.86027565022412 0.18626090750880 0.66562854493531 167.259 > 5 10 Er 0.86027565022412 0.68626090750880 0.66562854493531 167.259 > 5 11 Er 0.96410604128508 0.12823981642627 0.03619521241752 167.259 > 6 12 Er 0.96410604128508 0.62823981642627 0.03619521241752 167.259 > 6 13 Er 0.03589395871492 0.12823981642627 0.46380478758248 167.259 > 7 14 Er 0.03589395871492 0.62823981642627 0.46380478758248 167.259 > 7 15 Er 0.96410604128508 0.37176018357373 0.53619521241752 167.259 > 8 16 Er 0.96410604128508 0.87176018357373 0.53619521241752 167.259 > 8 17 Er 0.63972434977588 0.43626090750880 0.83437145506469 167.259 > 1 18 Er 0.63972434977588 0.93626090750880 0.83437145506469 167.259 > 1 19 Er 0.53589395871492 0.12176018357373 0.96380478758248 167.259 > 2 20 Er 0.53589395871492 0.62176018357373 0.96380478758248 167.259 > 2 21 Er 0.36027565022412 0.06373909249120 0.16562854493531 167.259 > 3 22 Er 0.36027565022412 0.56373909249120 0.16562854493531 167.259 > 3 23 Er 0.63972434977588 0.06373909249120 0.33437145506469 167.259 > 4 24 Er 0.63972434977588 0.56373909249120 0.33437145506469 167.259 > 4 25 Er 0.36027565022412 0.43626090750880 0.66562854493531 167.259 > 5 26 Er 0.36027565022412 0.93626090750880 0.66562854493531 167.259 > 5 27 Er 0.46410604128507 0.37823981642627 0.03619521241752 167.259 > 6 28 Er 0.46410604128507 0.87823981642627 0.03619521241752 167.259 > 6 29 Er 0.53589395871492 0.37823981642627 0.46380478758248 167.259 > 7 30 Er 0.53589395871492 0.87823981642627 0.46380478758248 167.259 > 7 31 Er 0.46410604128507 0.12176018357373 0.53619521241752 167.259 > 8 32 Er 0.46410604128507 0.62176018357373 0.53619521241752 167.259 > 8 *33 Si 0.68232176315161 0.29593083809406 0.30857317190562 28.085 > 9 34 Si 0.68232176315161 0.79593083809406 0.30857317190562 28.085 > 9 35 Si 0.31767823684838 0.20406916190594 0.69142682809438 28.085 > 10 36 Si 0.31767823684838 0.70406916190594 0.69142682809438 28.085 > 10 37 Si 0.81767823684839 0.04593083809406 0.19142682809438 28.085 > 11 38 Si 0.81767823684839 0.54593083809406 0.19142682809438 28.085 > 11 39 Si 0.18232176315161 0.45406916190594 0.80857317190562 28.085 > 12 40 Si 0.18232176315161 0.95406916190594 0.80857317190562 28.085 > 12 41 Si 0.18232176315161 0.04593083809406 0.30857317190562 28.085 > 9 42 Si 0.18232176315161 0.54593083809406 0.30857317190562 28.085 > 9 43 Si 0.81767823684839 0.45406916190594 0.69142682809438 28.085 > 10 44 Si 0.81767823684839 0.95406916190594 0.69142682809438 28.085 > 10 45 Si 0.31767823684838 0.29593083809406 0.19142682809438 28.085 > 11 46 Si 0.31767823684838 0.79593083809406 0.19142682809438 28.085 > 11 47 Si 0.68232176315161 0.20406916190594 0.80857317190562 28.085 > 12 48 Si 0.68232176315161 0.70406916190594 0.80857317190562 28.085 > 12 *49 O 0.20143177147727 0.17582166691027 0.67428612535376 15.999 > 13 50 O 0.20143177147727 0.67582166691027 0.67428612535376 15.999 > 13 *51 O 0.88208622155067 0.14597750583108 0.18051695437333 15.999 > 14 52 O 0.88208622155067 0.64597750583108 0.18051695437333 15.999 > 14 *53 O 0.08800798783720 0.00020182584943 0.64018672928053 15.999 > 15 54 O 0.08800798783720 0.50020182584943 0.64018672928053 15.999 > 15 *55 O 0.79845771404957 0.46598426709318 0.05758419857646 15.999 > 16 56 O 0.79845771404957 0.96598426709318 0.05758419857646 15.999 > 16 57 O 0.79856822852273 0.32417833308973 0.32571387464624 15.999 > 17 58 O 0.79856822852273 0.82417833308973 0.32571387464624 15.999 > 17 *59 O 0.01838069728252 0.29855201689401 0.39871763221785 15.999 > 18 60 O 0.01838069728252 0.79855201689401 0.39871763221785 15.999 > 18 61 O 0.70143177147727 0.07417833308973 0.17428612535376 15.999 > 19 62 O 0.70143177147727 0.57417833308973 0.17428612535376 15.999 > 19 63 O 0.88208622155067 0.35402249416892 0.68051695437333 15.999 > 20 64 O 0.88208622155067 0.85402249416892 0.68051695437333 15.999 > 20 65 O 0.20154228595043 0.03401573290682 0.94241580142354 15.999 > 21 66 O 0.20154228595043 0.53401573290682 0.94241580142354 15.999 > 21 67 O 0.01838069728252 0.20144798310599 0.89871763221785 15.999 > 22 68 O 0.01838069728252 0.70144798310599 0.89871763221785 15.999 > 22 69 O 0.98161930271748 0.29855201689401 0.10128236778215 15.999 > 23 70 O 0.98161930271748 0.79855201689401 0.10128236778215 15.999 > 23 71 O 0.41199201216280 0.25020182584943 0.85981327071947 15.999 > 24 72 O 0.41199201216280 0.75020182584943 0.85981327071947 15.999 > 24 73 O 0.11791377844933 0.35402249416892 0.81948304562667 15.999 > 25 74 O 0.11791377844933 0.85402249416892 0.81948304562667 15.999 > 25 75 O 0.20154228595043 0.46598426709318 0.44241580142354 15.999 > 26 76 O 0.20154228595043 0.96598426709318 0.44241580142354 15.999 > 26 77 O 0.58800798783720 0.24979817415057 0.14018672928053 15.999 > 27 78 O 0.58800798783720 0.74979817415057 0.14018672928053 15.999 > 27 79 O 0.29856822852273 0.42582166691027 0.82571387464624 15.999 > 28 80 O 0.29856822852273 0.92582166691027 0.82571387464624 15.999 > 28 81 O 0.91199201216280 0.49979817415057 0.35981327071947 15.999 > 29 82 O 0.91199201216280 0.99979817415057 0.35981327071947 15.999 > 29 83 O 0.98161930271748 0.20144798310599 0.60128236778215 15.999 > 30 84 O 0.98161930271748 0.70144798310599 0.60128236778215 15.999 > 30 85 O 0.11791377844933 0.14597750583108 0.31948304562667 15.999 > 31 86 O 0.11791377844933 0.64597750583108 0.31948304562667 15.999 > 31 87 O 0.79845771404957 0.03401573290682 0.55758419857646 15.999 > 32 88 O 0.79845771404957 0.53401573290682 0.55758419857646 15.999 > 32 89 O 0.70143177147727 0.42582166691027 0.67428612535376 15.999 > 13 90 O 0.70143177147727 0.92582166691027 0.67428612535376 15.999 > 13 91 O 0.38208622155067 0.39597750583108 0.18051695437333 15.999 > 14 92 O 0.38208622155067 0.89597750583108 0.18051695437333 15.999 > 14 93 O 0.58800798783720 0.25020182584943 0.64018672928053 15.999 > 15 94 O 0.58800798783720 0.75020182584943 0.64018672928053 15.999 > 15 95 O 0.29845771404957 0.21598426709318 0.05758419857646 15.999 > 16 96 O 0.29845771404957 0.71598426709318 0.05758419857646 15.999 > 16 97 O 0.29856822852273 0.07417833308973 0.32571387464624 15.999 > 17 98 O 0.29856822852273 0.57417833308973 0.32571387464624 15.999 > 17 99 O 0.51838069728252 0.04855201689401 0.39871763221785 15.999 > 18 100 O 0.51838069728252 0.54855201689401 0.39871763221785 15.999 > 18 101 O 0.20143177147727 0.32417833308973 0.17428612535376 15.999 > 19 102 O 0.20143177147727 0.82417833308973 0.17428612535376 15.999 > 19 103 O 0.38208622155067 0.10402249416892 0.68051695437333 15.999 > 20 104 O 0.38208622155067 0.60402249416892 0.68051695437333 15.999 > 20 105 O 0.70154228595043 0.28401573290682 0.94241580142354 15.999 > 21 106 O 0.70154228595043 0.78401573290682 0.94241580142354 15.999 > 21 107 O 0.51838069728252 0.45144798310599 0.89871763221785 15.999 > 22 108 O 0.51838069728252 0.95144798310599 0.89871763221785 15.999 > 22 109 O 0.48161930271748 0.04855201689401 0.10128236778215 15.999 > 23 110 O 0.48161930271748 0.54855201689401 0.10128236778215 15.999 > 23 111 O 0.91199201216280 0.00020182584943 0.85981327071947 15.999 > 24 112 O 0.91199201216280 0.50020182584943 0.85981327071947 15.999 > 24 113 O 0.61791377844933 0.10402249416892 0.81948304562667 15.999 > 25 114 O 0.61791377844933 0.60402249416892 0.81948304562667 15.999 > 25 115 O 0.70154228595043 0.21598426709318 0.44241580142354 15.999 > 26 116 O 0.70154228595043 0.71598426709318 0.44241580142354 15.999 > 26 117 O 0.08800798783720 0.49979817415057 0.14018672928053 15.999 > 27 118 O 0.08800798783720 0.99979817415057 0.14018672928053 15.999 > 27 119 O 0.79856822852273 0.17582166691027 0.82571387464624 15.999 > 28 120 O 0.79856822852273 0.67582166691027 0.82571387464624 15.999 > 28 121 O 0.41199201216280 0.24979817415057 0.35981327071947 15.999 > 29 122 O 0.41199201216280 0.74979817415057 0.35981327071947 15.999 > 29 123 O 0.48161930271748 0.45144798310599 0.60128236778215 15.999 > 30 124 O 0.48161930271748 0.95144798310599 0.60128236778215 15.999 > 30 125 O 0.61791377844933 0.39597750583108 0.31948304562667 15.999 > 31 126 O 0.61791377844933 0.89597750583108 0.31948304562667 15.999 > 31 127 O 0.29845771404957 0.28401573290682 0.55758419857646 15.999 > 32 128 O 0.29845771404957 0.78401573290682 0.55758419857646 15.999 > 32 ---------------------------------------------------------------------------- NAC parameters were read from "phonopy_mlp_eval_fc2_dataset.yaml.xz". --------------------------- Dielectric constant ---------------------------- 3.5322925 0.0000000 -0.0328378 0.0000000 3.5191752 0.0000000 -0.0328065 0.0000000 3.6134196 -------------------------- Born effective charges -------------------------- 1 Er 3.8289972 -0.4475072 -0.0338485 -0.4248230 3.6328161 -0.1161664 0.1210250 -0.1134513 3.8265455 2 Er 3.3593912 -0.1041723 -0.2212887 -0.1227900 3.7587641 -0.0035305 -0.2609645 -0.0086440 3.9600371 3 Er 3.8289972 -0.4475072 -0.0338485 -0.4248230 3.6328161 -0.1161664 0.1210250 -0.1134513 3.8265455 4 Er 3.8289972 0.4475072 -0.0338485 0.4248230 3.6328161 0.1161664 0.1210250 0.1134513 3.8265455 5 Er 3.8289972 0.4475072 -0.0338485 0.4248230 3.6328161 0.1161664 0.1210250 0.1134513 3.8265455 6 Er 3.3593912 -0.1041723 -0.2212887 -0.1227900 3.7587641 -0.0035305 -0.2609645 -0.0086440 3.9600371 7 Er 3.3593912 0.1041723 -0.2212887 0.1227900 3.7587641 0.0035305 -0.2609645 0.0086440 3.9600371 8 Er 3.3593912 0.1041723 -0.2212887 0.1227900 3.7587641 0.0035305 -0.2609645 0.0086440 3.9600371 9 Si 3.4222138 -0.1101648 0.2991125 -0.0494491 3.1210115 -0.1097387 0.1573289 -0.0147237 3.0471476 10 Si 3.4222138 -0.1101648 0.2991125 -0.0494491 3.1210115 -0.1097387 0.1573289 -0.0147237 3.0471476 11 Si 3.4222138 0.1101648 0.2991125 0.0494491 3.1210115 0.1097387 0.1573289 0.0147237 3.0471476 12 Si 3.4222138 0.1101648 0.2991125 0.0494491 3.1210115 0.1097387 0.1573289 0.0147237 3.0471476 13 O -2.9346576 -0.2708202 0.0050289 -0.3071036 -1.3504088 -0.1780837 -0.0464377 -0.1728699 -1.9258084 14 O -2.0048398 -0.3932289 0.1706151 -0.4110449 -2.5018078 0.1047064 0.2014447 0.1330464 -1.8361724 15 O -1.4198739 -0.2715106 -0.3575930 -0.2632322 -2.3325359 0.3646958 -0.3629527 0.2670824 -2.3464759 16 O -1.4951992 0.1944357 -0.3118556 0.1852867 -2.3053725 -0.2379332 -0.2585581 -0.2560449 -2.3916950 17 O -2.9346576 -0.2708202 0.0050289 -0.3071036 -1.3504088 -0.1780837 -0.0464377 -0.1728699 -1.9258084 18 O -2.7560316 0.1796317 0.4498292 0.2526433 -2.0224668 0.0158846 0.4491145 0.0960265 -2.3335785 19 O -2.9346576 0.2708202 0.0050289 0.3071036 -1.3504088 0.1780837 -0.0464377 0.1728699 -1.9258084 20 O -2.0048398 0.3932289 0.1706151 0.4110449 -2.5018078 -0.1047064 0.2014447 -0.1330464 -1.8361724 21 O -1.4951992 0.1944357 -0.3118556 0.1852867 -2.3053725 -0.2379332 -0.2585581 -0.2560449 -2.3916950 22 O -2.7560316 -0.1796317 0.4498292 -0.2526433 -2.0224668 -0.0158846 0.4491145 -0.0960265 -2.3335785 23 O -2.7560316 -0.1796317 0.4498292 -0.2526433 -2.0224668 -0.0158846 0.4491145 -0.0960265 -2.3335785 24 O -1.4198739 0.2715106 -0.3575930 0.2632322 -2.3325359 -0.3646958 -0.3629527 -0.2670824 -2.3464759 25 O -2.0048398 -0.3932289 0.1706151 -0.4110449 -2.5018078 0.1047064 0.2014447 0.1330464 -1.8361724 26 O -1.4951992 -0.1944357 -0.3118556 -0.1852867 -2.3053725 0.2379332 -0.2585581 0.2560449 -2.3916950 27 O -1.4198739 0.2715106 -0.3575930 0.2632322 -2.3325359 -0.3646958 -0.3629527 -0.2670824 -2.3464759 28 O -2.9346576 0.2708202 0.0050289 0.3071036 -1.3504088 0.1780837 -0.0464377 0.1728699 -1.9258084 29 O -1.4198739 -0.2715106 -0.3575930 -0.2632322 -2.3325359 0.3646958 -0.3629527 0.2670824 -2.3464759 30 O -2.7560316 0.1796317 0.4498292 0.2526433 -2.0224668 0.0158846 0.4491145 0.0960265 -2.3335785 31 O -2.0048398 0.3932289 0.1706151 0.4110449 -2.5018078 -0.1047064 0.2014447 -0.1330464 -1.8361724 32 O -1.4951992 -0.1944357 -0.3118556 -0.1852867 -2.3053725 0.2379332 -0.2585581 0.2560449 -2.3916950 ---------------------------------------------------------------------------- Displacement-force dataset was read from "phonopy_mlp_eval_fc2_dataset.yaml.xz". -------------------------------- Symfc start ------------------------------- Symfc version 1.5.4 (https://github.com/symfc/symfc) Citation: A. Seko and A. Togo, Phys. Rev. B, 110, 214302 (2024) Computing [2] order force constants. Permutation basis: 384/384 Permutation basis: 22848/22848 Construct permutation basis matrix. Finding block diagonal structure in projector. Using scipy connected_components. Rank of projector: 4752 Number of blocks in projector: 4752 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: 1024 Use submatrix version of eigh solver. (1) Block: 500 / 1024 (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: 1024 / 1024 (2) Block: 250 / 524 (2) 238 eigenvectors found. (2) Block: 524 / 524 (2) 260 eigenvectors found. (2) Complementary block size: 26 (2) Compute compressed projector. (2) Use standard solver. (2) 11 eigenvectors found. (1) 509 eigenvectors found. (1) Complementary block size: 31 (1) Compute compressed projector. (1) Use standard solver. (1) 15 eigenvectors found. --- Eigsh_solver_block: 2 / 6 --- Block_size: 1024 Use submatrix version of eigh solver. (1) Block: 500 / 1024 (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: 1024 / 1024 (2) Block: 250 / 524 (2) 239 eigenvectors found. (2) Block: 524 / 524 (2) 265 eigenvectors found. (2) Complementary block size: 20 (2) Compute compressed projector. (2) Use standard solver. (2) 9 eigenvectors found. (1) 513 eigenvectors found. (1) Complementary block size: 26 (1) Compute compressed projector. (1) Use standard solver. (1) 11 eigenvectors found. --- Eigsh_solver_block: 3 / 6 --- Block_size: 1024 Use submatrix version of eigh solver. (1) Block: 500 / 1024 (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: 1024 / 1024 (2) Block: 250 / 524 (2) 238 eigenvectors found. (2) Block: 524 / 524 (2) 260 eigenvectors found. (2) Complementary block size: 26 (2) Compute compressed projector. (2) Use standard solver. (2) 11 eigenvectors found. (1) 509 eigenvectors found. (1) Complementary block size: 31 (1) Compute compressed projector. (1) Use standard solver. (1) 15 eigenvectors found. --- Eigsh_solver_block: 4 / 6 --- Block_size: 560 Use submatrix version of eigh solver. (1) Block: 560 / 560 (2) Block: 250 / 560 (2) 242 eigenvectors found. (2) Block: 500 / 560 (2) 242 eigenvectors found. (2) Block: 560 / 560 (2) 54 eigenvectors found. (2) Complementary block size: 22 (2) Compute compressed projector. (2) Use standard solver. (2) 14 eigenvectors found. (1) 552 eigenvectors found. (1) Complementary block size: 7 (1) Compute compressed projector. (1) Use standard solver. (1) 0 eigenvectors found. --- Eigsh_solver_block: 5 / 6 --- Block_size: 560 Use submatrix version of eigh solver. (1) Block: 560 / 560 (2) Block: 250 / 560 (2) 242 eigenvectors found. (2) Block: 500 / 560 (2) 242 eigenvectors found. (2) Block: 560 / 560 (2) 54 eigenvectors found. (2) Complementary block size: 22 (2) Compute compressed projector. (2) Use standard solver. (2) 14 eigenvectors found. (1) 552 eigenvectors found. (1) Complementary block size: 7 (1) Compute compressed projector. (1) Use standard solver. (1) 0 eigenvectors found. --- Eigsh_solver_block: 6 / 6 --- Block_size: 560 Use submatrix version of eigh solver. (1) Block: 560 / 560 (2) Block: 250 / 560 (2) 242 eigenvectors found. (2) Block: 500 / 560 (2) 242 eigenvectors found. (2) Block: 560 / 560 (2) 54 eigenvectors found. (2) Complementary block size: 22 (2) Compute compressed projector. (2) Use standard solver. (2) 14 eigenvectors found. (1) 552 eigenvectors found. (1) Complementary block size: 7 (1) Compute compressed projector. (1) Use standard solver. (1) 0 eigenvectors found. Tree of FC basis block matrices: - (4752, 4681), data: False |-- (560, 552), data: False |-- (560, 552), data: False |-- (560, 14), data: (560, 22) @ (22, 14) |-- (60, 54), data: True |-- (250, 242), data: True |-- (250, 242), data: True |-- (560, 552), data: False |-- (560, 552), data: False |-- (560, 14), data: (560, 22) @ (22, 14) |-- (60, 54), data: True |-- (250, 242), data: True |-- (250, 242), data: True |-- (560, 552), data: False |-- (560, 552), data: False |-- (560, 14), data: (560, 22) @ (22, 14) |-- (60, 54), data: True |-- (250, 242), data: True |-- (250, 242), data: True |-- (1024, 1008), data: False |-- (1024, 15), data: (1024, 31) @ (31, 15) |-- (524, 509), data: False |-- (524, 11), data: (524, 26) @ (26, 11) |-- (274, 260), data: True |-- (250, 238), data: True |-- (500, 484), data: False |-- (500, 14), data: (500, 30) @ (30, 14) |-- (250, 236), data: True |-- (250, 234), data: True |-- (1024, 1009), data: False |-- (1024, 11), data: (1024, 26) @ (26, 11) |-- (524, 513), data: False |-- (524, 9), data: (524, 20) @ (20, 9) |-- (274, 265), data: True |-- (250, 239), data: True |-- (500, 485), data: False |-- (500, 13), data: (500, 28) @ (28, 13) |-- (250, 237), data: True |-- (250, 235), data: True |-- (1024, 1008), data: False |-- (1024, 15), data: (1024, 31) @ (31, 15) |-- (524, 509), data: False |-- (524, 11), data: (524, 26) @ (26, 11) |-- (274, 260), data: True |-- (250, 238), data: True |-- (500, 484), data: False |-- (500, 14), data: (500, 30) @ (30, 14) |-- (250, 236), data: True |-- (250, 234), data: True ----- Solver_atoms: 1 -- 128 / 128 Time (Solver_compr_matrix_reshape): 0.004 Solver_block: 100 / 960 - Time: 1.364 Solver_block: 200 / 960 - Time: 1.193 Solver_block: 300 / 960 - Time: 1.199 Solver_block: 400 / 960 - Time: 1.193 Solver_block: 500 / 960 - Time: 1.193 Solver_block: 600 / 960 - Time: 1.196 Solver_block: 700 / 960 - Time: 1.199 Solver_block: 800 / 960 - Time: 1.194 Solver_block: 900 / 960 - Time: 1.173 Solver_block: 960 / 960 - Time: 0.845 Solver: Calculate X.T @ X and X.T @ y (disp @ compr @ eigvecs).T @ (disp @ compr @ eigvecs): 12.079 --------------------------------- Symfc end -------------------------------- Max drift of force constants: 0.00000000 (xx) 0.00000000 (xx) Permutation basis: 384/384 Permutation basis: 22848/22848 Construct permutation basis matrix. Finding block diagonal structure in projector. Using scipy connected_components. Rank of projector: 4752 Number of blocks in projector: 4752 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: 1024 Use submatrix version of eigh solver. (1) Block: 500 / 1024 (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: 1024 / 1024 (2) Block: 250 / 524 (2) 238 eigenvectors found. (2) Block: 524 / 524 (2) 260 eigenvectors found. (2) Complementary block size: 26 (2) Compute compressed projector. (2) Use standard solver. (2) 11 eigenvectors found. (1) 509 eigenvectors found. (1) Complementary block size: 31 (1) Compute compressed projector. (1) Use standard solver. (1) 15 eigenvectors found. --- Eigsh_solver_block: 2 / 6 --- Block_size: 1024 Use submatrix version of eigh solver. (1) Block: 500 / 1024 (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: 1024 / 1024 (2) Block: 250 / 524 (2) 239 eigenvectors found. (2) Block: 524 / 524 (2) 265 eigenvectors found. (2) Complementary block size: 20 (2) Compute compressed projector. (2) Use standard solver. (2) 9 eigenvectors found. (1) 513 eigenvectors found. (1) Complementary block size: 26 (1) Compute compressed projector. (1) Use standard solver. (1) 11 eigenvectors found. --- Eigsh_solver_block: 3 / 6 --- Block_size: 1024 Use submatrix version of eigh solver. (1) Block: 500 / 1024 (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: 1024 / 1024 (2) Block: 250 / 524 (2) 238 eigenvectors found. (2) Block: 524 / 524 (2) 260 eigenvectors found. (2) Complementary block size: 26 (2) Compute compressed projector. (2) Use standard solver. (2) 11 eigenvectors found. (1) 509 eigenvectors found. (1) Complementary block size: 31 (1) Compute compressed projector. (1) Use standard solver. (1) 15 eigenvectors found. --- Eigsh_solver_block: 4 / 6 --- Block_size: 560 Use submatrix version of eigh solver. (1) Block: 560 / 560 (2) Block: 250 / 560 (2) 242 eigenvectors found. (2) Block: 500 / 560 (2) 242 eigenvectors found. (2) Block: 560 / 560 (2) 54 eigenvectors found. (2) Complementary block size: 22 (2) Compute compressed projector. (2) Use standard solver. (2) 14 eigenvectors found. (1) 552 eigenvectors found. (1) Complementary block size: 7 (1) Compute compressed projector. (1) Use standard solver. (1) 0 eigenvectors found. --- Eigsh_solver_block: 5 / 6 --- Block_size: 560 Use submatrix version of eigh solver. (1) Block: 560 / 560 (2) Block: 250 / 560 (2) 242 eigenvectors found. (2) Block: 500 / 560 (2) 242 eigenvectors found. (2) Block: 560 / 560 (2) 54 eigenvectors found. (2) Complementary block size: 22 (2) Compute compressed projector. (2) Use standard solver. (2) 14 eigenvectors found. (1) 552 eigenvectors found. (1) Complementary block size: 7 (1) Compute compressed projector. (1) Use standard solver. (1) 0 eigenvectors found. --- Eigsh_solver_block: 6 / 6 --- Block_size: 560 Use submatrix version of eigh solver. (1) Block: 560 / 560 (2) Block: 250 / 560 (2) 242 eigenvectors found. (2) Block: 500 / 560 (2) 242 eigenvectors found. (2) Block: 560 / 560 (2) 54 eigenvectors found. (2) Complementary block size: 22 (2) Compute compressed projector. (2) Use standard solver. (2) 14 eigenvectors found. (1) 552 eigenvectors found. (1) Complementary block size: 7 (1) Compute compressed projector. (1) Use standard solver. (1) 0 eigenvectors found. Tree of FC basis block matrices: - (4752, 4681), data: False |-- (560, 552), data: False |-- (560, 552), data: False |-- (560, 14), data: (560, 22) @ (22, 14) |-- (60, 54), data: True |-- (250, 242), data: True |-- (250, 242), data: True |-- (560, 552), data: False |-- (560, 552), data: False |-- (560, 14), data: (560, 22) @ (22, 14) |-- (60, 54), data: True |-- (250, 242), data: True |-- (250, 242), data: True |-- (560, 552), data: False |-- (560, 552), data: False |-- (560, 14), data: (560, 22) @ (22, 14) |-- (60, 54), data: True |-- (250, 242), data: True |-- (250, 242), data: True |-- (1024, 1008), data: False |-- (1024, 15), data: (1024, 31) @ (31, 15) |-- (524, 509), data: False |-- (524, 11), data: (524, 26) @ (26, 11) |-- (274, 260), data: True |-- (250, 238), data: True |-- (500, 484), data: False |-- (500, 14), data: (500, 30) @ (30, 14) |-- (250, 236), data: True |-- (250, 234), data: True |-- (1024, 1009), data: False |-- (1024, 11), data: (1024, 26) @ (26, 11) |-- (524, 513), data: False |-- (524, 9), data: (524, 20) @ (20, 9) |-- (274, 265), data: True |-- (250, 239), data: True |-- (500, 485), data: False |-- (500, 13), data: (500, 28) @ (28, 13) |-- (250, 237), data: True |-- (250, 235), data: True |-- (1024, 1008), data: False |-- (1024, 15), data: (1024, 31) @ (31, 15) |-- (524, 509), data: False |-- (524, 11), data: (524, 26) @ (26, 11) |-- (274, 260), data: True |-- (250, 238), data: True |-- (500, 484), data: False |-- (500, 14), data: (500, 30) @ (30, 14) |-- (250, 236), data: True |-- (250, 234), data: True Max drift after symmetrization by symfc projector: 0.00000000 (xx) 0.00000000 (xx) 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 12:22:47]------------------------- _ ___ _ __ __| | / _ \ '_ \ / _` | | __/ | | | (_| | \___|_| |_|\__,_| ---------------------------- ------ calculate fc3 ------- ---------------------------- _ _____ _ __ | |__ ___ _ __ ___|___ / _ __ _ _ | '_ \| '_ \ / _ \| '_ \ / _ \ |_ \| '_ \| | | | | |_) | | | | (_) | | | | (_) |__) | |_) | |_| | | .__/|_| |_|\___/|_| |_|\___/____/| .__/ \__, | |_| |_| |___/ 3.23.0 -------------------------[time 2026-01-08 12:22:48]------------------------- Compiled with OpenMP support (max 128 threads). Running in phono3py.load mode. Python version 3.14.2 Spglib version 2.6.1 ----------------------------- General settings ----------------------------- Run mode: force constants HDF5 data compression filter: gzip Crystal structure was read from "phono3py_mlp_eval_fc3_disp.yaml.xz". Supercell (dim): [1 2 1] Primitive matrix: [0.5 0.5 0. ] [-0.5 0.5 0. ] [0. 0. 1.] Spacegroup: C2/c (15) ------------------------------ primitive cell ------------------------------ Lattice vectors: a 7.166446015001886 -3.317851634999999 0.000000000000000 b 7.166446015001886 3.317851634999999 0.000000000000000 c -5.462180259819114 0.000000000000000 8.654610456623876 Atomic positions (fractional): 1 Er 0.76720253475828 0.51224616479349 0.83437145506469 167.259 2 Er 0.29237359156747 0.77941432586238 0.96380478758248 167.259 3 Er 0.23279746524172 0.48775383520651 0.16562854493531 167.259 4 Er 0.51224616479349 0.76720253475828 0.33437145506469 167.259 5 Er 0.48775383520651 0.23279746524172 0.66562854493531 167.259 6 Er 0.70762640843253 0.22058567413762 0.03619521241752 167.259 7 Er 0.77941432586239 0.29237359156747 0.46380478758248 167.259 8 Er 0.22058567413762 0.70762640843253 0.53619521241752 167.259 9 Si 0.09046008696349 0.27418343933974 0.30857317190562 28.085 10 Si 0.90953991303651 0.72581656066026 0.69142682809438 28.085 11 Si 0.72581656066026 0.90953991303651 0.19142682809438 28.085 12 Si 0.27418343933974 0.09046008696349 0.80857317190562 28.085 13 O 0.84978843765674 0.55307510529781 0.67428612535376 15.999 14 O 0.59013120988850 0.17404123321284 0.18051695437333 15.999 15 O 0.08760433613834 0.08841163953607 0.64018672928053 15.999 16 O 0.86648917986322 0.73042624823592 0.05758419857646 15.999 17 O 0.15021156234326 0.44692489470219 0.32571387464624 15.999 18 O 0.42127666349450 0.61548473107053 0.39871763221785 15.999 19 O 0.55307510529781 0.84978843765674 0.17428612535376 15.999 20 O 0.17404123321284 0.59013120988850 0.68051695437333 15.999 21 O 0.13351082013678 0.26957375176408 0.94241580142354 15.999 22 O 0.61548473107053 0.42127666349450 0.89871763221785 15.999 23 O 0.38451526892947 0.57872333650550 0.10128236778215 15.999 24 O 0.91158836046393 0.91239566386166 0.85981327071947 15.999 25 O 0.40986879011150 0.82595876678716 0.81948304562667 15.999 26 O 0.26957375176408 0.13351082013678 0.44241580142354 15.999 27 O 0.08841163953607 0.08760433613834 0.14018672928053 15.999 28 O 0.44692489470219 0.15021156234326 0.82571387464624 15.999 29 O 0.91239566386166 0.91158836046393 0.35981327071947 15.999 30 O 0.57872333650550 0.38451526892947 0.60128236778215 15.999 31 O 0.82595876678716 0.40986879011150 0.31948304562667 15.999 32 O 0.73042624823592 0.86648917986322 0.55758419857646 15.999 -------------------------------- supercell --------------------------------- Lattice vectors: a 14.332892030003771 0.000000000000000 0.000000000000000 b 0.000000000000000 13.271406539999997 0.000000000000000 c -5.462180259819114 0.000000000000000 8.654610456623876 Atomic positions (fractional): 1 Er 0.13972434977588 0.18626090750880 0.83437145506469 167.259 > 1 2 Er 0.13972434977588 0.68626090750880 0.83437145506469 167.259 > 1 3 Er 0.03589395871492 0.37176018357373 0.96380478758248 167.259 > 3 4 Er 0.03589395871492 0.87176018357373 0.96380478758248 167.259 > 3 5 Er 0.86027565022412 0.31373909249120 0.16562854493531 167.259 > 5 6 Er 0.86027565022412 0.81373909249120 0.16562854493531 167.259 > 5 7 Er 0.13972434977588 0.31373909249120 0.33437145506469 167.259 > 7 8 Er 0.13972434977588 0.81373909249120 0.33437145506469 167.259 > 7 9 Er 0.86027565022412 0.18626090750880 0.66562854493531 167.259 > 9 10 Er 0.86027565022412 0.68626090750880 0.66562854493531 167.259 > 9 11 Er 0.96410604128508 0.12823981642627 0.03619521241752 167.259 > 11 12 Er 0.96410604128508 0.62823981642627 0.03619521241752 167.259 > 11 13 Er 0.03589395871492 0.12823981642627 0.46380478758248 167.259 > 13 14 Er 0.03589395871492 0.62823981642627 0.46380478758248 167.259 > 13 15 Er 0.96410604128508 0.37176018357373 0.53619521241752 167.259 > 15 16 Er 0.96410604128508 0.87176018357373 0.53619521241752 167.259 > 15 17 Er 0.63972434977588 0.43626090750880 0.83437145506469 167.259 > 1 18 Er 0.63972434977588 0.93626090750880 0.83437145506469 167.259 > 1 19 Er 0.53589395871492 0.12176018357373 0.96380478758248 167.259 > 3 20 Er 0.53589395871492 0.62176018357373 0.96380478758248 167.259 > 3 21 Er 0.36027565022412 0.06373909249120 0.16562854493531 167.259 > 5 22 Er 0.36027565022412 0.56373909249120 0.16562854493531 167.259 > 5 23 Er 0.63972434977588 0.06373909249120 0.33437145506469 167.259 > 7 24 Er 0.63972434977588 0.56373909249120 0.33437145506469 167.259 > 7 25 Er 0.36027565022412 0.43626090750880 0.66562854493531 167.259 > 9 26 Er 0.36027565022412 0.93626090750880 0.66562854493531 167.259 > 9 27 Er 0.46410604128507 0.37823981642627 0.03619521241752 167.259 > 11 28 Er 0.46410604128507 0.87823981642627 0.03619521241752 167.259 > 11 29 Er 0.53589395871492 0.37823981642627 0.46380478758248 167.259 > 13 30 Er 0.53589395871492 0.87823981642627 0.46380478758248 167.259 > 13 31 Er 0.46410604128507 0.12176018357373 0.53619521241752 167.259 > 15 32 Er 0.46410604128507 0.62176018357373 0.53619521241752 167.259 > 15 33 Si 0.68232176315161 0.29593083809406 0.30857317190562 28.085 > 33 34 Si 0.68232176315161 0.79593083809406 0.30857317190562 28.085 > 33 35 Si 0.31767823684838 0.20406916190594 0.69142682809438 28.085 > 35 36 Si 0.31767823684838 0.70406916190594 0.69142682809438 28.085 > 35 37 Si 0.81767823684839 0.04593083809406 0.19142682809438 28.085 > 37 38 Si 0.81767823684839 0.54593083809406 0.19142682809438 28.085 > 37 39 Si 0.18232176315161 0.45406916190594 0.80857317190562 28.085 > 39 40 Si 0.18232176315161 0.95406916190594 0.80857317190562 28.085 > 39 41 Si 0.18232176315161 0.04593083809406 0.30857317190562 28.085 > 33 42 Si 0.18232176315161 0.54593083809406 0.30857317190562 28.085 > 33 43 Si 0.81767823684839 0.45406916190594 0.69142682809438 28.085 > 35 44 Si 0.81767823684839 0.95406916190594 0.69142682809438 28.085 > 35 45 Si 0.31767823684838 0.29593083809406 0.19142682809438 28.085 > 37 46 Si 0.31767823684838 0.79593083809406 0.19142682809438 28.085 > 37 47 Si 0.68232176315161 0.20406916190594 0.80857317190562 28.085 > 39 48 Si 0.68232176315161 0.70406916190594 0.80857317190562 28.085 > 39 49 O 0.20143177147727 0.17582166691027 0.67428612535376 15.999 > 49 50 O 0.20143177147727 0.67582166691027 0.67428612535376 15.999 > 49 51 O 0.88208622155067 0.14597750583108 0.18051695437333 15.999 > 51 52 O 0.88208622155067 0.64597750583108 0.18051695437333 15.999 > 51 53 O 0.08800798783720 0.00020182584943 0.64018672928053 15.999 > 53 54 O 0.08800798783720 0.50020182584943 0.64018672928053 15.999 > 53 55 O 0.79845771404957 0.46598426709318 0.05758419857646 15.999 > 55 56 O 0.79845771404957 0.96598426709318 0.05758419857646 15.999 > 55 57 O 0.79856822852273 0.32417833308973 0.32571387464624 15.999 > 57 58 O 0.79856822852273 0.82417833308973 0.32571387464624 15.999 > 57 59 O 0.01838069728252 0.29855201689401 0.39871763221785 15.999 > 59 60 O 0.01838069728252 0.79855201689401 0.39871763221785 15.999 > 59 61 O 0.70143177147727 0.07417833308973 0.17428612535376 15.999 > 61 62 O 0.70143177147727 0.57417833308973 0.17428612535376 15.999 > 61 63 O 0.88208622155067 0.35402249416892 0.68051695437333 15.999 > 63 64 O 0.88208622155067 0.85402249416892 0.68051695437333 15.999 > 63 65 O 0.20154228595043 0.03401573290682 0.94241580142354 15.999 > 65 66 O 0.20154228595043 0.53401573290682 0.94241580142354 15.999 > 65 67 O 0.01838069728252 0.20144798310599 0.89871763221785 15.999 > 67 68 O 0.01838069728252 0.70144798310599 0.89871763221785 15.999 > 67 69 O 0.98161930271748 0.29855201689401 0.10128236778215 15.999 > 69 70 O 0.98161930271748 0.79855201689401 0.10128236778215 15.999 > 69 71 O 0.41199201216280 0.25020182584943 0.85981327071947 15.999 > 71 72 O 0.41199201216280 0.75020182584943 0.85981327071947 15.999 > 71 73 O 0.11791377844933 0.35402249416892 0.81948304562667 15.999 > 73 74 O 0.11791377844933 0.85402249416892 0.81948304562667 15.999 > 73 75 O 0.20154228595043 0.46598426709318 0.44241580142354 15.999 > 75 76 O 0.20154228595043 0.96598426709318 0.44241580142354 15.999 > 75 77 O 0.58800798783720 0.24979817415057 0.14018672928053 15.999 > 77 78 O 0.58800798783720 0.74979817415057 0.14018672928053 15.999 > 77 79 O 0.29856822852273 0.42582166691027 0.82571387464624 15.999 > 79 80 O 0.29856822852273 0.92582166691027 0.82571387464624 15.999 > 79 81 O 0.91199201216280 0.49979817415057 0.35981327071947 15.999 > 81 82 O 0.91199201216280 0.99979817415057 0.35981327071947 15.999 > 81 83 O 0.98161930271748 0.20144798310599 0.60128236778215 15.999 > 83 84 O 0.98161930271748 0.70144798310599 0.60128236778215 15.999 > 83 85 O 0.11791377844933 0.14597750583108 0.31948304562667 15.999 > 85 86 O 0.11791377844933 0.64597750583108 0.31948304562667 15.999 > 85 87 O 0.79845771404957 0.03401573290682 0.55758419857646 15.999 > 87 88 O 0.79845771404957 0.53401573290682 0.55758419857646 15.999 > 87 89 O 0.70143177147727 0.42582166691027 0.67428612535376 15.999 > 49 90 O 0.70143177147727 0.92582166691027 0.67428612535376 15.999 > 49 91 O 0.38208622155067 0.39597750583108 0.18051695437333 15.999 > 51 92 O 0.38208622155067 0.89597750583108 0.18051695437333 15.999 > 51 93 O 0.58800798783720 0.25020182584943 0.64018672928053 15.999 > 53 94 O 0.58800798783720 0.75020182584943 0.64018672928053 15.999 > 53 95 O 0.29845771404957 0.21598426709318 0.05758419857646 15.999 > 55 96 O 0.29845771404957 0.71598426709318 0.05758419857646 15.999 > 55 97 O 0.29856822852273 0.07417833308973 0.32571387464624 15.999 > 57 98 O 0.29856822852273 0.57417833308973 0.32571387464624 15.999 > 57 99 O 0.51838069728252 0.04855201689401 0.39871763221785 15.999 > 59 100 O 0.51838069728252 0.54855201689401 0.39871763221785 15.999 > 59 101 O 0.20143177147727 0.32417833308973 0.17428612535376 15.999 > 61 102 O 0.20143177147727 0.82417833308973 0.17428612535376 15.999 > 61 103 O 0.38208622155067 0.10402249416892 0.68051695437333 15.999 > 63 104 O 0.38208622155067 0.60402249416892 0.68051695437333 15.999 > 63 105 O 0.70154228595043 0.28401573290682 0.94241580142354 15.999 > 65 106 O 0.70154228595043 0.78401573290682 0.94241580142354 15.999 > 65 107 O 0.51838069728252 0.45144798310599 0.89871763221785 15.999 > 67 108 O 0.51838069728252 0.95144798310599 0.89871763221785 15.999 > 67 109 O 0.48161930271748 0.04855201689401 0.10128236778215 15.999 > 69 110 O 0.48161930271748 0.54855201689401 0.10128236778215 15.999 > 69 111 O 0.91199201216280 0.00020182584943 0.85981327071947 15.999 > 71 112 O 0.91199201216280 0.50020182584943 0.85981327071947 15.999 > 71 113 O 0.61791377844933 0.10402249416892 0.81948304562667 15.999 > 73 114 O 0.61791377844933 0.60402249416892 0.81948304562667 15.999 > 73 115 O 0.70154228595043 0.21598426709318 0.44241580142354 15.999 > 75 116 O 0.70154228595043 0.71598426709318 0.44241580142354 15.999 > 75 117 O 0.08800798783720 0.49979817415057 0.14018672928053 15.999 > 77 118 O 0.08800798783720 0.99979817415057 0.14018672928053 15.999 > 77 119 O 0.79856822852273 0.17582166691027 0.82571387464624 15.999 > 79 120 O 0.79856822852273 0.67582166691027 0.82571387464624 15.999 > 79 121 O 0.41199201216280 0.24979817415057 0.35981327071947 15.999 > 81 122 O 0.41199201216280 0.74979817415057 0.35981327071947 15.999 > 81 123 O 0.48161930271748 0.45144798310599 0.60128236778215 15.999 > 83 124 O 0.48161930271748 0.95144798310599 0.60128236778215 15.999 > 83 125 O 0.61791377844933 0.39597750583108 0.31948304562667 15.999 > 85 126 O 0.61791377844933 0.89597750583108 0.31948304562667 15.999 > 85 127 O 0.29845771404957 0.28401573290682 0.55758419857646 15.999 > 87 128 O 0.29845771404957 0.78401573290682 0.55758419857646 15.999 > 87 ---------------------------------------------------------------------------- NAC parameters were read from "phono3py_mlp_eval_fc3_disp.yaml.xz". --------------------------- Dielectric constant ---------------------------- 3.5322925 0.0000000 -0.0328378 0.0000000 3.5191752 0.0000000 -0.0328065 0.0000000 3.6134196 -------------------------- Born effective charges -------------------------- 1 Er 3.8289972 -0.4475072 -0.0338485 -0.4248230 3.6328161 -0.1161664 0.1210250 -0.1134513 3.8265455 2 Er 3.3593912 -0.1041723 -0.2212887 -0.1227900 3.7587641 -0.0035305 -0.2609645 -0.0086440 3.9600371 3 Er 3.8289972 -0.4475072 -0.0338485 -0.4248230 3.6328161 -0.1161664 0.1210250 -0.1134513 3.8265455 4 Er 3.8289972 0.4475072 -0.0338485 0.4248230 3.6328161 0.1161664 0.1210250 0.1134513 3.8265455 5 Er 3.8289972 0.4475072 -0.0338485 0.4248230 3.6328161 0.1161664 0.1210250 0.1134513 3.8265455 6 Er 3.3593912 -0.1041723 -0.2212887 -0.1227900 3.7587641 -0.0035305 -0.2609645 -0.0086440 3.9600371 7 Er 3.3593912 0.1041723 -0.2212887 0.1227900 3.7587641 0.0035305 -0.2609645 0.0086440 3.9600371 8 Er 3.3593912 0.1041723 -0.2212887 0.1227900 3.7587641 0.0035305 -0.2609645 0.0086440 3.9600371 9 Si 3.4222138 -0.1101648 0.2991125 -0.0494491 3.1210115 -0.1097387 0.1573289 -0.0147237 3.0471476 10 Si 3.4222138 -0.1101648 0.2991125 -0.0494491 3.1210115 -0.1097387 0.1573289 -0.0147237 3.0471476 11 Si 3.4222138 0.1101648 0.2991125 0.0494491 3.1210115 0.1097387 0.1573289 0.0147237 3.0471476 12 Si 3.4222138 0.1101648 0.2991125 0.0494491 3.1210115 0.1097387 0.1573289 0.0147237 3.0471476 13 O -2.9346576 -0.2708202 0.0050289 -0.3071036 -1.3504088 -0.1780837 -0.0464377 -0.1728699 -1.9258084 14 O -2.0048398 -0.3932289 0.1706151 -0.4110449 -2.5018078 0.1047064 0.2014447 0.1330464 -1.8361724 15 O -1.4198739 -0.2715106 -0.3575930 -0.2632322 -2.3325359 0.3646958 -0.3629527 0.2670824 -2.3464759 16 O -1.4951992 0.1944357 -0.3118556 0.1852867 -2.3053725 -0.2379332 -0.2585581 -0.2560449 -2.3916950 17 O -2.9346576 -0.2708202 0.0050289 -0.3071036 -1.3504088 -0.1780837 -0.0464377 -0.1728699 -1.9258084 18 O -2.7560316 0.1796317 0.4498292 0.2526433 -2.0224668 0.0158846 0.4491145 0.0960265 -2.3335785 19 O -2.9346576 0.2708202 0.0050289 0.3071036 -1.3504088 0.1780837 -0.0464377 0.1728699 -1.9258084 20 O -2.0048398 0.3932289 0.1706151 0.4110449 -2.5018078 -0.1047064 0.2014447 -0.1330464 -1.8361724 21 O -1.4951992 0.1944357 -0.3118556 0.1852867 -2.3053725 -0.2379332 -0.2585581 -0.2560449 -2.3916950 22 O -2.7560316 -0.1796317 0.4498292 -0.2526433 -2.0224668 -0.0158846 0.4491145 -0.0960265 -2.3335785 23 O -2.7560316 -0.1796317 0.4498292 -0.2526433 -2.0224668 -0.0158846 0.4491145 -0.0960265 -2.3335785 24 O -1.4198739 0.2715106 -0.3575930 0.2632322 -2.3325359 -0.3646958 -0.3629527 -0.2670824 -2.3464759 25 O -2.0048398 -0.3932289 0.1706151 -0.4110449 -2.5018078 0.1047064 0.2014447 0.1330464 -1.8361724 26 O -1.4951992 -0.1944357 -0.3118556 -0.1852867 -2.3053725 0.2379332 -0.2585581 0.2560449 -2.3916950 27 O -1.4198739 0.2715106 -0.3575930 0.2632322 -2.3325359 -0.3646958 -0.3629527 -0.2670824 -2.3464759 28 O -2.9346576 0.2708202 0.0050289 0.3071036 -1.3504088 0.1780837 -0.0464377 0.1728699 -1.9258084 29 O -1.4198739 -0.2715106 -0.3575930 -0.2632322 -2.3325359 0.3646958 -0.3629527 0.2670824 -2.3464759 30 O -2.7560316 0.1796317 0.4498292 0.2526433 -2.0224668 0.0158846 0.4491145 0.0960265 -2.3335785 31 O -2.0048398 0.3932289 0.1706151 0.4110449 -2.5018078 -0.1047064 0.2014447 -0.1330464 -1.8361724 32 O -1.4951992 -0.1944357 -0.3118556 -0.1852867 -2.3053725 0.2379332 -0.2585581 0.2560449 -2.3916950 ---------------------------------------------------------------------------- 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] [-0.0053 0.0000 0.0085] [ 0.0053 0.0000 -0.0085] Computing fc3[ 3, 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] [-0.0053 0.0000 0.0085] [ 0.0053 0.0000 -0.0085] Computing fc3[ 33, 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] [-0.0053 0.0000 0.0085] [ 0.0053 0.0000 -0.0085] 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] [-0.0053 0.0000 0.0085] [ 0.0053 0.0000 -0.0085] Computing fc3[ 51, 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] [-0.0053 0.0000 0.0085] [ 0.0053 0.0000 -0.0085] Computing fc3[ 53, 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] [-0.0053 0.0000 0.0085] [ 0.0053 0.0000 -0.0085] Computing fc3[ 55, 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] [-0.0053 0.0000 0.0085] [ 0.0053 0.0000 -0.0085] Computing fc3[ 59, 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] [-0.0053 0.0000 0.0085] [ 0.0053 0.0000 -0.0085] Expanding fc3. Symmetrizing fc3 by traditional approach (N=3). Symmetrizing fc2 by traditional approach (N=3). Max drift of fc3: 0.00000000 (xxx) 0.00000000 (xxx) 0.00000000 (xxx) fc3 was written into "fc3.hdf5". Max drift of fc2: 0.00000000 (yz) 0.00000000 (yz) fc2 was written into "fc2.hdf5". --------------------------- Calculation settings --------------------------- Non-analytical term correction (NAC): True NAC unit conversion factor: 14.39965 BZ integration: Tetrahedron-method Temperatures: 0.0 300.0 Cutoff frequency: 0.01 Frequency conversion factor to THz: 15.63330 ----------- None of ph-ph interaction calculation was performed. ----------- Summary of calculation was written in "phono3py.yaml". -------------------------[time 2026-01-08 12:23:34]------------------------- _ ___ _ __ __| | / _ \ '_ \ / _` | | __/ | | | (_| | \___|_| |_|\__,_| ---------------------------- ------ calculate LTC ------- ---------------------------- _ _____ _ __ | |__ ___ _ __ ___|___ / _ __ _ _ | '_ \| '_ \ / _ \| '_ \ / _ \ |_ \| '_ \| | | | | |_) | | | | (_) | | | | (_) |__) | |_) | |_| | | .__/|_| |_|\___/|_| |_|\___/____/| .__/ \__, | |_| |_| |___/ 3.23.0 -------------------------[time 2026-01-08 12:23:34]------------------------- Compiled with OpenMP support (max 128 threads). Running in phono3py.load mode. Python version 3.14.2 Spglib version 2.6.1 ----------------------------- General settings ----------------------------- Run mode: conductivity-RTA HDF5 data compression filter: gzip Crystal structure was read from "phono3py.yaml". Supercell (dim): [1 2 1] Primitive matrix: [0.5 0.5 0. ] [-0.5 0.5 0. ] [0. 0. 1.] Spacegroup: C2/c (15) ------------------------------ primitive cell ------------------------------ Lattice vectors: a 7.166446015001886 -3.317851634999999 0.000000000000000 b 7.166446015001886 3.317851634999999 0.000000000000000 c -5.462180259819114 0.000000000000000 8.654610456623876 Atomic positions (fractional): 1 Er 0.76720253475828 0.51224616479349 0.83437145506469 167.259 2 Er 0.29237359156747 0.77941432586238 0.96380478758248 167.259 3 Er 0.23279746524172 0.48775383520651 0.16562854493531 167.259 4 Er 0.51224616479349 0.76720253475828 0.33437145506469 167.259 5 Er 0.48775383520651 0.23279746524172 0.66562854493531 167.259 6 Er 0.70762640843253 0.22058567413762 0.03619521241752 167.259 7 Er 0.77941432586239 0.29237359156747 0.46380478758248 167.259 8 Er 0.22058567413762 0.70762640843253 0.53619521241752 167.259 9 Si 0.09046008696349 0.27418343933974 0.30857317190562 28.085 10 Si 0.90953991303651 0.72581656066026 0.69142682809438 28.085 11 Si 0.72581656066026 0.90953991303651 0.19142682809438 28.085 12 Si 0.27418343933974 0.09046008696349 0.80857317190562 28.085 13 O 0.84978843765674 0.55307510529781 0.67428612535376 15.999 14 O 0.59013120988850 0.17404123321284 0.18051695437333 15.999 15 O 0.08760433613834 0.08841163953607 0.64018672928053 15.999 16 O 0.86648917986322 0.73042624823592 0.05758419857646 15.999 17 O 0.15021156234326 0.44692489470219 0.32571387464624 15.999 18 O 0.42127666349450 0.61548473107053 0.39871763221785 15.999 19 O 0.55307510529781 0.84978843765674 0.17428612535376 15.999 20 O 0.17404123321284 0.59013120988850 0.68051695437333 15.999 21 O 0.13351082013678 0.26957375176408 0.94241580142354 15.999 22 O 0.61548473107053 0.42127666349450 0.89871763221785 15.999 23 O 0.38451526892947 0.57872333650550 0.10128236778215 15.999 24 O 0.91158836046393 0.91239566386166 0.85981327071947 15.999 25 O 0.40986879011150 0.82595876678716 0.81948304562667 15.999 26 O 0.26957375176408 0.13351082013678 0.44241580142354 15.999 27 O 0.08841163953607 0.08760433613834 0.14018672928053 15.999 28 O 0.44692489470219 0.15021156234326 0.82571387464624 15.999 29 O 0.91239566386166 0.91158836046393 0.35981327071947 15.999 30 O 0.57872333650550 0.38451526892947 0.60128236778215 15.999 31 O 0.82595876678716 0.40986879011150 0.31948304562667 15.999 32 O 0.73042624823592 0.86648917986322 0.55758419857646 15.999 -------------------------------- supercell --------------------------------- Lattice vectors: a 14.332892030003771 0.000000000000000 0.000000000000000 b 0.000000000000000 13.271406539999997 0.000000000000000 c -5.462180259819114 0.000000000000000 8.654610456623876 Atomic positions (fractional): 1 Er 0.13972434977588 0.18626090750880 0.83437145506469 167.259 > 1 2 Er 0.13972434977588 0.68626090750880 0.83437145506469 167.259 > 1 3 Er 0.03589395871492 0.37176018357373 0.96380478758248 167.259 > 3 4 Er 0.03589395871492 0.87176018357373 0.96380478758248 167.259 > 3 5 Er 0.86027565022412 0.31373909249120 0.16562854493531 167.259 > 5 6 Er 0.86027565022412 0.81373909249120 0.16562854493531 167.259 > 5 7 Er 0.13972434977588 0.31373909249120 0.33437145506469 167.259 > 7 8 Er 0.13972434977588 0.81373909249120 0.33437145506469 167.259 > 7 9 Er 0.86027565022412 0.18626090750880 0.66562854493531 167.259 > 9 10 Er 0.86027565022412 0.68626090750880 0.66562854493531 167.259 > 9 11 Er 0.96410604128508 0.12823981642627 0.03619521241752 167.259 > 11 12 Er 0.96410604128508 0.62823981642627 0.03619521241752 167.259 > 11 13 Er 0.03589395871492 0.12823981642627 0.46380478758248 167.259 > 13 14 Er 0.03589395871492 0.62823981642627 0.46380478758248 167.259 > 13 15 Er 0.96410604128508 0.37176018357373 0.53619521241752 167.259 > 15 16 Er 0.96410604128508 0.87176018357373 0.53619521241752 167.259 > 15 17 Er 0.63972434977588 0.43626090750880 0.83437145506469 167.259 > 1 18 Er 0.63972434977588 0.93626090750880 0.83437145506469 167.259 > 1 19 Er 0.53589395871492 0.12176018357373 0.96380478758248 167.259 > 3 20 Er 0.53589395871492 0.62176018357373 0.96380478758248 167.259 > 3 21 Er 0.36027565022412 0.06373909249120 0.16562854493531 167.259 > 5 22 Er 0.36027565022412 0.56373909249120 0.16562854493531 167.259 > 5 23 Er 0.63972434977588 0.06373909249120 0.33437145506469 167.259 > 7 24 Er 0.63972434977588 0.56373909249120 0.33437145506469 167.259 > 7 25 Er 0.36027565022412 0.43626090750880 0.66562854493531 167.259 > 9 26 Er 0.36027565022412 0.93626090750880 0.66562854493531 167.259 > 9 27 Er 0.46410604128507 0.37823981642627 0.03619521241752 167.259 > 11 28 Er 0.46410604128507 0.87823981642627 0.03619521241752 167.259 > 11 29 Er 0.53589395871492 0.37823981642627 0.46380478758248 167.259 > 13 30 Er 0.53589395871492 0.87823981642627 0.46380478758248 167.259 > 13 31 Er 0.46410604128507 0.12176018357373 0.53619521241752 167.259 > 15 32 Er 0.46410604128507 0.62176018357373 0.53619521241752 167.259 > 15 33 Si 0.68232176315161 0.29593083809406 0.30857317190562 28.085 > 33 34 Si 0.68232176315161 0.79593083809406 0.30857317190562 28.085 > 33 35 Si 0.31767823684838 0.20406916190594 0.69142682809438 28.085 > 35 36 Si 0.31767823684838 0.70406916190594 0.69142682809438 28.085 > 35 37 Si 0.81767823684839 0.04593083809406 0.19142682809438 28.085 > 37 38 Si 0.81767823684839 0.54593083809406 0.19142682809438 28.085 > 37 39 Si 0.18232176315161 0.45406916190594 0.80857317190562 28.085 > 39 40 Si 0.18232176315161 0.95406916190594 0.80857317190562 28.085 > 39 41 Si 0.18232176315161 0.04593083809406 0.30857317190562 28.085 > 33 42 Si 0.18232176315161 0.54593083809406 0.30857317190562 28.085 > 33 43 Si 0.81767823684839 0.45406916190594 0.69142682809438 28.085 > 35 44 Si 0.81767823684839 0.95406916190594 0.69142682809438 28.085 > 35 45 Si 0.31767823684838 0.29593083809406 0.19142682809438 28.085 > 37 46 Si 0.31767823684838 0.79593083809406 0.19142682809438 28.085 > 37 47 Si 0.68232176315161 0.20406916190594 0.80857317190562 28.085 > 39 48 Si 0.68232176315161 0.70406916190594 0.80857317190562 28.085 > 39 49 O 0.20143177147727 0.17582166691027 0.67428612535376 15.999 > 49 50 O 0.20143177147727 0.67582166691027 0.67428612535376 15.999 > 49 51 O 0.88208622155067 0.14597750583108 0.18051695437333 15.999 > 51 52 O 0.88208622155067 0.64597750583108 0.18051695437333 15.999 > 51 53 O 0.08800798783720 0.00020182584943 0.64018672928053 15.999 > 53 54 O 0.08800798783720 0.50020182584943 0.64018672928053 15.999 > 53 55 O 0.79845771404957 0.46598426709318 0.05758419857646 15.999 > 55 56 O 0.79845771404957 0.96598426709318 0.05758419857646 15.999 > 55 57 O 0.79856822852273 0.32417833308973 0.32571387464624 15.999 > 57 58 O 0.79856822852273 0.82417833308973 0.32571387464624 15.999 > 57 59 O 0.01838069728252 0.29855201689401 0.39871763221785 15.999 > 59 60 O 0.01838069728252 0.79855201689401 0.39871763221785 15.999 > 59 61 O 0.70143177147727 0.07417833308973 0.17428612535376 15.999 > 61 62 O 0.70143177147727 0.57417833308973 0.17428612535376 15.999 > 61 63 O 0.88208622155067 0.35402249416892 0.68051695437333 15.999 > 63 64 O 0.88208622155067 0.85402249416892 0.68051695437333 15.999 > 63 65 O 0.20154228595043 0.03401573290682 0.94241580142354 15.999 > 65 66 O 0.20154228595043 0.53401573290682 0.94241580142354 15.999 > 65 67 O 0.01838069728252 0.20144798310599 0.89871763221785 15.999 > 67 68 O 0.01838069728252 0.70144798310599 0.89871763221785 15.999 > 67 69 O 0.98161930271748 0.29855201689401 0.10128236778215 15.999 > 69 70 O 0.98161930271748 0.79855201689401 0.10128236778215 15.999 > 69 71 O 0.41199201216280 0.25020182584943 0.85981327071947 15.999 > 71 72 O 0.41199201216280 0.75020182584943 0.85981327071947 15.999 > 71 73 O 0.11791377844933 0.35402249416892 0.81948304562667 15.999 > 73 74 O 0.11791377844933 0.85402249416892 0.81948304562667 15.999 > 73 75 O 0.20154228595043 0.46598426709318 0.44241580142354 15.999 > 75 76 O 0.20154228595043 0.96598426709318 0.44241580142354 15.999 > 75 77 O 0.58800798783720 0.24979817415057 0.14018672928053 15.999 > 77 78 O 0.58800798783720 0.74979817415057 0.14018672928053 15.999 > 77 79 O 0.29856822852273 0.42582166691027 0.82571387464624 15.999 > 79 80 O 0.29856822852273 0.92582166691027 0.82571387464624 15.999 > 79 81 O 0.91199201216280 0.49979817415057 0.35981327071947 15.999 > 81 82 O 0.91199201216280 0.99979817415057 0.35981327071947 15.999 > 81 83 O 0.98161930271748 0.20144798310599 0.60128236778215 15.999 > 83 84 O 0.98161930271748 0.70144798310599 0.60128236778215 15.999 > 83 85 O 0.11791377844933 0.14597750583108 0.31948304562667 15.999 > 85 86 O 0.11791377844933 0.64597750583108 0.31948304562667 15.999 > 85 87 O 0.79845771404957 0.03401573290682 0.55758419857646 15.999 > 87 88 O 0.79845771404957 0.53401573290682 0.55758419857646 15.999 > 87 89 O 0.70143177147727 0.42582166691027 0.67428612535376 15.999 > 49 90 O 0.70143177147727 0.92582166691027 0.67428612535376 15.999 > 49 91 O 0.38208622155067 0.39597750583108 0.18051695437333 15.999 > 51 92 O 0.38208622155067 0.89597750583108 0.18051695437333 15.999 > 51 93 O 0.58800798783720 0.25020182584943 0.64018672928053 15.999 > 53 94 O 0.58800798783720 0.75020182584943 0.64018672928053 15.999 > 53 95 O 0.29845771404957 0.21598426709318 0.05758419857646 15.999 > 55 96 O 0.29845771404957 0.71598426709318 0.05758419857646 15.999 > 55 97 O 0.29856822852273 0.07417833308973 0.32571387464624 15.999 > 57 98 O 0.29856822852273 0.57417833308973 0.32571387464624 15.999 > 57 99 O 0.51838069728252 0.04855201689401 0.39871763221785 15.999 > 59 100 O 0.51838069728252 0.54855201689401 0.39871763221785 15.999 > 59 101 O 0.20143177147727 0.32417833308973 0.17428612535376 15.999 > 61 102 O 0.20143177147727 0.82417833308973 0.17428612535376 15.999 > 61 103 O 0.38208622155067 0.10402249416892 0.68051695437333 15.999 > 63 104 O 0.38208622155067 0.60402249416892 0.68051695437333 15.999 > 63 105 O 0.70154228595043 0.28401573290682 0.94241580142354 15.999 > 65 106 O 0.70154228595043 0.78401573290682 0.94241580142354 15.999 > 65 107 O 0.51838069728252 0.45144798310599 0.89871763221785 15.999 > 67 108 O 0.51838069728252 0.95144798310599 0.89871763221785 15.999 > 67 109 O 0.48161930271748 0.04855201689401 0.10128236778215 15.999 > 69 110 O 0.48161930271748 0.54855201689401 0.10128236778215 15.999 > 69 111 O 0.91199201216280 0.00020182584943 0.85981327071947 15.999 > 71 112 O 0.91199201216280 0.50020182584943 0.85981327071947 15.999 > 71 113 O 0.61791377844933 0.10402249416892 0.81948304562667 15.999 > 73 114 O 0.61791377844933 0.60402249416892 0.81948304562667 15.999 > 73 115 O 0.70154228595043 0.21598426709318 0.44241580142354 15.999 > 75 116 O 0.70154228595043 0.71598426709318 0.44241580142354 15.999 > 75 117 O 0.08800798783720 0.49979817415057 0.14018672928053 15.999 > 77 118 O 0.08800798783720 0.99979817415057 0.14018672928053 15.999 > 77 119 O 0.79856822852273 0.17582166691027 0.82571387464624 15.999 > 79 120 O 0.79856822852273 0.67582166691027 0.82571387464624 15.999 > 79 121 O 0.41199201216280 0.24979817415057 0.35981327071947 15.999 > 81 122 O 0.41199201216280 0.74979817415057 0.35981327071947 15.999 > 81 123 O 0.48161930271748 0.45144798310599 0.60128236778215 15.999 > 83 124 O 0.48161930271748 0.95144798310599 0.60128236778215 15.999 > 83 125 O 0.61791377844933 0.39597750583108 0.31948304562667 15.999 > 85 126 O 0.61791377844933 0.89597750583108 0.31948304562667 15.999 > 85 127 O 0.29845771404957 0.28401573290682 0.55758419857646 15.999 > 87 128 O 0.29845771404957 0.78401573290682 0.55758419857646 15.999 > 87 ---------------------------------------------------------------------------- NAC parameters were read from "phono3py.yaml". --------------------------- Dielectric constant ---------------------------- 3.5322925 0.0000000 -0.0328378 0.0000000 3.5191752 0.0000000 -0.0328065 0.0000000 3.6134196 -------------------------- Born effective charges -------------------------- 1 Er 3.8289972 -0.4475072 -0.0338485 -0.4248230 3.6328161 -0.1161664 0.1210250 -0.1134513 3.8265455 2 Er 3.3593912 -0.1041723 -0.2212887 -0.1227900 3.7587641 -0.0035305 -0.2609645 -0.0086440 3.9600371 3 Er 3.8289972 -0.4475072 -0.0338485 -0.4248230 3.6328161 -0.1161664 0.1210250 -0.1134513 3.8265455 4 Er 3.8289972 0.4475072 -0.0338485 0.4248230 3.6328161 0.1161664 0.1210250 0.1134513 3.8265455 5 Er 3.8289972 0.4475072 -0.0338485 0.4248230 3.6328161 0.1161664 0.1210250 0.1134513 3.8265455 6 Er 3.3593912 -0.1041723 -0.2212887 -0.1227900 3.7587641 -0.0035305 -0.2609645 -0.0086440 3.9600371 7 Er 3.3593912 0.1041723 -0.2212887 0.1227900 3.7587641 0.0035305 -0.2609645 0.0086440 3.9600371 8 Er 3.3593912 0.1041723 -0.2212887 0.1227900 3.7587641 0.0035305 -0.2609645 0.0086440 3.9600371 9 Si 3.4222138 -0.1101648 0.2991125 -0.0494491 3.1210115 -0.1097387 0.1573289 -0.0147237 3.0471476 10 Si 3.4222138 -0.1101648 0.2991125 -0.0494491 3.1210115 -0.1097387 0.1573289 -0.0147237 3.0471476 11 Si 3.4222138 0.1101648 0.2991125 0.0494491 3.1210115 0.1097387 0.1573289 0.0147237 3.0471476 12 Si 3.4222138 0.1101648 0.2991125 0.0494491 3.1210115 0.1097387 0.1573289 0.0147237 3.0471476 13 O -2.9346576 -0.2708202 0.0050289 -0.3071036 -1.3504088 -0.1780837 -0.0464377 -0.1728699 -1.9258084 14 O -2.0048398 -0.3932289 0.1706151 -0.4110449 -2.5018078 0.1047064 0.2014447 0.1330464 -1.8361724 15 O -1.4198739 -0.2715106 -0.3575930 -0.2632322 -2.3325359 0.3646958 -0.3629527 0.2670824 -2.3464759 16 O -1.4951992 0.1944357 -0.3118556 0.1852867 -2.3053725 -0.2379332 -0.2585581 -0.2560449 -2.3916950 17 O -2.9346576 -0.2708202 0.0050289 -0.3071036 -1.3504088 -0.1780837 -0.0464377 -0.1728699 -1.9258084 18 O -2.7560316 0.1796317 0.4498292 0.2526433 -2.0224668 0.0158846 0.4491145 0.0960265 -2.3335785 19 O -2.9346576 0.2708202 0.0050289 0.3071036 -1.3504088 0.1780837 -0.0464377 0.1728699 -1.9258084 20 O -2.0048398 0.3932289 0.1706151 0.4110449 -2.5018078 -0.1047064 0.2014447 -0.1330464 -1.8361724 21 O -1.4951992 0.1944357 -0.3118556 0.1852867 -2.3053725 -0.2379332 -0.2585581 -0.2560449 -2.3916950 22 O -2.7560316 -0.1796317 0.4498292 -0.2526433 -2.0224668 -0.0158846 0.4491145 -0.0960265 -2.3335785 23 O -2.7560316 -0.1796317 0.4498292 -0.2526433 -2.0224668 -0.0158846 0.4491145 -0.0960265 -2.3335785 24 O -1.4198739 0.2715106 -0.3575930 0.2632322 -2.3325359 -0.3646958 -0.3629527 -0.2670824 -2.3464759 25 O -2.0048398 -0.3932289 0.1706151 -0.4110449 -2.5018078 0.1047064 0.2014447 0.1330464 -1.8361724 26 O -1.4951992 -0.1944357 -0.3118556 -0.1852867 -2.3053725 0.2379332 -0.2585581 0.2560449 -2.3916950 27 O -1.4198739 0.2715106 -0.3575930 0.2632322 -2.3325359 -0.3646958 -0.3629527 -0.2670824 -2.3464759 28 O -2.9346576 0.2708202 0.0050289 0.3071036 -1.3504088 0.1780837 -0.0464377 0.1728699 -1.9258084 29 O -1.4198739 -0.2715106 -0.3575930 -0.2632322 -2.3325359 0.3646958 -0.3629527 0.2670824 -2.3464759 30 O -2.7560316 0.1796317 0.4498292 0.2526433 -2.0224668 0.0158846 0.4491145 0.0960265 -2.3335785 31 O -2.0048398 0.3932289 0.1706151 0.4110449 -2.5018078 -0.1047064 0.2014447 -0.1330464 -1.8361724 32 O -1.4951992 -0.1944357 -0.3118556 -0.1852867 -2.3053725 0.2379332 -0.2585581 0.2560449 -2.3916950 ---------------------------------------------------------------------------- fc3 was read from "fc3.hdf5". fc2 was read from "fc2.hdf5". ----------------------------- Force constants ------------------------------ Max drift of fc3: 0.00000000 (xxx) 0.00000000 (xxx) 0.00000000 (xxx) Max drift of fc2: 0.00000000 (xx) 0.00000000 (xx) --------------------------- 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 ... [ 9 9 6 ] 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: 307, Lambda: 0.11 Running harmonic phonon calculations... -------------------- Lattice thermal conductivity (RTA) -------------------- ======================= Grid point 0 (1/140) ======================= q-point: ( 0.00 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 7.23e-05 7.23e-05 7.23e-05 7.23e-05 7.23e-05 7.23e-05 7.23e-05 7.23e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 140 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 1.381 ( 0.000 0.000 0.000) 0.000 2.065 ( 0.000 0.000 0.000) 0.000 2.226 ( 0.000 0.000 0.000) 0.000 2.503 ( 0.000 0.000 0.000) 0.000 2.595 ( 0.000 0.000 0.000) 0.000 2.617 ( 0.000 0.000 0.000) 0.000 2.669 ( 0.000 0.000 0.000) 0.000 2.939 ( 0.000 0.000 0.000) 0.000 3.470 ( 0.000 0.000 0.000) 0.000 3.584 ( 0.000 0.000 0.000) 0.000 3.588 ( 0.000 0.000 0.000) 0.000 3.671 ( 0.000 0.000 0.000) 0.000 3.742 ( 0.000 0.000 0.000) 0.000 4.199 ( 0.000 0.000 0.000) 0.000 4.261 ( 0.000 0.000 0.000) 0.000 4.347 ( 0.000 0.000 0.000) 0.000 4.569 ( 0.000 0.000 0.000) 0.000 4.585 ( 0.000 0.000 0.000) 0.000 4.643 ( 0.000 0.000 0.000) 0.000 4.747 ( 0.000 0.000 0.000) 0.000 5.232 ( 0.000 0.000 0.000) 0.000 5.235 ( 0.000 0.000 0.000) 0.000 5.258 ( 0.000 0.000 0.000) 0.000 5.672 ( 0.000 0.000 0.000) 0.000 5.841 ( 0.000 0.000 0.000) 0.000 6.108 ( 0.000 0.000 0.000) 0.000 6.151 ( 0.000 0.000 0.000) 0.000 6.329 ( 0.000 0.000 0.000) 0.000 6.353 ( 0.000 0.000 0.000) 0.000 6.457 ( 0.000 0.000 0.000) 0.000 6.468 ( 0.000 0.000 0.000) 0.000 6.787 ( 0.000 0.000 0.000) 0.000 6.920 ( 0.000 0.000 0.000) 0.000 7.326 ( 0.000 0.000 0.000) 0.000 7.347 ( 0.000 0.000 0.000) 0.000 7.762 ( 0.000 0.000 0.000) 0.000 7.860 ( 0.000 0.000 0.000) 0.000 8.382 ( 0.000 0.000 0.000) 0.000 8.902 ( 0.000 0.000 0.000) 0.000 8.921 ( 0.000 0.000 0.000) 0.000 9.118 ( 0.000 0.000 0.000) 0.000 9.265 ( 0.000 0.000 0.000) 0.000 9.353 ( 0.000 0.000 0.000) 0.000 9.468 ( 0.000 0.000 0.000) 0.000 9.947 ( 0.000 0.000 0.000) 0.000 10.115 ( 0.000 0.000 0.000) 0.000 10.347 ( 0.000 0.000 0.000) 0.000 10.552 ( 0.000 0.000 0.000) 0.000 11.005 ( 0.000 0.000 0.000) 0.000 11.056 ( 0.000 0.000 0.000) 0.000 11.236 ( 0.000 0.000 0.000) 0.000 11.240 ( 0.000 0.000 0.000) 0.000 11.795 ( 0.000 0.000 0.000) 0.000 11.833 ( 0.000 0.000 0.000) 0.000 12.008 ( 0.000 0.000 0.000) 0.000 12.112 ( 0.000 0.000 0.000) 0.000 12.526 ( 0.000 0.000 0.000) 0.000 12.614 ( 0.000 0.000 0.000) 0.000 12.746 ( 0.000 0.000 0.000) 0.000 12.759 ( 0.000 0.000 0.000) 0.000 13.530 ( 0.000 0.000 0.000) 0.000 14.897 ( 0.000 0.000 0.000) 0.000 14.954 ( 0.000 0.000 0.000) 0.000 15.044 ( 0.000 0.000 0.000) 0.000 15.093 ( 0.000 0.000 0.000) 0.000 15.156 ( 0.000 0.000 0.000) 0.000 15.516 ( 0.000 0.000 0.000) 0.000 15.720 ( 0.000 0.000 0.000) 0.000 15.751 ( 0.000 0.000 0.000) 0.000 15.900 ( 0.000 0.000 0.000) 0.000 16.193 ( 0.000 0.000 0.000) 0.000 16.385 ( 0.000 0.000 0.000) 0.000 16.558 ( 0.000 0.000 0.000) 0.000 16.775 ( 0.000 0.000 0.000) 0.000 17.097 ( 0.000 0.000 0.000) 0.000 17.689 ( 0.000 0.000 0.000) 0.000 18.030 ( 0.000 0.000 0.000) 0.000 25.616 ( 0.000 0.000 0.000) 0.000 25.694 ( 0.000 0.000 0.000) 0.000 25.764 ( 0.000 0.000 0.000) 0.000 25.888 ( 0.000 0.000 0.000) 0.000 25.973 ( 0.000 0.000 0.000) 0.000 26.232 ( 0.000 0.000 0.000) 0.000 26.590 ( 0.000 0.000 0.000) 0.000 26.642 ( 0.000 0.000 0.000) 0.000 26.816 ( 0.000 0.000 0.000) 0.000 27.144 ( 0.000 0.000 0.000) 0.000 27.922 ( 0.000 0.000 0.000) 0.000 28.450 ( 0.000 0.000 0.000) 0.000 28.476 ( 0.000 0.000 0.000) 0.000 28.625 ( 0.000 0.000 0.000) 0.000 28.766 ( 0.000 0.000 0.000) 0.000 29.496 ( 0.000 0.000 0.000) 0.000 ======================= Grid point 1 (2/140) ======================= q-point: ( 0.11 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 7.23e-05 7.23e-05 7.23e-05 7.23e-05 7.23e-05 7.23e-05 7.23e-05 7.23e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 244 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.473 ( 22.795 -17.933 -2.112) 29.080 0.637 ( 11.562 -26.642 17.374) 33.843 0.912 ( 20.869 -35.939 15.825) 44.470 1.539 ( 0.435 -16.550 3.168) 16.856 2.215 ( -3.384 -14.876 -2.149) 15.407 2.303 ( -5.660 -10.293 0.039) 11.747 2.491 ( 3.258 -0.424 -2.008) 3.850 2.597 ( -9.021 -8.525 0.764) 12.435 2.695 ( -3.959 -6.194 4.016) 8.377 2.760 ( 10.112 -6.384 -5.461) 13.147 2.959 ( 0.844 -1.466 0.919) 1.925 3.406 ( 1.646 11.411 -4.420) 12.347 3.469 ( -1.794 1.670 2.071) 3.209 3.605 ( 1.576 -0.674 1.333) 2.171 3.660 ( -0.493 0.655 -0.692) 1.073 3.897 ( -0.924 -10.867 -1.769) 11.049 4.148 ( -0.911 5.869 -0.749) 5.986 4.199 ( -5.182 4.853 -0.649) 7.129 4.396 ( 1.336 -3.079 3.404) 4.781 4.489 ( -1.871 2.765 1.143) 3.529 4.551 ( -1.615 4.321 -2.126) 5.080 4.601 ( -0.340 1.709 -0.225) 1.757 4.937 ( -2.351 -6.477 -6.364) 9.379 5.150 ( -1.106 3.833 0.364) 4.006 5.328 ( 6.431 -3.457 1.264) 7.410 5.370 ( -0.351 -8.135 0.066) 8.142 5.692 ( -2.219 4.028 -3.481) 5.768 5.888 ( -5.216 -4.722 -3.297) 7.771 6.034 ( 1.064 8.363 1.576) 8.577 6.149 ( 0.340 1.826 -1.637) 2.476 6.362 ( -2.737 3.058 0.830) 4.188 6.379 ( 2.778 2.757 6.728) 7.784 6.499 ( 14.310 1.288 4.072) 14.934 6.561 ( -1.652 -4.244 3.353) 5.655 6.826 ( -0.117 6.859 -2.567) 7.325 7.280 ( -6.640 -3.559 4.632) 8.844 7.341 ( 6.123 -0.519 -3.446) 7.045 7.691 ( -7.760 7.331 -0.817) 10.707 7.778 ( -11.482 0.464 -1.262) 11.561 7.796 ( -6.015 -1.789 -3.527) 7.199 8.499 ( 5.400 -9.139 -1.603) 10.736 8.964 ( 0.445 -5.583 -1.877) 5.907 9.107 ( -2.238 -3.111 -6.527) 7.569 9.218 ( -10.570 2.330 8.404) 13.704 9.328 ( 8.264 -1.318 -9.060) 12.334 9.415 ( 8.211 -2.108 4.429) 9.565 9.507 ( -0.173 1.009 13.570) 13.609 9.871 ( -3.529 6.232 0.237) 7.166 10.219 ( -3.114 -4.281 -0.514) 5.318 10.578 ( 3.724 -0.395 3.656) 5.233 10.925 ( -4.148 -0.162 -5.673) 7.029 11.017 ( 1.764 -0.256 -4.789) 5.110 11.186 ( -3.018 -14.281 -9.253) 17.283 11.306 ( 1.240 -6.081 1.131) 6.308 11.642 ( 0.060 9.762 22.880) 24.876 11.798 ( -2.210 -1.039 -0.198) 2.450 11.857 ( -3.411 -0.746 9.737) 10.344 11.983 ( 4.470 3.060 -2.819) 6.107 12.103 ( 0.935 2.969 1.197) 3.335 12.546 ( -4.401 1.027 -4.043) 6.064 12.595 ( -4.080 -0.115 -6.952) 8.062 12.787 ( 2.684 -0.024 9.174) 9.558 13.330 ( -34.420 -15.260 -17.102) 41.353 13.505 ( -17.282 1.532 20.654) 26.974 14.747 ( 1.589 9.142 -3.023) 9.759 14.988 ( 1.988 8.437 -0.300) 8.673 15.086 ( 0.990 -4.021 -0.129) 4.143 15.146 ( 2.752 -3.124 -1.330) 4.371 15.392 ( 19.626 7.186 3.163) 21.138 15.452 ( -5.900 2.681 -1.015) 6.559 15.725 ( 2.944 6.882 4.344) 8.654 15.777 ( -0.749 -3.137 0.064) 3.226 15.924 ( 2.569 -1.618 -2.954) 4.236 16.191 ( -4.865 -0.246 5.420) 7.287 16.488 ( -11.379 -2.253 3.406) 12.090 16.632 ( -1.187 -6.968 -6.298) 9.467 16.952 ( 29.189 19.464 -2.577) 35.178 17.185 ( 15.877 -0.319 -3.668) 16.299 18.041 ( 1.523 -0.456 -0.248) 1.609 18.310 ( 5.165 1.414 -18.634) 19.388 25.632 ( 0.648 -1.258 0.550) 1.518 25.700 ( 0.664 -0.670 0.206) 0.966 25.778 ( -0.811 -1.067 2.211) 2.586 25.891 ( -0.328 -0.360 0.529) 0.719 25.992 ( -0.099 -1.810 0.201) 1.824 26.509 ( -2.572 -1.588 -13.678) 14.008 26.636 ( -2.110 -1.106 -1.794) 2.982 26.661 ( -3.068 -2.453 8.390) 9.264 26.870 ( -0.966 -1.343 4.721) 5.003 27.668 ( -37.902 -5.980 -9.696) 39.577 28.074 ( -17.828 -13.747 0.246) 22.514 28.513 ( -10.257 -10.529 -0.856) 14.724 28.560 ( -1.138 -9.112 -1.548) 9.312 28.637 ( -0.655 -1.135 2.118) 2.491 29.445 ( -0.376 4.338 -4.200) 6.050 29.876 ( 80.253 45.753 17.155) 93.958 ======================= Grid point 2 (3/140) ======================= q-point: ( 0.22 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 7.23e-05 7.23e-05 7.23e-05 7.23e-05 7.23e-05 7.23e-05 7.23e-05 7.23e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 244 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.925 ( 20.556 -16.128 0.012) 26.128 1.223 ( 9.796 -23.537 14.356) 29.258 1.613 ( 10.586 -23.625 11.451) 28.308 1.901 ( -0.898 -20.901 4.863) 21.478 2.282 ( -6.250 -7.411 -3.882) 10.443 2.496 ( -1.538 -5.951 -4.288) 7.494 2.573 ( -1.634 -11.080 2.822) 11.550 2.775 ( -0.794 -13.583 -0.195) 13.608 2.855 ( -4.576 -15.201 5.413) 16.773 2.956 ( 5.900 -10.099 -5.038) 12.735 3.000 ( 1.290 -2.033 1.252) 2.714 3.247 ( 4.829 5.727 0.640) 7.518 3.430 ( -2.092 2.066 -2.070) 3.596 3.569 ( -1.315 4.044 -3.387) 5.436 3.694 ( 3.067 -1.318 3.620) 4.924 3.970 ( -2.656 -0.475 -5.138) 5.803 4.033 ( -4.504 3.441 -5.450) 7.863 4.049 ( -6.904 2.681 -0.020) 7.406 4.412 ( 4.176 8.376 -1.933) 9.556 4.423 ( -3.258 -0.100 4.612) 5.648 4.557 ( -3.003 -2.606 0.405) 3.997 4.634 ( 5.201 -5.294 9.094) 11.738 4.942 ( -2.982 0.092 -3.928) 4.933 5.097 ( -0.993 1.949 -0.618) 2.273 5.443 ( 4.016 -3.963 1.376) 5.808 5.495 ( 1.395 -5.370 -5.500) 7.813 5.625 ( 1.468 0.397 -0.907) 1.770 5.850 ( -3.382 3.099 -2.786) 5.366 5.918 ( 1.254 7.081 4.357) 8.408 6.111 ( 2.341 2.212 -2.376) 4.002 6.265 ( -1.183 5.477 1.278) 5.748 6.423 ( 0.515 -1.160 2.601) 2.895 6.568 ( -5.412 -1.394 4.178) 6.977 6.658 ( 9.436 -3.362 -0.009) 10.017 6.739 ( 2.825 1.632 -5.107) 6.060 7.282 ( 0.055 1.569 0.202) 1.583 7.355 ( 0.272 1.928 -3.766) 4.239 7.459 ( -8.001 7.825 -2.329) 11.431 7.652 ( -11.403 3.262 -0.692) 11.881 7.761 ( -3.296 0.676 -1.213) 3.576 8.711 ( 3.822 -10.155 0.867) 10.885 9.052 ( 3.599 -1.462 4.252) 5.760 9.125 ( -5.233 -5.899 -8.074) 11.286 9.161 ( -8.056 -2.841 0.066) 8.542 9.364 ( -4.595 -7.341 -8.551) 12.171 9.540 ( 0.875 1.231 9.815) 9.931 9.580 ( 4.984 -5.074 1.508) 7.271 9.746 ( -0.647 4.591 4.766) 6.649 10.256 ( -3.151 -3.028 -1.145) 4.517 10.661 ( 5.820 -1.823 5.914) 8.495 10.882 ( 0.536 1.569 -0.418) 1.710 11.035 ( 5.143 -0.336 -1.137) 5.278 11.314 ( -0.758 -4.416 -0.230) 4.486 11.446 ( 2.178 -7.769 0.625) 8.092 11.632 ( 8.107 2.067 1.282) 8.464 11.793 ( -3.593 -2.400 -0.901) 4.414 11.882 ( -2.945 0.926 10.150) 10.609 11.979 ( 6.166 1.487 -4.549) 7.805 12.030 ( 0.485 6.047 3.564) 7.036 12.466 ( -4.746 1.585 -6.606) 8.287 12.522 ( -4.038 -0.597 -7.584) 8.612 12.843 ( 0.882 1.036 9.076) 9.177 13.171 ( -11.444 4.835 -10.007) 15.953 13.420 ( -16.245 4.241 17.416) 24.191 14.640 ( 1.861 3.076 -2.507) 4.383 14.862 ( 3.021 7.144 0.771) 7.795 15.096 ( -1.796 -0.447 -2.643) 3.226 15.260 ( 0.722 -5.938 -1.601) 6.192 15.377 ( -5.800 -0.782 -0.058) 5.852 15.431 ( 4.953 1.562 3.360) 6.186 15.634 ( 2.596 7.215 0.309) 7.674 15.804 ( -3.877 -0.774 2.689) 4.781 15.942 ( 7.061 1.031 -7.617) 10.437 16.181 ( -5.341 -0.149 6.304) 8.264 16.456 ( -1.694 2.483 0.387) 3.031 16.699 ( -4.213 -6.738 -4.302) 9.037 16.855 ( 14.774 10.355 -1.640) 18.116 17.295 ( 9.701 -1.986 -1.106) 9.964 18.055 ( 2.648 0.904 -1.276) 3.075 18.216 ( -0.019 3.892 -6.647) 7.702 25.663 ( 1.093 -1.319 0.143) 1.720 25.737 ( 1.352 -2.384 1.147) 2.971 25.804 ( -0.316 -1.485 1.049) 1.845 25.901 ( -0.580 -0.578 1.365) 1.591 26.018 ( -0.536 -1.106 -0.036) 1.229 26.468 ( 0.326 -0.694 -7.097) 7.138 26.622 ( -2.680 -0.754 -2.442) 3.703 26.703 ( -2.452 1.064 13.421) 13.685 26.911 ( -0.553 -4.200 -6.826) 8.034 27.458 ( -15.202 2.080 -2.480) 15.543 28.116 ( -4.516 -2.519 0.197) 5.175 28.619 ( -1.847 -6.894 4.197) 8.280 28.655 ( -2.535 -2.818 0.605) 3.839 28.764 ( -5.322 -16.122 -0.928) 17.003 29.320 ( 0.252 6.624 -6.714) 9.435 29.785 ( 35.813 25.838 6.941) 44.703 ======================= Grid point 3 (4/140) ======================= q-point: ( 0.33 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 7.23e-05 7.23e-05 7.23e-05 7.23e-05 7.23e-05 7.23e-05 7.23e-05 7.23e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 244 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.309 ( 15.853 -11.512 1.384) 19.641 1.685 ( 4.139 -17.669 6.722) 19.352 1.973 ( 0.863 -10.209 10.981) 15.019 2.178 ( -3.401 -13.685 -3.456) 14.519 2.449 ( 4.390 -10.534 2.133) 11.610 2.528 ( -2.528 -3.341 -2.165) 4.716 2.711 ( -4.232 -7.333 1.479) 8.594 2.943 ( 5.205 -0.354 -3.392) 6.223 3.018 ( -2.571 -5.300 2.112) 6.258 3.043 ( 1.096 -1.098 4.862) 5.104 3.126 ( -2.846 -13.657 4.564) 14.678 3.311 ( 2.087 2.413 -5.615) 6.458 3.424 ( 1.743 -7.006 -2.258) 7.564 3.460 ( 0.445 3.669 -1.651) 4.048 3.721 ( -0.087 0.863 3.646) 3.748 3.823 ( -6.747 8.386 -6.780) 12.720 4.015 ( 4.144 -3.913 -0.344) 5.710 4.051 ( -2.629 -7.857 -4.223) 9.299 4.294 ( 3.726 7.690 -2.460) 8.892 4.407 ( -6.813 0.007 7.906) 10.436 4.625 ( -0.054 -4.371 4.003) 5.927 4.814 ( 5.910 -4.417 6.338) 9.727 4.870 ( -2.851 2.911 -2.255) 4.657 5.045 ( -2.396 2.477 -1.394) 3.718 5.487 ( 0.662 -0.723 -8.515) 8.571 5.528 ( -1.353 -3.565 -1.014) 3.945 5.685 ( 2.544 -1.812 -1.946) 3.680 5.777 ( 0.338 1.324 0.786) 1.576 5.853 ( 2.017 5.216 7.025) 8.980 6.106 ( 4.921 -0.301 -3.120) 5.834 6.183 ( -0.766 3.189 -1.049) 3.444 6.426 ( -2.572 1.666 2.590) 4.013 6.526 ( -8.043 0.483 -0.634) 8.083 6.742 ( 4.392 -1.681 -3.770) 6.027 6.797 ( 6.974 -3.504 0.225) 7.808 7.137 ( -4.164 9.023 -2.280) 10.196 7.327 ( -0.264 -0.333 -3.578) 3.603 7.352 ( 1.365 3.355 -0.282) 3.633 7.507 ( -10.795 2.416 -1.272) 11.135 7.714 ( -3.021 1.841 1.235) 3.747 8.830 ( 1.988 0.242 2.336) 3.077 9.113 ( -7.418 -2.750 -6.664) 10.344 9.145 ( 0.865 -5.457 6.146) 8.264 9.197 ( -2.246 -6.401 -4.016) 7.883 9.392 ( -2.879 -1.489 -0.262) 3.252 9.564 ( -1.245 1.832 -2.077) 3.037 9.619 ( 2.658 -4.745 1.998) 5.794 9.851 ( 2.509 -6.650 6.137) 9.390 10.250 ( -1.908 0.599 -0.792) 2.151 10.735 ( 3.453 2.003 5.978) 7.188 10.922 ( 3.118 -5.642 -0.740) 6.489 11.081 ( 4.630 -0.053 1.007) 4.738 11.343 ( -1.590 -1.021 3.531) 4.005 11.592 ( 1.292 -7.953 -2.750) 8.513 11.639 ( 5.654 3.481 -2.642) 7.146 11.824 ( 0.847 9.189 -0.274) 9.232 11.853 ( 1.434 -1.752 2.526) 3.392 11.924 ( -2.203 -1.495 5.567) 6.171 12.063 ( 4.708 -2.053 -2.218) 5.595 12.370 ( -3.494 0.724 -8.340) 9.071 12.490 ( -0.990 -1.020 -3.993) 4.238 12.834 ( 1.086 4.578 -1.626) 4.978 12.943 ( -9.441 7.270 3.213) 12.341 13.284 ( -11.449 7.342 12.402) 18.407 14.649 ( 2.715 -2.769 -1.408) 4.126 14.829 ( 1.597 0.092 1.758) 2.377 15.052 ( -4.436 0.833 -2.292) 5.062 15.314 ( 3.232 3.049 0.260) 4.451 15.349 ( -3.529 -1.933 -3.343) 5.232 15.487 ( -1.025 -4.966 3.677) 6.263 15.562 ( 2.752 3.381 0.440) 4.382 15.765 ( -4.144 2.767 2.245) 5.465 15.928 ( 5.737 2.191 -6.778) 9.146 16.181 ( -2.923 -0.475 4.511) 5.397 16.362 ( 0.991 7.221 -1.965) 7.549 16.746 ( -6.604 -4.488 0.897) 8.034 16.838 ( 10.349 1.972 -4.049) 11.286 17.381 ( 5.757 -1.299 0.159) 5.904 18.011 ( 1.761 4.916 -2.914) 5.980 18.155 ( -0.944 0.432 -0.984) 1.430 25.696 ( 1.329 -1.346 0.122) 1.895 25.803 ( 1.517 -2.984 1.359) 3.613 25.826 ( -0.255 -1.012 -0.262) 1.076 25.914 ( -0.549 -0.517 1.965) 2.105 26.013 ( -0.939 0.764 -0.334) 1.256 26.464 ( 1.701 -0.789 -3.265) 3.765 26.595 ( -3.501 -0.267 -2.151) 4.118 26.725 ( -1.857 1.700 11.755) 12.021 26.918 ( -1.677 -2.815 -10.669) 11.161 27.352 ( -4.483 1.610 2.324) 5.300 28.113 ( -1.609 -0.528 -0.609) 1.799 28.657 ( -1.371 0.133 1.277) 1.878 28.771 ( -2.478 -8.418 5.650) 10.436 28.986 ( -6.916 -16.562 -3.207) 18.233 29.188 ( 2.695 6.100 -5.064) 8.374 29.636 ( 19.850 20.381 2.613) 28.570 ======================= Grid point 4 (5/140) ======================= q-point: ( 0.44 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 7.23e-05 7.23e-05 7.23e-05 7.23e-05 7.23e-05 7.23e-05 7.23e-05 7.23e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 244 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.533 ( 5.793 -3.845 0.782) 6.997 1.955 ( 0.727 -12.657 -0.456) 12.686 2.107 ( -0.447 3.768 6.851) 7.832 2.318 ( 1.002 -8.465 -0.609) 8.546 2.489 ( -2.651 2.289 -2.632) 4.382 2.652 ( 1.973 -5.458 1.768) 6.067 2.796 ( -1.704 -5.231 1.017) 5.594 2.898 ( 1.499 4.153 -1.755) 4.752 3.080 ( -0.425 -0.246 3.946) 3.977 3.143 ( 1.941 -3.166 -2.332) 4.385 3.208 ( -0.369 -2.979 2.773) 4.087 3.323 ( -2.896 1.980 1.188) 3.704 3.382 ( 0.983 -3.685 -1.975) 4.294 3.526 ( 4.368 0.809 -0.577) 4.480 3.578 ( -9.447 4.674 -4.507) 11.463 3.786 ( 2.966 -0.893 1.531) 3.455 4.050 ( 0.003 -3.025 -3.640) 4.733 4.152 ( 1.608 3.900 -0.302) 4.229 4.290 ( 7.206 -6.054 0.085) 9.412 4.395 ( -7.095 -0.197 5.190) 8.793 4.710 ( -0.297 -3.450 2.787) 4.446 4.784 ( -1.530 2.826 -1.323) 3.475 4.925 ( 5.268 -0.076 1.866) 5.589 4.972 ( -4.483 1.193 -0.985) 4.743 5.478 ( 1.535 -1.363 -6.079) 6.416 5.536 ( -1.876 0.170 0.284) 1.905 5.674 ( -1.546 0.214 -0.643) 1.688 5.808 ( 1.586 -0.711 1.385) 2.223 5.845 ( 1.679 1.480 3.692) 4.317 6.136 ( 0.154 0.304 -2.698) 2.719 6.189 ( 9.362 -3.135 -0.192) 9.875 6.337 ( -10.465 4.087 1.805) 11.379 6.461 ( -1.573 0.957 -1.846) 2.608 6.775 ( 1.409 -1.005 -2.314) 2.889 6.888 ( 2.858 -1.558 1.922) 3.780 7.002 ( -1.462 2.862 -1.806) 3.686 7.273 ( -0.877 1.518 -1.748) 2.476 7.340 ( 2.045 2.818 1.226) 3.691 7.433 ( -4.227 -1.888 -1.775) 4.958 7.673 ( -1.577 1.300 1.251) 2.397 8.819 ( 0.499 1.534 1.163) 1.989 9.060 ( -3.552 0.108 -2.243) 4.202 9.255 ( -0.945 -4.454 -0.643) 4.598 9.268 ( 0.298 -2.558 0.920) 2.735 9.386 ( -0.618 0.625 2.480) 2.631 9.522 ( 1.265 1.687 -1.849) 2.804 9.742 ( 0.176 -6.070 -1.031) 6.159 9.951 ( 0.484 -0.828 1.896) 2.125 10.223 ( -0.558 0.589 0.508) 0.957 10.736 ( 1.098 1.367 1.970) 2.637 11.040 ( 1.345 -4.330 -0.317) 4.545 11.107 ( 2.291 0.793 1.119) 2.670 11.406 ( 0.197 -5.979 3.066) 6.722 11.569 ( -0.749 8.804 -0.947) 8.886 11.630 ( -0.376 0.207 -3.910) 3.933 11.734 ( 1.822 -0.053 0.350) 1.856 11.910 ( 1.517 -2.158 3.862) 4.677 11.980 ( 0.316 -1.217 1.644) 2.070 12.082 ( 0.579 0.293 -4.121) 4.172 12.319 ( -0.250 0.413 -3.256) 3.291 12.494 ( 0.663 -0.695 -0.840) 1.276 12.707 ( -1.537 3.724 -4.193) 5.815 12.876 ( -2.154 0.870 4.307) 4.894 13.153 ( -5.039 4.440 5.296) 8.553 14.738 ( 3.380 -4.474 -0.015) 5.607 14.838 ( -2.056 1.303 -0.283) 2.451 15.031 ( -1.397 -2.954 1.219) 3.488 15.192 ( -0.356 7.407 -1.581) 7.582 15.401 ( 0.259 -3.301 -1.640) 3.695 15.549 ( 1.374 1.093 0.750) 1.909 15.588 ( -0.271 -5.310 2.478) 5.866 15.684 ( -2.142 4.328 -0.108) 4.831 15.901 ( 1.743 1.267 -2.436) 3.253 16.192 ( -0.935 -0.572 2.495) 2.725 16.253 ( 0.704 4.244 -2.143) 4.806 16.761 ( -1.956 -1.108 0.753) 2.370 16.873 ( 3.021 -0.657 -1.829) 3.592 17.427 ( 1.896 -0.406 0.258) 1.956 17.936 ( 0.281 2.607 -1.185) 2.878 18.150 ( -0.191 -0.178 -0.066) 0.270 25.725 ( 0.785 -0.766 0.155) 1.108 25.830 ( -0.459 -0.236 -0.401) 0.653 25.862 ( 1.100 -1.721 0.612) 2.132 25.926 ( -0.229 -0.327 1.062) 1.135 25.984 ( -0.716 1.226 -0.357) 1.464 26.480 ( 1.454 -0.399 -0.642) 1.639 26.563 ( -2.170 0.041 -1.054) 2.413 26.732 ( -0.889 0.965 4.871) 5.045 26.897 ( -0.784 -1.055 -5.189) 5.352 27.332 ( -0.542 0.403 1.645) 1.778 28.109 ( -0.372 -0.166 -0.348) 0.536 28.643 ( -1.081 0.310 0.074) 1.127 28.894 ( -1.742 -4.131 4.516) 6.364 29.077 ( 0.004 -0.053 -6.847) 6.847 29.226 ( -5.089 -13.193 2.345) 14.334 29.443 ( 11.228 17.382 0.060) 20.694 ======================= Grid point 10 (6/140) ======================= q-point: ( 0.11 0.11 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 7.23e-05 7.23e-05 7.23e-05 7.23e-05 7.23e-05 7.23e-05 7.23e-05 7.23e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 140 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.553 ( 22.398 0.000 19.467) 29.675 0.613 ( 36.085 0.000 4.522) 36.368 1.029 ( 39.916 0.000 35.020) 53.101 1.410 ( 0.739 0.000 3.158) 3.243 2.042 ( -2.371 -0.000 -1.796) 2.974 2.153 ( -9.417 -0.000 1.682) 9.566 2.432 ( -12.276 -0.000 1.768) 12.403 2.500 ( 1.583 0.000 -5.878) 6.087 2.610 ( -5.464 -0.000 1.838) 5.765 2.777 ( 11.283 0.000 -3.513) 11.818 2.967 ( 1.390 0.000 2.639) 2.983 3.410 ( -1.391 -0.000 -9.548) 9.649 3.570 ( -0.457 -0.000 -3.539) 3.568 3.635 ( -2.623 -0.000 -3.539) 4.405 3.641 ( 4.427 0.000 3.352) 5.553 3.771 ( -1.433 -0.000 7.139) 7.281 4.185 ( 0.978 0.000 -4.727) 4.827 4.229 ( -5.344 -0.000 2.936) 6.098 4.384 ( 0.685 0.000 5.792) 5.832 4.400 ( -16.240 -0.000 -2.224) 16.392 4.586 ( 3.628 0.000 -2.805) 4.586 4.672 ( 0.713 0.000 3.674) 3.743 4.770 ( 5.717 0.000 -7.696) 9.587 5.217 ( -3.716 -0.000 -1.217) 3.910 5.249 ( 0.407 0.000 1.913) 1.956 5.374 ( 11.058 0.000 3.137) 11.494 5.675 ( 1.977 0.000 -0.525) 2.045 5.793 ( -3.437 -0.000 -3.913) 5.208 6.124 ( 0.019 0.000 3.563) 3.563 6.168 ( 2.652 0.000 -2.498) 3.643 6.375 ( 0.300 0.000 2.651) 2.668 6.430 ( -2.310 -0.000 -0.371) 2.340 6.524 ( 5.400 0.000 3.875) 6.647 6.794 ( 1.767 0.000 -1.467) 2.297 6.866 ( -3.636 -0.000 -3.603) 5.119 7.191 ( -20.222 -0.000 21.255) 29.338 7.332 ( 0.539 0.000 -3.970) 4.006 7.542 ( 9.428 0.000 -4.569) 10.477 7.723 ( -6.572 -0.000 3.526) 7.458 7.802 ( -7.697 -0.000 0.596) 7.720 8.451 ( 5.014 0.000 -0.422) 5.031 8.880 ( -1.435 -0.000 -3.184) 3.492 9.049 ( -5.302 -0.000 -4.947) 7.251 9.073 ( -3.194 -0.000 -16.653) 16.957 9.400 ( -7.879 -0.000 6.949) 10.505 9.459 ( 0.882 0.000 -2.413) 2.569 9.816 ( -0.960 -0.000 4.635) 4.733 10.047 ( -2.477 -0.000 14.428) 14.640 10.100 ( -2.831 -0.000 2.237) 3.608 10.363 ( -0.676 -0.000 6.551) 6.586 10.632 ( 5.222 0.000 5.087) 7.290 11.017 ( 2.141 0.000 -1.119) 2.416 11.102 ( 3.600 0.000 3.632) 5.114 11.294 ( 5.312 0.000 1.713) 5.582 11.770 ( -4.125 -0.000 1.643) 4.440 11.783 ( -7.063 -0.000 3.946) 8.090 11.941 ( -22.979 -0.000 42.265) 48.108 11.977 ( -2.919 -0.000 -1.069) 3.109 12.179 ( 4.730 0.000 -1.464) 4.951 12.481 ( 1.683 0.000 -8.846) 9.004 12.552 ( -3.612 -0.000 -6.414) 7.361 12.677 ( -10.561 -0.000 13.141) 16.859 12.920 ( 11.880 0.000 -1.026) 11.924 13.503 ( -6.648 -0.000 5.352) 8.535 14.857 ( -3.216 -0.000 -0.932) 3.348 14.977 ( 1.418 0.000 1.362) 1.966 15.022 ( -1.075 -0.000 -1.716) 2.024 15.259 ( 7.838 0.000 3.857) 8.736 15.395 ( -8.634 -0.000 -3.147) 9.189 15.705 ( -0.753 -0.000 -1.374) 1.567 15.734 ( 9.754 0.000 -10.344) 14.218 15.876 ( -2.315 -0.000 9.612) 9.887 15.885 ( -0.389 -0.000 -2.242) 2.275 16.202 ( -0.838 -0.000 2.858) 2.978 16.318 ( -9.376 -0.000 3.375) 9.965 16.534 ( -0.593 -0.000 -5.470) 5.503 17.141 ( 3.345 0.000 3.944) 5.172 17.733 ( 5.716 0.000 -1.552) 5.923 18.020 ( 2.541 0.000 -6.131) 6.636 18.151 ( 37.811 0.000 -62.907) 73.396 25.634 ( 1.107 0.000 1.388) 1.776 25.702 ( 0.861 0.000 0.385) 0.943 25.774 ( -3.533 -0.000 5.490) 6.529 25.887 ( -0.696 -0.000 0.776) 1.043 25.984 ( -0.516 -0.000 3.195) 3.237 26.267 ( 1.902 0.000 3.829) 4.275 26.553 ( -2.091 -0.000 -3.606) 4.168 26.638 ( 0.030 0.000 -0.838) 0.838 26.978 ( -15.750 -0.000 26.553) 30.873 27.193 ( 3.209 0.000 4.364) 5.416 27.905 ( 0.145 0.000 -3.890) 3.893 28.421 ( -1.718 -0.000 -2.814) 3.297 28.467 ( -0.534 -0.000 -0.500) 0.731 28.646 ( 0.158 0.000 2.669) 2.673 29.443 ( -1.539 -0.000 -7.492) 7.648 30.997 ( 16.611 0.000 -24.382) 29.502 ======================= Grid point 11 (7/140) ======================= q-point: ( 0.22 0.11 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 7.23e-05 7.23e-05 7.23e-05 7.23e-05 7.23e-05 7.23e-05 7.23e-05 7.23e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 244 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.899 ( 25.861 -10.142 4.676) 28.170 1.056 ( 21.115 -15.449 13.211) 29.310 1.498 ( 10.765 -13.619 16.115) 23.687 1.663 ( 12.861 -12.036 16.899) 24.411 2.084 ( -4.314 -8.141 -2.983) 9.684 2.234 ( -3.846 -15.908 0.932) 16.393 2.441 ( -9.246 -5.944 0.374) 10.998 2.517 ( 0.298 -8.817 0.589) 8.842 2.646 ( -3.881 -7.991 0.789) 8.918 2.884 ( 10.645 -4.477 -3.486) 12.063 2.999 ( 1.198 -1.009 3.234) 3.594 3.335 ( -0.502 1.765 -12.365) 12.501 3.467 ( -1.809 5.782 2.082) 6.406 3.588 ( -3.114 0.893 -3.879) 5.054 3.709 ( 4.204 -1.106 4.770) 6.453 3.837 ( -2.885 -3.785 -2.547) 5.398 4.077 ( -3.101 7.692 -7.778) 11.370 4.108 ( -8.763 6.459 5.276) 12.097 4.344 ( -7.879 -5.022 -2.964) 9.802 4.489 ( 0.256 -5.559 7.531) 9.365 4.565 ( 4.515 4.958 -0.651) 6.737 4.662 ( 2.491 0.247 5.463) 6.009 4.850 ( 0.188 -5.057 -6.447) 8.196 5.133 ( -1.534 3.254 -0.671) 3.659 5.331 ( -1.240 -5.560 -1.294) 5.841 5.484 ( 5.676 -1.546 0.134) 5.884 5.664 ( 3.512 2.472 -2.632) 5.037 5.792 ( -1.697 -3.515 -2.663) 4.725 6.088 ( 2.702 6.553 3.312) 7.824 6.150 ( 1.303 2.023 -3.128) 3.946 6.333 ( -2.228 3.800 1.526) 4.662 6.445 ( -1.568 -1.327 2.386) 3.148 6.588 ( -1.505 4.090 8.410) 9.472 6.690 ( 7.888 2.113 -2.133) 8.440 6.795 ( 2.123 3.855 -4.503) 6.297 7.209 ( -7.990 -6.020 4.008) 10.777 7.366 ( -1.639 -3.403 -3.886) 5.419 7.513 ( -5.848 8.943 -8.976) 13.955 7.595 ( -2.992 5.137 4.849) 7.671 7.772 ( -5.776 -0.564 2.566) 6.345 8.573 ( 3.465 -8.494 3.010) 9.655 8.911 ( -3.819 -7.612 -4.756) 9.754 8.961 ( -5.219 -2.868 -9.380) 11.111 9.084 ( -6.559 -7.821 -7.027) 12.392 9.283 ( -5.164 6.446 3.301) 8.894 9.455 ( -2.335 -2.244 -2.720) 4.229 9.761 ( 7.960 5.889 11.845) 15.438 9.879 ( 1.107 9.097 6.400) 11.178 10.180 ( -1.820 -3.939 2.582) 5.049 10.701 ( 4.861 -2.909 4.251) 7.083 10.778 ( -5.080 -16.658 -0.451) 17.421 11.043 ( 4.228 -1.761 -1.537) 4.831 11.207 ( 4.214 -6.553 4.634) 9.065 11.376 ( 5.545 -3.764 0.326) 6.710 11.692 ( -4.471 3.261 2.065) 5.907 11.752 ( -1.368 0.045 -2.113) 2.517 11.933 ( -2.799 0.491 9.870) 10.271 12.025 ( -5.530 -2.449 10.713) 12.302 12.148 ( 3.264 6.114 0.816) 6.978 12.421 ( -3.460 3.081 -8.390) 9.584 12.455 ( -2.028 0.368 -6.023) 6.366 12.806 ( -16.209 -9.925 12.361) 22.673 13.019 ( 4.798 -2.879 -4.850) 7.405 13.444 ( -8.382 3.792 7.499) 11.869 14.727 ( -1.000 7.560 0.231) 7.630 14.985 ( -1.386 2.425 -2.001) 3.436 15.108 ( 1.432 -7.817 0.435) 7.959 15.232 ( 4.539 9.056 1.300) 10.213 15.319 ( -4.946 1.216 -1.851) 5.419 15.577 ( 5.620 8.507 -0.015) 10.196 15.742 ( -3.782 0.463 2.248) 4.423 15.799 ( 2.867 4.942 -1.523) 5.912 15.955 ( 8.629 -1.919 -8.072) 11.970 16.179 ( -4.604 0.911 6.741) 8.214 16.362 ( -8.815 -6.619 1.178) 11.086 16.540 ( -3.793 -5.051 -5.186) 8.173 17.161 ( 7.583 6.441 2.927) 10.371 17.491 ( 21.129 16.807 -8.346) 28.259 18.067 ( 0.855 -1.381 1.143) 1.986 18.184 ( 5.680 -2.331 -22.403) 23.229 25.658 ( 1.677 -0.730 0.672) 1.948 25.724 ( 1.570 -1.339 1.085) 2.331 25.784 ( -1.498 -1.155 2.374) 3.035 25.890 ( -0.969 -0.617 1.198) 1.660 26.002 ( -0.037 -0.586 2.660) 2.724 26.400 ( -0.076 -5.583 -1.574) 5.801 26.543 ( -4.614 -2.992 -3.789) 6.678 26.663 ( -1.065 -3.861 -0.262) 4.014 26.930 ( -2.992 4.378 12.176) 13.281 27.329 ( -5.691 -5.381 4.587) 9.077 27.976 ( -2.124 -9.093 -2.929) 9.786 28.437 ( -2.805 -7.127 -3.191) 8.297 28.514 ( -2.018 -5.883 -1.138) 6.322 28.660 ( -1.352 -0.752 2.722) 3.131 29.362 ( -0.382 3.173 -9.523) 10.046 30.641 ( 23.405 35.200 -1.797) 42.309 ======================= Grid point 12 (8/140) ======================= q-point: ( 0.33 0.11 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 7.23e-05 7.23e-05 7.23e-05 7.23e-05 7.23e-05 7.23e-05 7.23e-05 7.23e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 244 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.297 ( 23.549 -10.733 2.692) 26.019 1.478 ( 6.241 -13.684 7.977) 17.025 1.886 ( -1.326 -17.149 2.267) 17.349 1.900 ( 5.255 -9.209 15.109) 18.458 2.314 ( 5.431 -13.640 5.338) 15.622 2.395 ( -2.602 -5.691 -4.866) 7.927 2.523 ( -8.037 -10.491 4.585) 13.988 2.775 ( -2.958 -16.278 4.511) 17.148 2.834 ( 0.343 -14.526 -1.379) 14.596 3.024 ( 5.154 -2.210 -1.869) 5.911 3.062 ( 2.770 -2.782 5.916) 7.100 3.268 ( 1.273 -2.468 -10.171) 10.543 3.389 ( -1.775 2.594 0.472) 3.178 3.525 ( 1.215 3.706 -1.925) 4.350 3.721 ( -4.992 -0.737 -1.414) 5.240 3.852 ( -4.974 7.115 -9.015) 12.515 3.905 ( 0.723 -5.317 0.569) 5.396 4.019 ( -0.305 0.666 2.842) 2.935 4.337 ( -4.791 -0.651 -2.994) 5.687 4.497 ( 3.618 6.400 4.689) 8.719 4.605 ( 1.247 -2.617 7.278) 7.834 4.783 ( 0.887 -6.353 8.555) 10.692 4.865 ( -0.362 -0.533 -3.467) 3.527 5.071 ( -0.524 2.755 -2.763) 3.937 5.363 ( -4.525 -3.001 -7.842) 9.538 5.491 ( 0.452 -0.422 -2.452) 2.529 5.670 ( -1.244 -0.844 -0.996) 1.803 5.828 ( 7.339 0.441 -0.791) 7.395 6.019 ( 3.620 7.115 6.152) 10.079 6.115 ( 3.285 0.411 -6.096) 6.937 6.246 ( -2.461 4.853 1.476) 5.638 6.429 ( -7.207 0.615 0.666) 7.263 6.513 ( 1.167 4.011 1.174) 4.339 6.741 ( 4.044 0.667 -3.558) 5.428 6.800 ( 5.570 -2.722 1.421) 6.360 7.231 ( -9.439 9.359 -5.901) 14.544 7.278 ( -1.873 -3.383 0.521) 3.902 7.348 ( -5.994 -1.121 -4.385) 7.511 7.508 ( 0.724 6.140 2.452) 6.652 7.745 ( -3.333 1.184 3.357) 4.876 8.755 ( -1.005 -8.044 1.403) 8.227 8.951 ( -5.578 -5.803 -5.583) 9.797 8.998 ( -5.758 -9.113 -6.003) 12.338 9.138 ( -3.957 -4.980 -0.149) 6.363 9.246 ( 1.378 -4.673 -2.726) 5.583 9.465 ( -4.832 -3.827 -2.799) 6.770 9.766 ( 3.711 8.706 6.373) 11.410 9.847 ( 4.777 -1.501 9.229) 10.500 10.233 ( -0.686 -1.481 2.312) 2.830 10.808 ( 5.501 -1.493 4.726) 7.404 10.871 ( -0.945 -2.686 0.090) 2.849 11.112 ( 4.400 -1.673 1.105) 4.836 11.343 ( 3.009 -2.490 1.623) 4.230 11.488 ( 2.113 -3.723 -0.372) 4.297 11.696 ( 4.496 -3.435 -4.855) 7.456 11.742 ( -1.870 -3.641 -0.183) 4.098 11.950 ( -0.747 0.554 4.938) 5.025 12.025 ( -1.395 9.350 1.004) 9.507 12.079 ( 0.279 -0.385 8.231) 8.245 12.319 ( -1.291 0.774 -7.413) 7.564 12.426 ( -0.556 -1.059 -4.990) 5.131 12.855 ( -13.041 -3.600 10.035) 16.844 12.980 ( -1.078 5.752 -7.500) 9.513 13.333 ( -11.182 5.211 10.228) 16.025 14.647 ( 0.773 1.871 1.280) 2.395 14.901 ( -0.643 4.436 -1.513) 4.731 15.095 ( 3.952 7.753 -0.195) 8.705 15.230 ( -1.380 -4.632 -4.452) 6.572 15.314 ( -2.979 -4.860 3.433) 6.654 15.525 ( 3.299 4.784 3.037) 6.557 15.663 ( 2.547 5.473 -1.649) 6.257 15.778 ( -1.693 0.669 1.296) 2.234 15.975 ( 7.068 1.810 -8.344) 11.084 16.171 ( -3.232 -0.225 4.571) 5.603 16.362 ( -8.970 -1.235 -1.773) 9.226 16.592 ( -4.278 -6.853 -1.367) 8.193 17.077 ( 14.470 11.895 -1.037) 18.761 17.453 ( 11.215 3.199 -1.871) 11.811 18.069 ( 1.665 3.165 -6.086) 7.059 18.132 ( -2.687 -0.843 -3.047) 4.149 25.688 ( 1.772 -1.083 0.158) 2.083 25.781 ( 1.979 -2.465 2.220) 3.863 25.805 ( -0.745 -1.261 0.565) 1.570 25.903 ( -1.241 -0.986 1.585) 2.241 26.017 ( -0.364 0.274 1.758) 1.816 26.453 ( 2.342 -1.502 -0.257) 2.795 26.529 ( -4.726 -2.060 -3.437) 6.196 26.706 ( -2.916 -3.086 -3.023) 5.212 26.912 ( -0.165 2.581 9.117) 9.476 27.354 ( -1.126 0.054 3.723) 3.890 28.059 ( -2.140 -4.045 -2.471) 5.201 28.567 ( -7.701 -9.205 -6.799) 13.794 28.594 ( -3.156 -10.015 1.345) 10.586 28.700 ( -3.039 -5.971 1.185) 6.804 29.264 ( 2.889 3.869 -7.560) 8.971 30.272 ( 19.903 30.353 4.065) 36.523 ======================= Grid point 13 (9/140) ======================= q-point: ( 0.44 0.11 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 7.23e-05 7.23e-05 7.23e-05 7.23e-05 7.23e-05 7.23e-05 7.23e-05 7.23e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 244 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.557 ( 9.671 -1.396 2.804) 10.165 1.746 ( 4.137 -14.498 2.742) 15.324 2.114 ( -0.560 -10.673 -3.615) 11.282 2.193 ( 7.488 -6.682 14.631) 17.742 2.437 ( -4.770 -4.967 -0.303) 6.893 2.571 ( 4.490 -8.257 5.127) 10.707 2.655 ( -4.860 -9.625 2.633) 11.099 2.943 ( -5.617 -3.039 -4.369) 7.738 2.985 ( 1.823 -5.245 -2.097) 5.935 3.078 ( -3.156 -5.434 0.923) 6.352 3.152 ( 0.052 -3.418 7.688) 8.414 3.268 ( -1.728 -3.751 -2.186) 4.672 3.339 ( -0.345 1.249 -9.315) 9.404 3.520 ( -2.692 0.642 0.262) 2.780 3.590 ( -1.299 4.820 -5.932) 7.753 3.824 ( 1.496 -3.246 0.872) 3.679 3.937 ( -3.026 -2.954 -1.875) 4.626 4.186 ( 10.226 -6.138 0.631) 11.943 4.293 ( 2.675 -0.519 2.108) 3.445 4.451 ( 1.049 5.567 8.012) 9.812 4.682 ( -1.110 -2.601 6.688) 7.261 4.809 ( -2.271 1.888 -1.198) 3.187 4.917 ( -0.598 -2.185 0.214) 2.275 5.001 ( 1.716 3.584 -0.990) 4.095 5.354 ( -1.916 -5.425 -9.557) 11.155 5.488 ( -5.543 -2.176 0.045) 5.955 5.670 ( -1.941 -1.140 3.021) 3.768 5.858 ( 8.490 2.478 -5.502) 10.416 5.946 ( 0.626 6.392 2.417) 6.862 6.131 ( 1.186 -0.043 -0.088) 1.190 6.209 ( 5.199 -1.461 0.102) 5.401 6.325 ( -8.512 3.468 -1.827) 9.371 6.477 ( 1.616 2.263 -0.477) 2.821 6.761 ( 3.970 -0.966 -2.841) 4.976 6.882 ( 0.836 -2.225 3.335) 4.096 7.016 ( -7.088 4.741 -4.107) 9.465 7.231 ( -2.993 1.715 -9.151) 9.779 7.346 ( -7.870 -2.377 3.465) 8.921 7.477 ( 8.437 2.736 4.575) 9.980 7.713 ( -1.431 2.449 3.376) 4.410 8.784 ( -7.256 -1.741 -2.459) 7.857 8.997 ( -1.519 -4.453 -3.519) 5.875 9.104 ( -2.142 -9.296 -2.273) 9.806 9.202 ( -2.159 -5.357 0.176) 5.779 9.355 ( 1.490 -4.584 -0.917) 4.906 9.501 ( -2.565 -6.757 -3.260) 7.928 9.688 ( 1.478 4.848 2.110) 5.490 9.967 ( 4.075 -2.332 7.422) 8.782 10.233 ( -1.273 1.315 1.111) 2.141 10.812 ( 1.532 3.409 1.722) 4.115 10.980 ( 3.608 -5.282 2.444) 6.848 11.161 ( 2.994 0.759 2.831) 4.190 11.383 ( 2.698 -0.071 1.964) 3.338 11.522 ( -1.808 -3.481 -6.438) 7.539 11.696 ( 2.086 4.513 -0.785) 5.033 11.795 ( -2.063 4.889 -2.971) 6.081 11.914 ( 1.013 -2.838 4.857) 5.716 11.997 ( 4.273 -2.875 -0.146) 5.152 12.100 ( 0.398 2.589 5.087) 5.722 12.312 ( 4.114 -0.387 -2.080) 4.627 12.436 ( -0.785 -3.494 -4.424) 5.692 12.785 ( -0.870 8.763 -4.624) 9.946 12.851 ( -10.422 -1.379 5.271) 11.760 13.195 ( -11.496 5.478 6.926) 14.496 14.686 ( 1.997 -3.694 2.177) 4.730 14.839 ( -1.751 1.366 -1.650) 2.766 15.029 ( 2.175 2.497 0.979) 3.453 15.271 ( -3.111 -2.173 -1.270) 4.001 15.334 ( 0.216 1.773 -1.709) 2.472 15.529 ( 1.738 -2.569 3.911) 4.992 15.621 ( 4.622 2.996 0.227) 5.513 15.737 ( -1.104 3.188 0.261) 3.384 15.938 ( 3.213 2.915 -5.046) 6.655 16.178 ( -1.855 -0.910 1.907) 2.811 16.262 ( -8.681 2.291 -3.460) 9.622 16.670 ( -2.960 -5.527 0.241) 6.274 17.018 ( 14.001 7.973 -0.477) 16.119 17.473 ( 5.285 2.271 0.308) 5.760 17.959 ( -3.320 3.477 -5.679) 7.440 18.140 ( -0.548 -0.919 0.575) 1.214 25.721 ( 1.450 -0.997 0.540) 1.841 25.816 ( -0.367 -0.714 -0.188) 0.825 25.849 ( 2.013 -2.199 1.756) 3.460 25.916 ( -1.485 -0.908 1.242) 2.139 26.002 ( -0.600 1.656 0.901) 1.979 26.486 ( -1.011 -0.389 2.198) 2.450 26.523 ( 0.399 -2.069 -2.489) 3.261 26.692 ( -2.158 -1.301 -7.723) 8.123 26.933 ( 1.187 1.274 11.318) 11.451 27.357 ( 1.068 1.578 1.857) 2.661 28.079 ( -1.197 -1.992 -2.251) 3.236 28.567 ( -6.677 -4.224 -6.226) 10.059 28.763 ( -4.217 -8.889 2.794) 10.228 28.807 ( -7.504 -12.577 -5.806) 15.754 29.225 ( 5.549 1.802 -1.196) 5.956 29.953 ( 14.582 26.506 4.494) 30.584 ======================= Grid point 14 (10/140) ======================= q-point: ( 0.56 0.11 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 7.23e-05 7.23e-05 7.23e-05 7.23e-05 7.23e-05 7.23e-05 7.23e-05 7.23e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 244 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.577 ( -1.275 3.938 2.031) 4.611 2.003 ( 5.496 -7.689 -0.999) 9.504 2.129 ( 0.358 4.457 -0.260) 4.479 2.342 ( -1.461 -2.223 0.431) 2.694 2.507 ( 3.806 -2.135 8.628) 9.669 2.677 ( -0.941 -0.763 -0.366) 1.266 2.806 ( -0.350 -6.790 5.712) 8.881 2.875 ( -1.570 2.675 -2.736) 4.136 3.029 ( -4.311 -1.651 -3.858) 6.016 3.104 ( -2.422 -3.612 -2.695) 5.116 3.218 ( -4.099 -3.970 -4.422) 7.219 3.257 ( -0.008 1.790 -1.620) 2.414 3.390 ( 1.148 -3.493 -2.031) 4.200 3.435 ( -5.540 -4.218 2.163) 7.291 3.617 ( 6.854 -1.503 0.430) 7.030 3.833 ( 2.134 3.381 -0.555) 4.036 3.972 ( -6.097 -5.087 -1.198) 8.030 4.196 ( 2.787 3.502 4.165) 6.114 4.374 ( -1.308 7.013 4.941) 8.677 4.463 ( 10.861 -0.224 -0.344) 10.869 4.746 ( -1.151 -1.352 -3.257) 3.710 4.778 ( 1.017 -0.832 7.478) 7.592 4.862 ( -4.614 1.173 -4.511) 6.559 5.002 ( 4.883 0.871 -0.092) 4.961 5.397 ( -3.339 -5.672 -4.321) 7.874 5.518 ( -4.020 -4.141 5.224) 7.784 5.700 ( 0.713 -0.593 4.075) 4.179 5.819 ( 1.482 2.519 -8.487) 8.976 5.857 ( 2.133 4.335 -2.989) 5.681 6.144 ( -0.762 -0.094 5.230) 5.286 6.173 ( -8.532 3.488 -1.025) 9.275 6.343 ( 10.581 -3.454 -3.065) 11.544 6.469 ( 2.044 -0.678 1.797) 2.805 6.787 ( 2.050 -0.072 -0.910) 2.244 6.879 ( -5.560 2.497 -1.255) 6.223 6.952 ( -3.562 -3.285 2.220) 5.330 7.174 ( -0.253 -3.123 -8.962) 9.494 7.334 ( -3.940 -0.333 4.338) 5.869 7.536 ( 6.252 2.374 5.966) 8.962 7.692 ( 2.826 0.991 1.618) 3.404 8.741 ( -6.546 -2.047 -3.644) 7.766 9.059 ( 2.723 -4.388 -0.609) 5.200 9.206 ( -0.643 -5.095 -2.704) 5.804 9.266 ( -2.406 -3.826 -0.474) 4.544 9.381 ( 0.812 0.510 -1.592) 1.858 9.551 ( 0.400 2.752 3.616) 4.561 9.702 ( -1.637 -7.605 -4.236) 8.857 10.014 ( 2.274 4.133 5.430) 7.193 10.208 ( -1.042 -0.346 -0.969) 1.464 10.766 ( 1.998 4.113 -0.355) 4.586 11.056 ( -0.619 -0.286 2.671) 2.757 11.151 ( 0.574 4.012 1.832) 4.448 11.453 ( 3.043 -5.528 0.558) 6.335 11.531 ( -1.907 4.013 -3.352) 5.566 11.544 ( -0.472 1.977 -5.006) 5.403 11.741 ( -2.800 -0.554 -1.090) 3.055 11.967 ( 0.120 2.728 4.987) 5.685 12.053 ( 2.447 3.894 -0.036) 4.599 12.100 ( 5.537 -0.887 5.997) 8.211 12.332 ( 2.666 0.512 0.498) 2.760 12.464 ( -1.590 -2.192 -2.453) 3.654 12.700 ( 2.448 -0.709 0.755) 2.658 12.827 ( -5.679 -1.631 -1.080) 6.006 13.082 ( -6.802 -0.556 -0.667) 6.858 14.762 ( -2.750 0.927 0.548) 2.953 14.816 ( 2.083 -3.187 0.390) 3.828 15.062 ( 1.769 -2.621 1.961) 3.721 15.173 ( -0.191 6.130 -0.554) 6.158 15.374 ( -1.257 -4.424 -1.677) 4.896 15.583 ( 1.655 2.274 1.462) 3.170 15.645 ( 3.965 -2.491 1.436) 4.897 15.668 ( 1.102 4.334 -0.989) 4.580 15.897 ( 0.142 1.274 -1.167) 1.734 16.154 ( -9.011 -0.872 -2.557) 9.407 16.192 ( -0.445 -0.905 -0.085) 1.012 16.725 ( -1.483 -3.004 0.019) 3.350 16.999 ( 10.212 6.712 1.588) 12.323 17.455 ( 1.249 3.080 0.508) 3.362 17.883 ( -4.024 -1.035 -3.118) 5.195 18.150 ( -0.152 -0.350 0.473) 0.608 25.735 ( -0.075 0.623 0.626) 0.886 25.829 ( 0.886 -0.874 -0.372) 1.299 25.884 ( 0.201 0.608 0.930) 1.129 25.925 ( -0.743 -0.308 0.959) 1.251 25.975 ( -0.095 0.387 -0.263) 0.477 26.481 ( -2.626 -0.017 2.551) 3.661 26.569 ( 3.396 -1.525 -0.210) 3.728 26.661 ( -0.807 -1.648 -9.473) 9.649 26.993 ( 2.863 1.175 14.090) 14.426 27.334 ( 1.012 1.441 -2.617) 3.155 28.095 ( -0.398 -1.653 -1.277) 2.126 28.569 ( -4.874 -5.089 -6.551) 9.622 28.824 ( -6.045 -4.713 -4.928) 9.112 28.942 ( -5.274 -10.635 -0.836) 11.901 29.266 ( 2.661 -1.014 3.644) 4.624 29.654 ( 10.151 22.773 4.042) 25.258 ======================= Grid point 15 (11/140) ======================= q-point: (-0.33 0.11 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 7.23e-05 7.23e-05 7.23e-05 7.23e-05 7.23e-05 7.23e-05 7.23e-05 7.23e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 244 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.417 ( -6.944 11.661 0.091) 13.572 1.901 ( -3.160 14.448 -6.024) 15.969 2.099 ( 4.877 5.263 -1.262) 7.285 2.367 ( 2.671 1.512 4.118) 5.136 2.564 ( 0.182 4.672 3.954) 6.124 2.583 ( -2.920 5.604 -1.912) 6.602 2.826 ( 2.249 3.684 0.756) 4.382 2.881 ( -1.783 -2.932 1.118) 3.609 3.011 ( -0.686 -1.255 -4.505) 4.726 3.097 ( -4.212 3.016 -0.698) 5.227 3.199 ( -3.902 -4.960 1.167) 6.418 3.287 ( 3.319 -0.478 -8.473) 9.112 3.404 ( -0.394 -1.425 1.448) 2.069 3.488 ( -2.121 -0.801 1.533) 2.737 3.740 ( -1.137 4.680 2.137) 5.269 3.775 ( 9.522 -6.005 0.662) 11.276 4.016 ( -5.160 -4.917 0.862) 7.180 4.199 ( 0.192 1.755 4.473) 4.809 4.224 ( 0.508 9.366 2.789) 9.785 4.469 ( 5.975 3.706 -3.882) 8.031 4.667 ( -4.941 3.356 -6.875) 9.107 4.824 ( 1.266 2.547 3.063) 4.180 4.845 ( -0.211 -2.359 1.112) 2.616 5.042 ( 4.531 -1.316 -1.093) 4.843 5.445 ( -4.369 -3.744 0.842) 5.815 5.575 ( -1.211 -1.721 3.804) 4.347 5.723 ( -0.550 1.052 2.619) 2.875 5.763 ( -2.109 0.854 -3.674) 4.321 5.794 ( 4.715 1.789 -4.395) 6.689 6.087 ( -3.520 0.711 0.352) 3.608 6.165 ( -1.002 -0.623 3.850) 4.027 6.413 ( 3.832 -1.197 -2.554) 4.758 6.566 ( 7.494 -3.023 0.887) 8.129 6.746 ( -6.847 3.259 -0.717) 7.617 6.804 ( -3.345 1.396 1.690) 4.000 7.026 ( 0.094 -6.850 0.913) 6.912 7.248 ( 1.449 -7.799 -3.529) 8.682 7.345 ( -0.366 -0.602 3.505) 3.575 7.540 ( 1.680 1.692 1.615) 2.880 7.751 ( 7.408 -0.802 3.942) 8.430 8.726 ( -5.445 -4.085 -4.716) 8.281 9.178 ( 4.223 -4.119 1.324) 6.046 9.222 ( 1.151 2.076 -1.202) 2.661 9.277 ( -1.101 0.793 1.414) 1.960 9.367 ( 3.808 0.191 -5.845) 6.979 9.518 ( -4.299 -0.376 3.357) 5.467 9.750 ( 1.219 2.561 0.448) 2.871 9.929 ( -1.669 7.348 -0.837) 7.581 10.234 ( 1.313 -3.084 0.527) 3.393 10.702 ( 0.398 3.536 -3.178) 4.771 11.015 ( -3.169 5.751 2.269) 6.948 11.060 ( -3.091 3.460 -0.794) 4.707 11.395 ( 2.348 5.265 -3.004) 6.501 11.542 ( -2.601 -2.011 -1.513) 3.619 11.631 ( 0.820 -10.196 0.444) 10.239 11.727 ( -2.440 0.446 0.532) 2.537 11.863 ( -0.687 6.550 -1.511) 6.757 12.015 ( 4.142 5.394 0.447) 6.815 12.112 ( -2.333 4.915 5.589) 7.800 12.397 ( 2.208 -3.235 5.915) 7.095 12.484 ( 0.522 -3.081 0.323) 3.142 12.777 ( -5.214 -1.584 5.714) 7.896 12.852 ( 7.491 -8.073 -5.261) 12.205 13.125 ( 0.394 -9.391 -9.453) 13.330 14.684 ( -3.515 3.738 0.519) 5.157 14.864 ( 1.673 2.124 0.305) 2.721 15.090 ( 4.867 -0.234 0.894) 4.954 15.195 ( -1.794 -6.049 0.748) 6.354 15.406 ( -0.927 -0.809 2.013) 2.359 15.538 ( 0.607 3.338 -0.769) 3.479 15.588 ( 2.026 5.605 -1.913) 6.260 15.739 ( 6.100 -3.268 -2.218) 7.267 15.887 ( -4.204 -0.844 3.855) 5.766 16.144 ( -3.390 -5.842 -5.721) 8.851 16.212 ( -4.261 -2.957 3.335) 6.167 16.750 ( -0.564 -1.044 -0.362) 1.241 16.951 ( 5.849 7.767 2.612) 10.067 17.397 ( -1.565 3.788 -0.024) 4.099 17.907 ( -2.921 -5.714 -0.482) 6.435 18.155 ( 0.049 -0.204 0.375) 0.430 25.712 ( -0.784 1.590 0.192) 1.783 25.836 ( -0.669 1.617 -0.019) 1.750 25.855 ( 0.819 2.164 0.721) 2.424 25.911 ( -0.541 0.295 -1.344) 1.478 26.000 ( 0.681 -1.874 0.318) 2.020 26.481 ( -1.510 0.081 4.723) 4.959 26.613 ( 3.250 -1.315 -3.236) 4.772 26.644 ( -0.375 -1.629 -6.693) 6.899 27.054 ( 2.525 3.363 13.594) 14.230 27.335 ( 3.954 -2.736 -3.608) 6.011 28.117 ( 0.894 -1.284 -0.544) 1.656 28.584 ( -4.837 -4.729 -7.408) 10.032 28.803 ( -3.576 -0.941 -5.724) 6.814 29.075 ( -1.960 -8.372 2.496) 8.953 29.246 ( -2.601 8.521 0.747) 8.940 29.447 ( 4.226 8.286 5.353) 10.732 ======================= Grid point 16 (12/140) ======================= q-point: (-0.22 0.11 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 7.23e-05 7.23e-05 7.23e-05 7.23e-05 7.23e-05 7.23e-05 7.23e-05 7.23e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 244 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.108 ( -7.293 17.609 -0.313) 19.062 1.516 ( -3.993 23.246 -6.731) 24.528 1.927 ( -0.015 18.914 -1.191) 18.951 2.231 ( 0.869 17.756 -1.026) 17.807 2.444 ( 4.084 4.527 2.548) 6.608 2.540 ( -2.910 1.616 -0.293) 3.342 2.743 ( 0.906 7.783 -0.265) 7.840 2.930 ( -1.480 4.241 5.020) 6.736 2.997 ( -0.578 0.487 -0.724) 1.047 3.015 ( 0.522 -2.192 -4.203) 4.769 3.119 ( 2.086 12.848 -3.592) 13.502 3.269 ( -4.836 5.294 0.954) 7.234 3.416 ( 0.549 2.015 1.430) 2.531 3.516 ( 1.385 -6.153 1.306) 6.440 3.664 ( -1.345 0.586 -1.495) 2.095 3.919 ( -0.465 -0.860 -0.881) 1.315 4.047 ( 6.913 -2.892 2.562) 7.920 4.146 ( -1.791 0.311 3.238) 3.714 4.277 ( 1.883 -5.394 5.736) 8.096 4.436 ( 3.529 2.175 -4.099) 5.830 4.530 ( -7.279 2.060 -7.110) 10.381 4.734 ( 1.117 8.175 0.108) 8.252 4.927 ( 1.215 -4.394 1.761) 4.887 5.086 ( 2.078 -1.274 -0.532) 2.494 5.432 ( -4.613 1.152 -0.850) 4.830 5.606 ( 0.884 0.451 4.880) 4.980 5.657 ( 0.126 6.193 -1.581) 6.392 5.743 ( -2.708 -4.700 -0.694) 5.468 5.856 ( 3.446 -3.854 -0.560) 5.200 6.078 ( -1.040 -0.883 0.650) 1.511 6.197 ( -0.568 -2.563 1.098) 2.845 6.446 ( 3.204 -0.503 -1.087) 3.420 6.605 ( -4.572 3.961 -1.425) 6.215 6.653 ( 2.878 0.512 -2.120) 3.611 6.754 ( -3.737 2.601 4.111) 6.134 7.177 ( 0.003 -8.798 0.677) 8.824 7.355 ( 0.105 -2.187 0.759) 2.317 7.420 ( 5.898 -6.034 4.215) 9.432 7.554 ( -1.633 -4.717 -4.804) 6.927 7.845 ( 6.678 -0.548 5.048) 8.389 8.734 ( -4.054 -2.675 -3.213) 5.824 9.077 ( -0.690 8.744 -2.891) 9.235 9.264 ( 1.612 1.976 5.920) 6.445 9.292 ( 4.469 2.290 3.769) 6.279 9.372 ( -0.133 -2.904 -8.131) 8.635 9.561 ( 0.754 -2.911 3.092) 4.313 9.668 ( 2.221 6.365 3.142) 7.438 9.736 ( -3.751 10.298 -6.528) 12.756 10.312 ( 2.557 -1.789 2.648) 4.093 10.625 ( -2.405 2.470 -4.783) 5.896 10.888 ( -1.635 4.786 0.552) 5.087 11.003 ( -3.837 0.404 -0.054) 3.858 11.355 ( 2.212 0.968 -1.497) 2.841 11.514 ( -4.224 1.426 -1.319) 4.649 11.620 ( -1.542 8.310 1.911) 8.665 11.818 ( -0.618 -3.503 -0.202) 3.563 11.834 ( 1.017 -8.488 -0.915) 8.597 11.943 ( 5.294 5.342 -4.188) 8.608 12.007 ( -6.360 5.036 4.575) 9.313 12.475 ( 0.978 -2.616 2.817) 3.966 12.581 ( 3.688 -2.493 7.094) 8.375 12.763 ( -3.310 -1.491 -5.936) 6.958 13.110 ( 6.759 -12.824 8.986) 17.055 13.269 ( 2.811 -12.425 -14.484) 19.289 14.613 ( -2.704 1.580 1.083) 3.313 14.830 ( 2.051 1.665 -0.003) 2.642 15.153 ( 4.336 0.382 1.172) 4.508 15.254 ( -3.642 -3.958 1.124) 5.495 15.433 ( 2.521 1.427 3.476) 4.525 15.476 ( 1.378 7.057 -3.237) 7.885 15.514 ( -1.928 -2.894 -1.810) 3.921 15.817 ( 6.523 -1.669 -4.724) 8.225 15.893 ( -7.006 -2.129 6.668) 9.904 16.193 ( 6.289 -1.058 -6.888) 9.387 16.283 ( -10.387 -10.405 4.755) 15.452 16.749 ( -1.170 0.218 -0.046) 1.191 16.863 ( 2.918 7.699 1.923) 8.455 17.310 ( -2.647 4.373 -0.096) 5.113 17.993 ( -1.735 -5.327 0.729) 5.650 18.173 ( 0.167 -2.187 0.725) 2.311 25.680 ( -0.530 1.514 0.027) 1.604 25.776 ( -0.718 3.514 -0.350) 3.604 25.831 ( 0.152 1.896 0.074) 1.904 25.903 ( 0.151 0.008 -0.951) 0.963 26.029 ( 0.436 -0.598 0.279) 0.791 26.504 ( -0.502 -0.236 7.270) 7.291 26.616 ( 0.887 -1.946 -11.339) 11.539 26.651 ( 0.865 0.012 1.312) 1.571 27.035 ( 0.214 5.255 5.602) 7.684 27.477 ( 8.489 -8.006 2.614) 11.958 28.148 ( 2.512 -1.196 -0.329) 2.801 28.575 ( -4.485 -3.051 -6.156) 8.204 28.764 ( 1.481 1.658 -2.673) 3.476 29.009 ( -2.454 13.642 -2.094) 14.018 29.224 ( -0.347 -7.784 4.408) 8.952 29.403 ( -6.997 1.247 1.529) 7.270 ======================= Grid point 17 (13/140) ======================= q-point: (-0.11 0.11 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 7.23e-05 7.23e-05 7.23e-05 7.23e-05 7.23e-05 7.23e-05 7.23e-05 7.23e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 140 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.745 ( -0.000 21.082 -0.000) 21.082 1.036 ( -0.000 28.737 -0.000) 28.737 1.458 ( -0.000 34.493 -0.000) 34.493 1.877 ( -0.000 22.735 -0.000) 22.735 2.456 ( -0.000 3.949 -0.000) 3.949 2.465 ( -0.000 1.857 -0.000) 1.857 2.548 ( -0.000 15.580 -0.000) 15.580 2.795 ( -0.000 9.594 -0.000) 9.594 2.856 ( -0.000 12.561 -0.000) 12.561 2.947 ( -0.000 16.789 -0.000) 16.789 2.989 ( -0.000 4.589 -0.000) 4.589 3.192 ( 0.000 -11.687 0.000) 11.687 3.457 ( 0.000 -1.762 0.000) 1.762 3.620 ( 0.000 -4.121 0.000) 4.121 3.627 ( -0.000 2.256 -0.000) 2.256 4.005 ( 0.000 -9.818 0.000) 9.818 4.085 ( -0.000 8.428 -0.000) 8.428 4.153 ( 0.000 -4.289 0.000) 4.289 4.401 ( 0.000 -1.745 0.000) 1.745 4.425 ( 0.000 -3.092 0.000) 3.092 4.479 ( 0.000 -2.908 0.000) 2.908 4.625 ( -0.000 4.006 -0.000) 4.006 4.995 ( 0.000 -1.504 0.000) 1.504 5.114 ( 0.000 -1.455 0.000) 1.455 5.359 ( -0.000 3.930 -0.000) 3.930 5.516 ( -0.000 8.571 -0.000) 8.571 5.642 ( 0.000 -2.067 0.000) 2.067 5.859 ( 0.000 -9.923 0.000) 9.923 5.931 ( 0.000 -2.531 0.000) 2.531 6.103 ( 0.000 -2.622 0.000) 2.622 6.252 ( 0.000 -4.117 0.000) 4.117 6.454 ( -0.000 2.625 -0.000) 2.625 6.479 ( -0.000 5.310 -0.000) 5.310 6.633 ( -0.000 3.339 -0.000) 3.339 6.742 ( 0.000 -2.605 0.000) 2.605 7.281 ( 0.000 -3.632 0.000) 3.632 7.364 ( -0.000 1.599 -0.000) 1.599 7.604 ( 0.000 -8.670 0.000) 8.670 7.637 ( 0.000 -8.456 0.000) 8.456 7.898 ( 0.000 -0.309 0.000) 0.309 8.658 ( -0.000 9.505 -0.000) 9.505 8.983 ( -0.000 0.154 -0.000) 0.154 9.219 ( -0.000 6.504 -0.000) 6.504 9.277 ( -0.000 2.437 -0.000) 2.437 9.358 ( -0.000 2.856 -0.000) 2.856 9.498 ( -0.000 6.270 -0.000) 6.270 9.519 ( -0.000 8.791 -0.000) 8.791 9.760 ( 0.000 -8.783 0.000) 8.783 10.312 ( -0.000 4.076 -0.000) 4.076 10.561 ( -0.000 1.215 -0.000) 1.215 10.875 ( 0.000 -3.061 0.000) 3.061 10.995 ( 0.000 -1.220 0.000) 1.220 11.344 ( -0.000 3.218 -0.000) 3.218 11.429 ( -0.000 5.887 -0.000) 5.887 11.508 ( -0.000 1.980 -0.000) 1.980 11.834 ( -0.000 0.829 -0.000) 0.829 11.872 ( -0.000 2.396 -0.000) 2.396 11.941 ( -0.000 0.232 -0.000) 0.232 12.005 ( 0.000 -8.021 0.000) 8.021 12.533 ( 0.000 -2.723 0.000) 2.723 12.652 ( 0.000 -0.082 0.000) 0.082 12.733 ( 0.000 -0.416 0.000) 0.416 13.387 ( 0.000 -9.253 0.000) 9.253 13.443 ( 0.000 -13.166 0.000) 13.166 14.622 ( 0.000 -4.094 0.000) 4.094 14.863 ( 0.000 -4.428 0.000) 4.428 15.134 ( -0.000 2.948 -0.000) 2.948 15.293 ( 0.000 -0.054 0.000) 0.054 15.316 ( -0.000 10.063 -0.000) 10.063 15.437 ( 0.000 -1.278 0.000) 1.278 15.596 ( 0.000 -6.364 0.000) 6.364 15.827 ( -0.000 1.882 -0.000) 1.882 15.919 ( 0.000 -1.626 0.000) 1.626 16.206 ( -0.000 0.297 -0.000) 0.297 16.430 ( 0.000 -9.820 0.000) 9.820 16.724 ( -0.000 1.555 -0.000) 1.555 16.771 ( -0.000 4.818 -0.000) 4.818 17.219 ( -0.000 4.830 -0.000) 4.830 18.037 ( 0.000 -0.726 0.000) 0.726 18.249 ( 0.000 -5.776 0.000) 5.776 25.654 ( -0.000 1.513 -0.000) 1.513 25.721 ( -0.000 2.323 -0.000) 2.323 25.800 ( -0.000 1.742 -0.000) 1.742 25.898 ( -0.000 0.411 -0.000) 0.411 26.024 ( -0.000 1.440 -0.000) 1.440 26.541 ( 0.000 -1.168 0.000) 1.168 26.611 ( 0.000 -1.652 0.000) 1.652 26.655 ( -0.000 0.229 -0.000) 0.229 26.955 ( -0.000 5.708 -0.000) 5.708 27.698 ( 0.000 -10.601 0.000) 10.601 28.193 ( 0.000 -2.379 0.000) 2.379 28.587 ( 0.000 -2.335 0.000) 2.335 28.759 ( -0.000 12.603 -0.000) 12.603 28.764 ( 0.000 -0.045 0.000) 0.045 29.279 ( -0.000 5.998 -0.000) 5.998 29.368 ( 0.000 -6.993 0.000) 6.993 ======================= Grid point 20 (14/140) ======================= q-point: ( 0.22 0.22 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 7.23e-05 7.23e-05 7.23e-05 7.23e-05 7.23e-05 7.23e-05 7.23e-05 7.23e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 140 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.055 ( 17.903 0.000 17.868) 25.294 1.197 ( 33.175 0.000 4.167) 33.435 1.411 ( -1.439 -0.000 8.489) 8.610 1.818 ( 3.896 0.000 11.500) 12.142 1.941 ( -5.058 -0.000 -5.806) 7.700 2.146 ( 17.284 0.000 16.272) 23.738 2.297 ( -10.073 -0.000 6.459) 11.966 2.490 ( 4.770 0.000 -2.919) 5.592 2.535 ( -5.904 -0.000 2.370) 6.362 2.915 ( 10.285 0.000 -2.181) 10.513 3.012 ( -0.292 -0.000 4.577) 4.587 3.251 ( -2.756 -0.000 -15.825) 16.064 3.504 ( -1.994 -0.000 -5.579) 5.925 3.514 ( -7.053 -0.000 -6.146) 9.355 3.775 ( 6.647 0.000 5.666) 8.734 3.815 ( -3.029 -0.000 8.222) 8.762 4.119 ( -1.064 -0.000 -8.292) 8.360 4.134 ( -13.373 -0.000 -2.911) 13.686 4.184 ( -3.059 -0.000 1.146) 3.267 4.444 ( -3.115 -0.000 7.065) 7.721 4.628 ( 3.626 0.000 -0.295) 3.638 4.706 ( -2.217 -0.000 4.561) 5.071 4.798 ( 7.828 0.000 -5.735) 9.704 5.130 ( -4.515 -0.000 -2.078) 4.970 5.300 ( 2.192 0.000 4.154) 4.697 5.509 ( 3.235 0.000 -0.481) 3.271 5.670 ( -4.212 -0.000 -7.973) 9.017 5.777 ( 11.230 0.000 -0.213) 11.232 6.157 ( -0.944 -0.000 -2.262) 2.451 6.182 ( 3.134 0.000 3.640) 4.803 6.362 ( -6.059 -0.000 0.625) 6.091 6.410 ( 0.565 0.000 -0.147) 0.584 6.668 ( 4.568 0.000 7.531) 8.808 6.773 ( -2.410 -0.000 -4.609) 5.201 6.816 ( 3.256 0.000 -1.474) 3.574 7.080 ( -8.978 -0.000 5.794) 10.685 7.285 ( -0.706 -0.000 -5.546) 5.591 7.594 ( -0.647 -0.000 -5.367) 5.405 7.638 ( -13.621 -0.000 -0.163) 13.622 7.704 ( 1.787 0.000 6.281) 6.531 8.553 ( 3.507 0.000 6.567) 7.445 8.779 ( -5.517 -0.000 -6.414) 8.461 8.881 ( -3.414 -0.000 -10.838) 11.363 8.884 ( -7.887 -0.000 -6.140) 9.995 9.265 ( -10.403 -0.000 -0.057) 10.403 9.470 ( 3.445 0.000 -1.746) 3.862 9.896 ( 3.183 0.000 2.313) 3.934 10.092 ( -0.836 -0.000 2.339) 2.484 10.123 ( -3.099 -0.000 11.338) 11.754 10.463 ( 0.430 0.000 13.618) 13.625 10.770 ( 5.649 0.000 4.450) 7.191 11.049 ( 3.897 0.000 -1.944) 4.355 11.237 ( 6.965 0.000 6.810) 9.741 11.391 ( 5.173 0.000 -2.678) 5.825 11.685 ( -7.602 -0.000 1.676) 7.784 11.741 ( -0.496 -0.000 -1.593) 1.669 11.941 ( -0.220 -0.000 2.804) 2.813 11.998 ( -6.266 -0.000 14.978) 16.236 12.224 ( 1.212 0.000 -0.041) 1.213 12.393 ( -6.837 -0.000 -8.117) 10.612 12.450 ( 1.822 0.000 -2.675) 3.237 12.633 ( -9.762 -0.000 8.508) 12.949 13.055 ( 6.601 0.000 -2.581) 7.088 13.462 ( -4.289 -0.000 5.146) 6.699 14.815 ( -1.840 -0.000 0.600) 1.935 14.955 ( -2.272 -0.000 -2.232) 3.185 15.049 ( 3.165 0.000 1.782) 3.632 15.209 ( -9.629 -0.000 -2.627) 9.980 15.439 ( 8.066 0.000 3.029) 8.616 15.682 ( -0.732 -0.000 -0.797) 1.083 15.732 ( -1.138 -0.000 -0.516) 1.249 15.854 ( 0.854 0.000 -3.948) 4.039 15.974 ( 11.886 0.000 -7.611) 14.114 16.186 ( -11.606 -0.000 3.249) 12.052 16.220 ( -1.616 -0.000 4.613) 4.888 16.442 ( -3.328 -0.000 -5.053) 6.050 17.270 ( 8.251 0.000 2.972) 8.770 17.803 ( 4.152 0.000 -1.226) 4.330 17.984 ( 4.565 0.000 -12.704) 13.500 18.120 ( 8.718 0.000 -16.504) 18.665 25.671 ( 2.083 0.000 0.702) 2.198 25.727 ( 1.643 0.000 0.623) 1.757 25.771 ( -1.668 -0.000 2.188) 2.751 25.881 ( -1.257 -0.000 1.088) 1.662 26.023 ( -0.201 -0.000 5.815) 5.818 26.351 ( 1.147 0.000 6.500) 6.600 26.480 ( -0.350 -0.000 -5.219) 5.231 26.628 ( 0.148 0.000 -1.538) 1.545 27.001 ( -6.760 -0.000 13.721) 15.296 27.319 ( 5.068 0.000 7.974) 9.448 27.848 ( -0.091 -0.000 -7.699) 7.700 28.354 ( -2.530 -0.000 -3.402) 4.240 28.456 ( -0.455 -0.000 -0.095) 0.465 28.638 ( -4.845 -0.000 0.608) 4.883 29.338 ( 1.204 0.000 -10.837) 10.903 31.022 ( 6.787 0.000 -7.899) 10.414 ======================= Grid point 21 (15/140) ======================= q-point: ( 0.33 0.22 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 7.23e-05 7.23e-05 7.23e-05 7.23e-05 7.23e-05 7.23e-05 7.23e-05 7.23e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 244 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.276 ( 10.016 -7.326 12.037) 17.288 1.508 ( 23.920 -3.045 3.131) 24.316 1.633 ( 2.231 -15.170 5.856) 16.413 1.845 ( 0.259 -7.872 7.404) 10.810 2.038 ( -6.486 -16.087 -2.770) 17.565 2.318 ( -7.742 -5.599 3.350) 10.124 2.395 ( 9.049 -2.706 8.382) 12.628 2.548 ( -2.147 -7.872 5.520) 9.851 2.667 ( 7.821 -8.951 4.409) 12.677 3.014 ( 6.923 -2.721 -0.841) 7.485 3.065 ( 2.857 -3.463 8.789) 9.869 3.166 ( -1.999 -1.621 -16.244) 16.447 3.397 ( -6.688 2.333 -5.733) 9.113 3.498 ( -1.240 -4.784 -2.636) 5.601 3.742 ( -3.199 8.633 1.774) 9.376 3.882 ( 4.745 -2.499 6.027) 8.067 3.937 ( -3.692 9.651 -8.637) 13.467 4.026 ( -4.619 1.236 2.640) 5.462 4.229 ( -2.278 -5.364 -5.533) 8.036 4.533 ( -4.053 -7.505 4.801) 9.788 4.636 ( 2.636 2.260 2.197) 4.109 4.727 ( -3.006 -3.053 5.934) 7.320 4.855 ( 7.761 -1.009 -2.024) 8.084 5.081 ( -3.128 1.063 -1.291) 3.547 5.316 ( -1.592 2.246 1.952) 3.375 5.496 ( 1.426 1.840 -4.855) 5.385 5.618 ( -2.925 -1.679 -5.121) 6.132 5.879 ( 10.772 -1.451 -3.343) 11.372 6.116 ( -1.835 2.246 -1.494) 3.263 6.188 ( 5.928 4.593 3.645) 8.338 6.280 ( -7.823 2.065 -0.525) 8.108 6.402 ( -0.497 1.800 -0.593) 1.959 6.650 ( 0.999 7.846 2.085) 8.180 6.758 ( 1.990 -3.046 3.042) 4.742 6.825 ( 4.772 1.816 -1.969) 5.472 7.123 ( -6.367 -5.866 2.601) 9.040 7.255 ( -3.434 0.141 -5.965) 6.885 7.349 ( -9.100 9.857 -2.900) 13.725 7.672 ( -4.800 1.116 3.142) 5.845 7.691 ( 3.371 0.594 0.613) 3.477 8.646 ( -0.773 -4.380 3.977) 5.966 8.770 ( -6.179 -7.966 -5.510) 11.489 8.812 ( -3.676 -3.420 -4.208) 6.551 8.910 ( -5.256 -8.953 -7.636) 12.888 9.213 ( -4.623 -2.321 -1.503) 5.387 9.435 ( 2.431 3.945 -0.924) 4.725 9.912 ( 2.178 0.705 4.702) 5.229 9.980 ( 1.721 8.892 6.382) 11.080 10.214 ( 0.240 -3.117 5.725) 6.522 10.728 ( -2.874 -14.393 8.377) 16.900 10.841 ( 4.625 -1.298 3.577) 5.989 11.096 ( 4.391 -3.023 -1.770) 5.617 11.340 ( 6.696 -1.330 -2.176) 7.165 11.433 ( 2.726 -5.162 1.469) 6.020 11.635 ( -4.355 0.552 1.518) 4.645 11.721 ( -0.138 0.064 -2.576) 2.580 11.977 ( 1.715 0.410 5.189) 5.481 12.036 ( -4.336 -1.049 6.942) 8.252 12.197 ( 0.117 4.681 3.729) 5.985 12.270 ( -4.063 0.305 -7.228) 8.297 12.445 ( 3.039 1.944 -1.429) 3.880 12.663 ( -13.886 -7.348 6.704) 17.081 13.043 ( 1.921 3.786 -5.704) 7.111 13.416 ( -3.599 5.406 6.103) 8.912 14.731 ( 0.215 5.909 1.652) 6.139 14.928 ( -2.984 2.099 -1.936) 4.130 15.103 ( -2.265 -3.339 -3.557) 5.379 15.185 ( -2.527 -5.287 1.787) 6.127 15.382 ( 5.580 11.978 0.290) 13.217 15.644 ( 2.373 4.116 1.494) 4.980 15.707 ( -2.687 0.221 1.783) 3.232 15.817 ( 3.385 3.346 -2.947) 5.599 16.015 ( 8.581 0.841 -8.673) 12.229 16.150 ( -7.801 -2.161 4.054) 9.054 16.244 ( -4.790 -1.971 -0.087) 5.180 16.450 ( -2.516 -5.761 -2.099) 6.628 17.320 ( 9.900 4.589 1.685) 11.041 17.660 ( 9.769 11.630 -4.456) 15.829 18.037 ( -2.072 -3.680 -10.392) 11.218 18.097 ( 1.889 0.752 -2.697) 3.377 25.691 ( 1.995 -0.341 -0.050) 2.024 25.764 ( 1.900 -2.113 0.505) 2.886 25.781 ( -1.141 -1.223 2.141) 2.717 25.882 ( -1.501 -0.737 1.079) 1.990 26.044 ( 0.235 0.868 5.239) 5.316 26.411 ( -3.959 -3.548 1.981) 5.673 26.477 ( 3.824 -0.550 -1.907) 4.308 26.636 ( -0.227 -1.631 -2.855) 3.296 26.997 ( -3.267 2.044 11.366) 12.001 27.397 ( 4.457 0.701 7.518) 8.768 27.901 ( -1.649 -9.172 -6.678) 11.465 28.341 ( -4.010 -3.771 -4.747) 7.269 28.484 ( -1.679 -3.504 -0.131) 3.888 28.604 ( -6.669 -2.754 -1.805) 7.437 29.293 ( 3.894 1.469 -8.416) 9.389 30.847 ( 8.561 20.813 -1.372) 22.547 ======================= Grid point 22 (16/140) ======================= q-point: ( 0.44 0.22 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 7.23e-05 7.23e-05 7.23e-05 7.23e-05 7.23e-05 7.23e-05 7.23e-05 7.23e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 244 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.540 ( -0.989 -10.167 4.878) 11.320 1.675 ( 16.029 -4.305 3.424) 16.946 1.914 ( 6.359 -11.119 0.236) 12.811 2.158 ( 6.786 -12.497 8.668) 16.654 2.260 ( -4.587 -13.386 4.635) 14.889 2.415 ( -6.427 -12.366 2.694) 14.195 2.535 ( 4.237 -5.548 7.963) 10.590 2.728 ( -5.232 -11.222 -0.886) 12.413 2.828 ( -0.424 -8.450 -3.618) 9.202 3.051 ( 0.520 0.413 -1.179) 1.353 3.135 ( 0.367 -3.180 -8.652) 9.225 3.203 ( -0.578 -2.843 9.706) 10.130 3.280 ( -6.657 1.069 -6.737) 9.531 3.572 ( -4.377 7.081 1.289) 8.424 3.661 ( 6.347 -0.882 -4.293) 7.713 3.695 ( -1.578 0.207 -4.985) 5.233 3.926 ( -2.443 0.283 3.597) 4.357 4.160 ( 12.579 -8.458 3.239) 15.501 4.262 ( -1.146 -4.268 -1.720) 4.742 4.591 ( 0.932 2.225 4.956) 5.512 4.647 ( -2.808 -2.308 2.215) 4.257 4.788 ( -1.677 -2.512 1.758) 3.495 4.902 ( 0.849 1.261 -0.525) 1.608 5.062 ( 2.200 -0.070 4.489) 4.999 5.247 ( -2.111 0.389 -3.749) 4.320 5.436 ( -3.294 2.388 -4.090) 5.769 5.622 ( -2.549 -3.321 -0.722) 4.248 5.910 ( 4.801 1.804 -10.899) 12.045 6.042 ( -1.516 4.521 -1.318) 4.947 6.197 ( 7.944 1.783 1.411) 8.263 6.202 ( -5.559 1.239 5.322) 7.795 6.342 ( 1.061 4.011 -2.639) 4.917 6.559 ( 1.897 5.328 0.584) 5.686 6.800 ( 4.923 1.975 0.541) 5.332 6.856 ( -1.348 -2.880 2.919) 4.317 7.023 ( -8.527 6.197 -3.671) 11.162 7.200 ( -2.992 1.997 -8.550) 9.275 7.252 ( -5.519 -3.937 3.846) 7.794 7.616 ( 5.065 4.332 3.379) 7.473 7.727 ( -1.559 -1.333 2.322) 3.098 8.672 ( -6.554 -2.597 -2.243) 7.398 8.843 ( -3.591 -8.115 -6.450) 10.971 8.924 ( -1.246 -10.311 3.590) 10.989 9.010 ( -4.365 -10.676 -5.905) 12.957 9.272 ( 0.654 -7.681 -2.450) 8.089 9.402 ( -0.033 1.002 -0.272) 1.039 9.848 ( 1.542 9.148 3.948) 10.083 9.994 ( 3.272 -2.219 5.143) 6.487 10.260 ( -0.255 0.785 3.683) 3.774 10.863 ( -0.655 0.043 5.475) 5.515 10.939 ( 4.513 -5.012 3.125) 7.433 11.182 ( 3.154 -2.637 0.228) 4.118 11.370 ( 3.772 -3.758 -9.923) 11.261 11.521 ( -0.033 3.825 4.873) 6.195 11.700 ( 0.085 -6.519 -3.552) 7.424 11.725 ( 0.312 -6.700 0.672) 6.741 11.929 ( -6.730 6.906 0.073) 9.644 12.008 ( 2.919 0.901 2.876) 4.196 12.181 ( 1.686 1.684 6.521) 6.943 12.298 ( 2.994 -4.862 -1.017) 5.800 12.421 ( 2.978 2.866 -0.295) 4.144 12.701 ( -14.260 -6.711 4.900) 16.504 12.902 ( -1.798 8.227 -7.473) 11.259 13.282 ( -5.716 9.720 5.787) 12.674 14.689 ( 1.585 0.943 3.005) 3.526 14.843 ( -2.873 2.633 -2.419) 4.587 15.122 ( -1.263 -0.643 -1.233) 1.878 15.190 ( 1.942 3.612 -1.808) 4.482 15.327 ( -0.178 -2.547 1.916) 3.192 15.596 ( 2.171 4.820 3.452) 6.314 15.686 ( 1.047 1.000 -0.626) 1.577 15.787 ( 3.127 2.901 -0.803) 4.340 15.992 ( 3.357 2.989 -4.969) 6.700 16.141 ( -6.900 -1.412 0.774) 7.085 16.204 ( -4.130 0.863 -2.449) 4.878 16.548 ( -1.155 -7.167 0.035) 7.259 17.287 ( 13.021 9.505 0.862) 16.144 17.582 ( 7.024 5.185 -1.197) 8.812 17.942 ( -6.182 2.885 -8.484) 10.886 18.120 ( -0.235 -1.427 1.178) 1.866 25.718 ( 1.794 -1.084 0.132) 2.100 25.795 ( -0.464 -1.340 -0.332) 1.456 25.834 ( 1.680 -2.578 2.296) 3.840 25.889 ( -1.831 -0.997 0.689) 2.195 26.044 ( 0.177 2.078 3.687) 4.236 26.426 ( -4.294 -2.788 -1.086) 5.233 26.529 ( 4.280 -0.991 2.044) 4.846 26.630 ( -0.309 -0.465 -6.165) 6.190 27.011 ( -0.861 0.660 11.276) 11.328 27.434 ( 4.563 3.190 5.280) 7.673 27.989 ( -2.368 -5.790 -4.642) 7.790 28.351 ( -8.884 -6.910 -9.154) 14.508 28.556 ( -2.363 -8.421 -0.731) 8.777 28.633 ( -4.627 -5.942 -0.876) 7.582 29.279 ( 5.276 0.927 -3.500) 6.398 30.519 ( 9.131 25.941 2.340) 27.601 ======================= Grid point 23 (17/140) ======================= q-point: ( 0.56 0.22 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 7.23e-05 7.23e-05 7.23e-05 7.23e-05 7.23e-05 7.23e-05 7.23e-05 7.23e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 244 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.636 ( 1.090 -0.143 2.961) 3.158 1.938 ( 10.792 -8.472 4.165) 14.338 2.062 ( -1.766 -6.344 -2.935) 7.210 2.310 ( -2.030 -3.696 1.226) 4.392 2.504 ( 5.653 -8.322 8.556) 13.207 2.600 ( -3.115 -8.503 3.385) 9.667 2.719 ( 2.828 -6.787 9.247) 11.814 2.783 ( -5.225 -6.631 -5.294) 9.965 2.951 ( -0.667 -7.953 -7.671) 11.069 3.021 ( -4.287 2.484 0.294) 4.964 3.135 ( -2.844 -0.773 -7.446) 8.009 3.213 ( -2.600 -4.204 -1.522) 5.172 3.315 ( -1.113 -5.267 7.009) 8.837 3.403 ( -3.011 6.489 -4.297) 8.345 3.608 ( 2.785 -3.225 -2.603) 4.993 3.821 ( 0.325 -3.956 -2.874) 4.901 3.915 ( -1.174 1.181 2.008) 2.609 4.268 ( 4.128 -0.677 2.832) 5.052 4.500 ( 9.244 -7.402 3.846) 12.451 4.554 ( 3.676 6.397 4.989) 8.906 4.640 ( -5.659 -1.386 -3.291) 6.692 4.789 ( 0.137 0.976 0.835) 1.291 4.869 ( -0.752 0.521 1.367) 1.645 5.092 ( 5.533 2.686 1.745) 6.393 5.261 ( -2.344 -3.109 -4.179) 5.712 5.403 ( -5.758 -6.218 4.185) 9.452 5.671 ( -2.505 -4.295 0.281) 4.980 5.824 ( 0.642 2.935 -9.534) 9.996 5.935 ( -0.103 4.807 -5.910) 7.619 6.172 ( -5.133 3.033 4.928) 7.735 6.195 ( 1.573 3.411 2.147) 4.326 6.356 ( 10.320 -2.773 -2.820) 11.052 6.502 ( 0.453 2.771 0.941) 2.962 6.810 ( 4.257 1.007 -1.723) 4.702 6.852 ( -8.965 0.927 -0.449) 9.024 6.912 ( -2.054 0.689 4.423) 4.925 7.112 ( -0.448 0.691 -8.920) 8.958 7.289 ( -3.801 -3.203 2.948) 5.779 7.638 ( 3.796 1.494 4.451) 6.037 7.739 ( 2.154 0.429 2.102) 3.040 8.642 ( -5.731 -1.524 -3.228) 6.751 8.940 ( -1.004 -8.598 -3.274) 9.254 9.088 ( -2.190 -8.283 -0.378) 8.576 9.128 ( -1.171 -8.639 -1.358) 8.823 9.388 ( -0.720 0.221 -0.036) 0.754 9.443 ( 1.080 -12.531 -2.182) 12.765 9.714 ( 0.277 8.997 0.956) 9.052 10.087 ( 2.798 -2.400 4.391) 5.733 10.220 ( -1.405 3.939 0.667) 4.235 10.853 ( 1.727 3.472 2.660) 4.702 11.059 ( 1.915 -3.001 3.790) 5.200 11.207 ( 1.113 1.165 -0.899) 1.845 11.441 ( 6.087 -3.241 -4.712) 8.352 11.460 ( -1.904 1.607 0.971) 2.674 11.669 ( -2.561 3.149 -3.521) 5.373 11.711 ( -4.061 6.728 -2.548) 8.262 11.967 ( -0.091 -8.282 3.792) 9.110 12.060 ( 5.938 -1.395 1.609) 6.308 12.198 ( 1.320 0.959 5.868) 6.091 12.389 ( 0.132 -0.357 -2.628) 2.655 12.413 ( 6.537 0.230 3.443) 7.391 12.717 ( -9.237 -4.308 0.010) 10.192 12.735 ( -0.546 3.750 -4.265) 5.705 13.077 ( -8.907 8.994 2.609) 12.924 14.739 ( 0.364 -2.449 2.912) 3.822 14.793 ( -0.366 -0.149 -1.757) 1.801 15.072 ( 1.486 2.551 0.494) 2.994 15.235 ( -1.705 -4.577 1.365) 5.071 15.307 ( 0.163 3.586 -3.183) 4.798 15.603 ( 2.200 -1.071 3.736) 4.466 15.682 ( 1.416 0.975 0.122) 1.723 15.749 ( 3.959 4.185 -0.795) 5.815 15.934 ( 1.073 3.262 -2.397) 4.188 16.067 ( -10.314 1.121 -1.735) 10.518 16.175 ( -0.181 -0.278 -1.247) 1.291 16.649 ( -0.471 -5.307 0.159) 5.331 17.235 ( 12.338 9.519 1.909) 15.700 17.541 ( 2.849 4.539 0.545) 5.387 17.814 ( -7.306 0.726 -5.693) 9.290 18.141 ( -0.247 -0.856 0.672) 1.116 25.745 ( 0.640 -0.236 0.618) 0.921 25.814 ( 0.883 -1.436 -0.728) 1.836 25.883 ( -1.237 -0.528 1.011) 1.683 25.905 ( 0.491 -2.366 1.015) 2.621 26.012 ( -0.096 3.293 1.684) 3.700 26.442 ( -2.960 -2.706 0.559) 4.050 26.583 ( 2.067 -1.097 2.232) 3.234 26.598 ( 1.259 0.234 -7.489) 7.598 27.078 ( 1.377 -1.464 12.052) 12.219 27.396 ( 2.548 5.975 -0.539) 6.518 28.031 ( -1.606 -3.954 -2.540) 4.967 28.361 ( -7.648 -7.661 -8.874) 13.998 28.678 ( -3.924 -6.411 -2.530) 7.931 28.726 ( -2.370 -10.491 0.895) 10.793 29.305 ( 4.162 -0.103 0.454) 4.188 30.156 ( 6.913 26.116 2.799) 27.160 ======================= Grid point 24 (18/140) ======================= q-point: (-0.33 0.22 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 7.23e-05 7.23e-05 7.23e-05 7.23e-05 7.23e-05 7.23e-05 7.23e-05 7.23e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 244 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.569 ( -1.194 9.139 1.291) 9.306 2.044 ( 1.492 5.522 -1.627) 5.947 2.133 ( 0.551 -4.636 -1.278) 4.840 2.364 ( 1.867 -3.763 4.693) 6.298 2.598 ( -3.788 0.231 -4.239) 5.689 2.686 ( 3.962 2.241 9.058) 10.137 2.823 ( -1.386 -2.882 0.135) 3.200 2.879 ( 0.969 -0.825 3.717) 3.929 2.933 ( -2.049 -3.920 -4.752) 6.492 3.031 ( -1.736 -5.941 -4.537) 7.674 3.099 ( -2.676 0.005 -3.450) 4.366 3.233 ( -1.322 -2.705 -0.015) 3.010 3.375 ( -0.073 -3.116 -1.797) 3.597 3.428 ( -0.843 -5.127 2.739) 5.873 3.721 ( 5.339 -6.388 0.321) 8.331 3.842 ( 1.926 -0.667 -5.798) 6.146 3.873 ( -6.276 0.862 4.067) 7.528 4.322 ( 4.832 3.542 7.152) 9.329 4.409 ( 1.227 9.744 1.546) 9.942 4.559 ( 0.659 4.439 -2.302) 5.044 4.604 ( -4.997 0.195 -5.689) 7.575 4.807 ( -0.091 -2.009 1.037) 2.263 4.899 ( 2.940 -0.314 3.089) 4.276 5.080 ( 3.867 3.236 0.060) 5.043 5.328 ( -2.039 -7.522 -0.065) 7.793 5.504 ( -2.410 -5.682 1.920) 6.464 5.710 ( -2.144 -2.064 -1.285) 3.242 5.776 ( 2.452 1.185 -0.095) 2.724 5.836 ( -0.502 2.829 -5.045) 5.805 6.093 ( -1.235 2.661 -0.138) 2.937 6.181 ( -0.776 1.285 3.410) 3.726 6.430 ( 4.291 0.952 -2.111) 4.876 6.539 ( 2.843 -5.435 1.486) 6.312 6.746 ( -5.469 3.177 -1.057) 6.413 6.816 ( 0.765 1.003 -0.168) 1.273 6.935 ( -1.790 -3.299 1.971) 4.239 7.116 ( 0.616 -5.330 -4.090) 6.747 7.332 ( -0.633 -2.276 1.855) 3.004 7.614 ( 0.096 4.342 1.884) 4.734 7.796 ( 4.482 -1.889 2.583) 5.507 8.615 ( -3.672 -1.935 -2.916) 5.072 9.078 ( 0.910 -8.444 -0.966) 8.548 9.176 ( -1.872 -5.791 -1.178) 6.199 9.246 ( 1.299 -4.442 0.376) 4.643 9.388 ( 0.950 -0.739 -0.810) 1.450 9.562 ( -2.488 7.857 1.598) 8.395 9.656 ( 0.759 -11.113 -2.146) 11.343 10.077 ( -0.077 8.521 2.585) 8.905 10.191 ( 0.341 -2.726 -0.850) 2.875 10.796 ( 1.557 5.855 0.163) 6.060 11.068 ( -0.740 3.382 1.715) 3.863 11.149 ( -1.077 5.928 -0.103) 6.026 11.485 ( -0.853 -5.999 1.373) 6.213 11.508 ( 1.664 5.085 -2.359) 5.847 11.531 ( 4.192 1.842 -1.305) 4.761 11.645 ( -5.440 -2.926 -2.898) 6.823 12.000 ( -0.446 5.868 2.219) 6.289 12.112 ( 4.222 2.073 0.414) 4.722 12.224 ( -0.855 2.342 5.395) 5.943 12.376 ( 1.792 -1.289 0.603) 2.288 12.452 ( 2.287 -0.075 0.425) 2.328 12.712 ( -4.197 -2.770 -3.887) 6.356 12.779 ( 4.605 -5.848 3.182) 8.095 12.943 ( -7.266 -2.609 -3.535) 8.491 14.721 ( -1.497 2.636 -0.202) 3.038 14.863 ( 1.428 -4.080 1.197) 4.486 15.093 ( 0.476 -3.214 0.410) 3.275 15.179 ( 0.433 5.761 0.543) 5.802 15.346 ( -0.443 -5.209 -0.940) 5.312 15.619 ( 0.797 3.607 0.985) 3.823 15.663 ( 0.311 2.503 -0.204) 2.531 15.744 ( 5.858 -0.643 -0.358) 5.904 15.887 ( -0.836 2.376 0.133) 2.522 15.986 ( -7.645 -2.867 -1.530) 8.307 16.183 ( -0.203 -1.117 -0.415) 1.209 16.716 ( -0.089 -2.878 -0.014) 2.880 17.155 ( 5.885 9.842 1.491) 11.564 17.473 ( 0.376 5.335 0.438) 5.366 17.784 ( -3.589 -4.779 -2.218) 6.375 18.152 ( -0.099 -0.379 0.268) 0.475 25.736 ( -0.243 1.438 0.283) 1.485 25.847 ( 1.613 -0.700 -0.116) 1.763 25.874 ( -1.548 -0.300 -0.011) 1.577 25.939 ( 0.295 2.869 1.681) 3.338 25.969 ( -0.073 -1.240 -0.798) 1.476 26.474 ( -1.563 -2.153 2.751) 3.827 26.573 ( 0.959 -0.431 -6.569) 6.653 26.623 ( 1.161 -1.083 1.298) 2.051 27.184 ( 1.863 0.035 14.658) 14.776 27.302 ( 1.354 1.991 -8.645) 8.974 28.078 ( -0.119 -3.261 -0.883) 3.381 28.398 ( -5.133 -6.829 -5.896) 10.380 28.721 ( -2.263 -3.407 -1.428) 4.332 28.902 ( -1.182 -11.034 0.642) 11.116 29.326 ( 1.343 1.761 1.289) 2.563 29.793 ( 3.582 22.641 1.839) 22.996 ======================= Grid point 25 (19/140) ======================= q-point: (-0.22 0.22 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 7.23e-05 7.23e-05 7.23e-05 7.23e-05 7.23e-05 7.23e-05 7.23e-05 7.23e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 140 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.359 ( -0.000 14.745 -0.000) 14.745 1.834 ( -0.000 17.248 -0.000) 17.248 2.146 ( -0.000 5.553 -0.000) 5.553 2.457 ( 0.000 -2.842 0.000) 2.842 2.469 ( -0.000 10.149 -0.000) 10.149 2.616 ( -0.000 7.228 -0.000) 7.228 2.845 ( -0.000 3.732 -0.000) 3.732 2.896 ( 0.000 -4.739 0.000) 4.739 2.987 ( 0.000 -2.005 0.000) 2.005 3.036 ( -0.000 3.952 -0.000) 3.952 3.154 ( 0.000 -10.148 0.000) 10.148 3.278 ( -0.000 3.362 -0.000) 3.362 3.407 ( 0.000 -4.965 0.000) 4.965 3.480 ( 0.000 -0.152 0.000) 0.152 3.739 ( -0.000 7.829 -0.000) 7.829 3.878 ( 0.000 -5.849 0.000) 5.849 3.962 ( 0.000 -11.603 0.000) 11.603 4.183 ( -0.000 11.449 -0.000) 11.449 4.344 ( -0.000 4.498 -0.000) 4.498 4.485 ( -0.000 2.370 -0.000) 2.370 4.522 ( -0.000 3.783 -0.000) 3.783 4.862 ( 0.000 -3.942 0.000) 3.942 4.871 ( -0.000 6.236 -0.000) 6.236 5.074 ( 0.000 -0.762 0.000) 0.762 5.405 ( 0.000 -2.405 0.000) 2.405 5.584 ( 0.000 -4.054 0.000) 4.054 5.695 ( -0.000 0.748 -0.000) 0.748 5.753 ( -0.000 3.806 -0.000) 3.806 5.822 ( 0.000 -1.686 0.000) 1.686 6.069 ( -0.000 0.131 -0.000) 0.131 6.175 ( 0.000 -0.262 0.000) 0.262 6.436 ( 0.000 -0.899 0.000) 0.899 6.639 ( 0.000 -2.277 0.000) 2.277 6.659 ( -0.000 3.196 -0.000) 3.196 6.791 ( -0.000 2.111 -0.000) 2.111 7.030 ( 0.000 -8.037 0.000) 8.037 7.244 ( 0.000 -9.624 0.000) 9.624 7.371 ( 0.000 -2.401 0.000) 2.401 7.545 ( -0.000 3.620 -0.000) 3.620 7.860 ( 0.000 -2.085 0.000) 2.085 8.639 ( 0.000 -3.930 0.000) 3.930 9.173 ( 0.000 -0.409 0.000) 0.409 9.256 ( 0.000 -4.020 0.000) 4.020 9.284 ( 0.000 -0.801 0.000) 0.801 9.422 ( -0.000 6.198 -0.000) 6.198 9.449 ( 0.000 -5.846 0.000) 5.846 9.770 ( 0.000 -1.030 0.000) 1.030 9.902 ( -0.000 12.148 -0.000) 12.148 10.255 ( 0.000 -4.915 0.000) 4.915 10.691 ( -0.000 6.614 -0.000) 6.614 11.010 ( -0.000 8.909 -0.000) 8.909 11.010 ( -0.000 2.525 -0.000) 2.525 11.402 ( -0.000 4.534 -0.000) 4.534 11.519 ( -0.000 1.353 -0.000) 1.353 11.646 ( 0.000 -10.909 0.000) 10.909 11.691 ( 0.000 -3.166 0.000) 3.166 11.853 ( -0.000 9.211 -0.000) 9.211 12.069 ( -0.000 4.529 -0.000) 4.529 12.110 ( -0.000 9.861 -0.000) 9.861 12.435 ( 0.000 -2.980 0.000) 2.980 12.530 ( 0.000 -6.747 0.000) 6.747 12.712 ( 0.000 -1.072 0.000) 1.072 12.992 ( 0.000 -9.970 0.000) 9.970 12.994 ( 0.000 -11.746 0.000) 11.746 14.656 ( -0.000 3.839 -0.000) 3.839 14.885 ( -0.000 2.541 -0.000) 2.541 15.159 ( 0.000 -3.297 0.000) 3.297 15.160 ( 0.000 -3.142 0.000) 3.142 15.411 ( 0.000 -3.603 0.000) 3.603 15.539 ( -0.000 5.413 -0.000) 5.413 15.600 ( -0.000 5.594 -0.000) 5.594 15.806 ( 0.000 -2.396 0.000) 2.396 15.848 ( 0.000 -0.063 0.000) 0.063 16.064 ( 0.000 -9.464 0.000) 9.464 16.199 ( 0.000 -0.872 0.000) 0.872 16.746 ( 0.000 -0.797 0.000) 0.797 17.020 ( -0.000 9.003 -0.000) 9.003 17.383 ( -0.000 5.266 -0.000) 5.266 17.874 ( 0.000 -7.292 0.000) 7.292 18.158 ( 0.000 -0.365 0.000) 0.365 25.707 ( -0.000 1.803 -0.000) 1.803 25.829 ( -0.000 2.703 -0.000) 2.703 25.875 ( -0.000 3.371 -0.000) 3.371 25.892 ( 0.000 -1.152 0.000) 1.152 26.007 ( 0.000 -2.120 0.000) 2.120 26.510 ( 0.000 -1.464 0.000) 1.464 26.565 ( 0.000 -0.674 0.000) 0.674 26.649 ( 0.000 -0.979 0.000) 0.979 27.144 ( -0.000 6.121 -0.000) 6.121 27.372 ( 0.000 -8.006 0.000) 8.006 28.124 ( 0.000 -2.358 0.000) 2.358 28.460 ( 0.000 -5.224 0.000) 5.224 28.749 ( 0.000 -1.501 0.000) 1.501 29.077 ( 0.000 -10.003 0.000) 10.003 29.230 ( -0.000 11.489 -0.000) 11.489 29.515 ( -0.000 11.650 -0.000) 11.650 ======================= Grid point 30 (20/140) ======================= q-point: ( 0.33 0.33 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 7.23e-05 7.23e-05 7.23e-05 7.23e-05 7.23e-05 7.23e-05 7.23e-05 7.23e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 140 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.410 ( 6.797 0.000 12.438) 14.174 1.458 ( -1.102 -0.000 7.379) 7.461 1.716 ( 1.145 0.000 -0.949) 1.487 1.737 ( 18.295 0.000 4.528) 18.847 1.847 ( 0.387 0.000 -2.100) 2.136 2.226 ( -7.202 -0.000 5.948) 9.340 2.459 ( 5.822 0.000 0.950) 5.899 2.495 ( -3.366 -0.000 4.396) 5.536 2.718 ( 5.251 0.000 7.373) 9.052 3.025 ( -1.045 -0.000 -13.478) 13.519 3.068 ( 7.685 0.000 -4.330) 8.821 3.125 ( 6.359 0.000 17.301) 18.432 3.309 ( -10.205 -0.000 -6.159) 11.920 3.441 ( 2.691 0.000 -3.595) 4.490 3.831 ( -3.102 -0.000 3.641) 4.784 3.939 ( 5.357 0.000 6.014) 8.054 3.950 ( -7.503 -0.000 -0.707) 7.536 4.005 ( -0.115 -0.000 -12.303) 12.303 4.154 ( 0.333 0.000 -0.957) 1.014 4.387 ( -7.960 -0.000 0.232) 7.964 4.675 ( 0.401 0.000 0.788) 0.884 4.702 ( -2.574 -0.000 4.761) 5.412 4.917 ( 9.294 0.000 1.027) 9.350 5.065 ( -3.532 -0.000 2.717) 4.456 5.364 ( -2.183 -0.000 5.440) 5.862 5.501 ( 0.224 0.000 -5.873) 5.877 5.543 ( 0.555 0.000 -9.539) 9.556 5.920 ( 8.409 0.000 -5.892) 10.267 6.133 ( -1.565 -0.000 4.314) 4.589 6.197 ( -10.767 -0.000 -4.256) 11.577 6.307 ( 8.148 0.000 4.430) 9.274 6.445 ( 3.825 0.000 -0.362) 3.842 6.679 ( -5.131 -0.000 -2.245) 5.600 6.792 ( 2.210 0.000 5.535) 5.960 6.868 ( 4.482 0.000 -0.327) 4.494 7.071 ( 0.872 0.000 3.908) 4.005 7.202 ( -3.014 -0.000 -5.168) 5.983 7.384 ( -17.002 -0.000 -2.242) 17.149 7.508 ( -4.300 -0.000 -1.399) 4.522 7.811 ( 5.301 0.000 1.646) 5.551 8.610 ( -7.242 -0.000 -5.807) 9.283 8.631 ( -1.675 -0.000 2.222) 2.783 8.719 ( -5.767 -0.000 -4.625) 7.393 8.795 ( 0.533 0.000 0.495) 0.727 9.143 ( -2.132 -0.000 -3.473) 4.075 9.522 ( 4.172 0.000 -0.597) 4.214 9.902 ( -3.007 -0.000 -0.351) 3.028 10.115 ( 0.712 0.000 1.830) 1.964 10.199 ( -0.689 -0.000 9.739) 9.764 10.627 ( 1.442 0.000 16.087) 16.151 10.880 ( 4.166 0.000 2.230) 4.725 11.092 ( 4.052 0.000 -2.515) 4.769 11.325 ( 0.921 0.000 -14.049) 14.079 11.465 ( 7.811 0.000 10.553) 13.129 11.586 ( -5.686 -0.000 -0.078) 5.686 11.737 ( 1.483 0.000 -0.791) 1.681 12.020 ( -3.507 -0.000 3.907) 5.250 12.066 ( 6.586 0.000 9.186) 11.303 12.181 ( -4.290 -0.000 -8.033) 9.106 12.249 ( -3.651 -0.000 2.261) 4.294 12.467 ( -2.819 -0.000 4.757) 5.530 12.545 ( -5.712 -0.000 1.833) 5.999 13.053 ( -0.595 -0.000 -7.404) 7.428 13.478 ( -0.304 -0.000 4.589) 4.599 14.809 ( -0.291 -0.000 1.326) 1.357 14.903 ( -1.348 -0.000 -2.172) 2.556 15.045 ( -7.693 -0.000 -2.854) 8.206 15.120 ( 3.848 0.000 1.571) 4.156 15.543 ( 3.660 0.000 -1.345) 3.899 15.649 ( -4.436 -0.000 1.091) 4.569 15.735 ( 0.155 0.000 3.518) 3.521 15.854 ( 4.911 0.000 -4.866) 6.913 16.037 ( -10.198 -0.000 2.454) 10.489 16.064 ( 9.908 0.000 -9.108) 13.458 16.244 ( -1.362 -0.000 5.107) 5.285 16.360 ( -1.886 -0.000 -3.185) 3.702 17.438 ( 10.448 0.000 1.185) 10.515 17.818 ( -1.557 -0.000 -0.318) 1.589 17.921 ( 2.868 0.000 -11.263) 11.623 18.103 ( 1.103 0.000 -2.672) 2.890 25.701 ( 1.522 0.000 -0.802) 1.721 25.762 ( 1.974 0.000 0.467) 2.028 25.771 ( -0.803 -0.000 1.929) 2.090 25.870 ( -1.469 -0.000 1.012) 1.784 26.085 ( 0.334 0.000 6.111) 6.120 26.357 ( -3.258 -0.000 0.021) 3.258 26.509 ( 4.734 0.000 1.628) 5.006 26.615 ( 0.280 0.000 -1.731) 1.753 27.035 ( -3.272 -0.000 8.944) 9.523 27.504 ( 6.602 0.000 11.249) 13.043 27.757 ( -0.579 -0.000 -9.163) 9.181 28.289 ( -2.014 -0.000 -2.032) 2.861 28.438 ( -4.173 -0.000 -2.432) 4.830 28.492 ( -6.987 -0.000 -4.711) 8.427 29.300 ( 4.702 0.000 -6.671) 8.162 31.049 ( 3.063 0.000 -2.445) 3.919 ======================= Grid point 31 (21/140) ======================= q-point: ( 0.44 0.33 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 7.23e-05 7.23e-05 7.23e-05 7.23e-05 7.23e-05 7.23e-05 7.23e-05 7.23e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 244 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.431 ( -2.240 -3.102 9.470) 10.214 1.609 ( 3.320 -9.334 -4.486) 10.875 1.911 ( -5.569 -20.734 1.236) 21.505 1.957 ( 17.758 -5.030 6.847) 19.686 2.006 ( 7.441 -11.544 5.168) 14.675 2.251 ( -3.483 -4.941 3.761) 7.119 2.512 ( 2.534 -2.860 1.203) 4.006 2.556 ( -0.853 -5.927 4.215) 7.322 2.728 ( -6.553 -1.463 -0.491) 6.733 2.967 ( -1.748 -4.083 -14.509) 15.174 3.111 ( 5.761 1.775 1.721) 6.269 3.197 ( -7.468 0.481 -2.336) 7.840 3.255 ( -0.218 0.083 7.593) 7.597 3.547 ( 5.838 -4.364 2.768) 7.796 3.726 ( 1.022 5.603 -3.402) 6.634 3.818 ( -1.458 11.287 -2.749) 11.708 3.923 ( -3.379 0.170 3.598) 4.939 4.092 ( 1.955 -10.056 -0.618) 10.263 4.172 ( 5.295 -2.823 -1.984) 6.320 4.468 ( -3.867 -10.775 -0.878) 11.482 4.663 ( -0.954 1.006 0.903) 1.654 4.732 ( -2.659 -2.930 4.699) 6.143 4.960 ( 4.077 2.725 -2.794) 5.644 5.087 ( 1.134 -1.682 10.180) 10.380 5.291 ( -3.274 5.717 0.743) 6.630 5.471 ( 1.335 3.181 -3.647) 5.020 5.516 ( -2.273 -2.945 -8.925) 9.669 5.924 ( 2.651 1.862 -6.721) 7.461 6.057 ( -6.325 3.072 -4.235) 8.208 6.185 ( 0.442 -2.011 5.560) 5.929 6.350 ( 7.790 4.735 2.967) 9.587 6.433 ( 4.012 4.602 -0.247) 6.110 6.632 ( -3.770 1.639 -0.516) 4.143 6.812 ( -0.387 -0.244 4.972) 4.993 6.889 ( 5.246 2.178 -1.298) 5.826 7.067 ( -3.545 5.306 0.047) 6.382 7.160 ( -6.004 1.931 -6.657) 9.170 7.183 ( -5.149 -1.163 1.537) 5.497 7.577 ( -5.086 -7.751 0.306) 9.275 7.799 ( 4.836 5.250 1.155) 7.231 8.581 ( -5.334 -3.240 -1.587) 6.439 8.650 ( -2.540 -5.878 -4.654) 7.916 8.742 ( -4.203 -8.724 -1.868) 9.863 8.853 ( 0.421 -4.596 3.113) 5.567 9.153 ( 0.567 -3.692 -3.579) 5.173 9.472 ( 1.795 5.528 0.295) 5.820 9.948 ( -0.222 -5.075 0.605) 5.116 10.040 ( 0.726 7.792 2.857) 8.331 10.273 ( -0.030 -1.854 4.974) 5.309 10.829 ( 0.422 -9.730 15.064) 17.938 10.925 ( 3.085 -1.328 1.085) 3.530 11.136 ( 3.049 -3.617 -2.128) 5.187 11.250 ( -1.111 -1.483 -16.081) 16.188 11.564 ( -1.604 -1.449 3.110) 3.788 11.621 ( 5.628 -4.065 5.517) 8.868 11.707 ( 1.102 3.549 -0.648) 3.772 11.974 ( -4.986 3.662 -0.180) 6.189 12.059 ( 0.257 2.071 -0.518) 2.150 12.216 ( -0.703 -1.480 1.484) 2.210 12.259 ( 4.385 -3.704 4.117) 7.064 12.473 ( -5.591 -1.369 5.065) 7.667 12.538 ( -2.239 -1.123 2.083) 3.258 12.951 ( -3.869 5.104 -9.060) 11.095 13.439 ( -0.291 7.199 3.701) 8.100 14.760 ( 1.248 4.215 1.779) 4.742 14.861 ( -3.217 3.260 -1.606) 4.854 15.018 ( -2.757 -4.612 -2.609) 5.973 15.215 ( 2.940 -4.908 0.976) 5.804 15.421 ( -0.334 11.043 -0.514) 11.060 15.653 ( -1.932 -1.831 0.147) 2.665 15.719 ( 0.455 4.012 3.259) 5.189 15.861 ( 6.107 1.822 -3.732) 7.385 15.997 ( -6.916 -1.238 1.746) 7.240 16.084 ( 3.569 0.474 -5.878) 6.894 16.217 ( -1.174 2.747 1.132) 3.195 16.418 ( -0.508 -7.219 -0.231) 7.241 17.497 ( 10.930 3.601 1.233) 11.574 17.725 ( 2.348 6.409 -1.070) 6.909 17.886 ( -5.039 1.396 -7.793) 9.385 18.105 ( 0.101 -0.769 0.358) 0.854 25.713 ( 1.231 -0.865 -0.578) 1.612 25.771 ( -0.125 -0.606 0.284) 0.681 25.810 ( 1.228 -2.515 1.279) 3.077 25.868 ( -1.428 -0.474 0.764) 1.687 26.101 ( 0.424 1.652 4.520) 4.831 26.350 ( -2.569 -2.006 -1.020) 3.415 26.554 ( 2.816 -0.324 1.757) 3.335 26.611 ( 0.939 -0.114 -2.140) 2.340 27.051 ( -1.685 0.083 7.245) 7.439 27.573 ( 6.576 3.403 8.477) 11.256 27.811 ( -1.267 -8.997 -4.649) 10.206 28.211 ( -6.465 2.348 -7.080) 9.871 28.414 ( -4.710 -5.968 -3.770) 8.486 28.505 ( -1.731 -4.682 -0.506) 5.017 29.307 ( 4.186 0.231 -3.469) 5.442 30.926 ( 3.201 15.219 -0.228) 15.554 ======================= Grid point 32 (22/140) ======================= q-point: ( 0.56 0.33 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 7.23e-05 7.23e-05 7.23e-05 7.23e-05 7.23e-05 7.23e-05 7.23e-05 7.23e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 244 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.567 ( 0.925 -9.311 1.222) 9.436 1.810 ( -0.029 -11.915 1.794) 12.050 2.072 ( 7.527 1.000 0.214) 7.596 2.190 ( 2.344 -9.640 3.602) 10.555 2.342 ( -4.396 -12.801 -1.443) 13.611 2.413 ( 3.656 -17.375 8.819) 19.825 2.616 ( -1.030 -7.047 -1.843) 7.357 2.674 ( 0.239 -5.873 4.296) 7.281 2.743 ( -3.607 -8.143 -3.495) 9.568 2.997 ( -0.924 -6.237 -6.840) 9.303 3.079 ( 0.043 4.201 -1.235) 4.379 3.142 ( -3.315 -0.789 -2.502) 4.227 3.294 ( -0.766 -1.542 7.498) 7.694 3.516 ( -3.001 8.152 2.554) 9.055 3.574 ( 0.524 3.931 -8.810) 9.662 3.788 ( 3.547 -0.997 0.723) 3.754 3.924 ( -1.027 -0.205 1.251) 1.631 4.248 ( 2.686 -7.357 0.398) 7.842 4.352 ( 1.007 -10.761 0.945) 10.850 4.604 ( 3.760 -5.249 -0.106) 6.458 4.646 ( 0.229 1.051 0.400) 1.147 4.796 ( -1.678 -3.919 2.797) 5.099 4.904 ( 1.681 3.701 0.609) 4.110 5.113 ( -3.373 2.754 -0.737) 4.416 5.282 ( 5.048 -2.458 8.521) 10.204 5.353 ( -2.690 6.486 -0.823) 7.069 5.523 ( -4.167 -5.905 -9.433) 11.883 5.860 ( 1.277 3.441 -1.649) 4.024 5.944 ( -3.946 2.837 -5.775) 7.547 6.244 ( 0.502 2.294 7.780) 8.127 6.293 ( 2.429 5.825 -3.036) 7.004 6.399 ( 6.824 1.916 -0.618) 7.115 6.557 ( -3.080 3.464 0.537) 4.667 6.809 ( -4.035 1.137 0.927) 4.294 6.874 ( 3.275 2.944 -0.021) 4.404 6.955 ( -1.204 3.597 1.993) 4.285 7.080 ( -1.967 0.202 -5.794) 6.122 7.217 ( -2.083 -3.204 1.340) 4.049 7.655 ( -1.061 -3.639 1.200) 3.976 7.771 ( 2.592 1.711 1.101) 3.295 8.579 ( -2.659 -1.043 -1.007) 3.029 8.756 ( -1.181 -9.865 -2.912) 10.354 8.887 ( -2.717 -11.327 -1.105) 11.701 8.981 ( 0.341 -8.703 1.798) 8.893 9.236 ( -0.167 -8.023 -2.749) 8.483 9.423 ( 0.828 1.768 0.693) 2.071 9.894 ( 0.759 10.317 1.366) 10.435 10.047 ( 0.615 -4.671 0.867) 4.790 10.283 ( -0.387 2.444 1.759) 3.036 10.932 ( 1.065 1.830 4.570) 5.037 11.033 ( 2.119 -3.471 6.410) 7.591 11.182 ( 0.000 -2.457 -6.559) 7.004 11.316 ( 1.621 -12.261 -5.762) 13.644 11.545 ( -0.557 5.020 1.343) 5.226 11.632 ( -2.423 0.580 -1.426) 2.871 11.785 ( 1.608 -2.601 0.489) 3.097 11.858 ( -1.396 1.591 1.426) 2.552 12.083 ( 3.962 -2.378 0.531) 4.651 12.212 ( -3.045 0.302 1.984) 3.647 12.382 ( 6.295 -1.414 -0.791) 6.500 12.488 ( -3.779 -3.411 6.980) 8.639 12.575 ( 0.412 -2.630 2.563) 3.695 12.758 ( -6.087 6.776 -8.794) 12.661 13.265 ( -1.573 13.957 1.974) 14.183 14.741 ( 1.183 0.583 2.697) 3.003 14.784 ( -1.579 1.500 -2.342) 3.198 15.089 ( -0.887 -5.387 -0.651) 5.499 15.214 ( 1.703 7.747 -0.528) 7.949 15.328 ( -0.848 -1.514 0.541) 1.817 15.654 ( 1.309 3.333 1.829) 4.021 15.678 ( -0.897 -0.909 -0.067) 1.279 15.851 ( 5.757 3.505 -1.788) 6.973 15.958 ( -5.700 0.942 0.921) 5.851 16.043 ( -0.700 3.069 -2.370) 3.940 16.176 ( -0.271 1.298 -0.454) 1.401 16.542 ( -0.035 -7.207 0.078) 7.208 17.500 ( 11.504 8.285 2.966) 14.484 17.646 ( 2.272 5.382 -0.374) 5.854 17.745 ( -9.477 2.460 -5.560) 11.260 18.125 ( -0.124 -1.178 0.469) 1.274 25.740 ( 0.793 -1.200 0.077) 1.441 25.788 ( 0.010 -1.541 -0.318) 1.574 25.868 ( -1.245 -0.649 1.236) 1.870 25.870 ( 0.860 -2.590 -0.127) 2.732 26.080 ( 0.235 3.148 2.116) 3.801 26.373 ( -1.417 -2.991 -0.474) 3.343 26.562 ( -0.413 0.025 -1.495) 1.551 26.622 ( 2.408 0.195 0.131) 2.419 27.089 ( -0.157 -2.028 5.155) 5.542 27.556 ( 3.674 8.010 3.378) 9.438 27.917 ( -1.654 -6.311 -1.670) 6.734 28.150 ( -5.044 -6.223 -6.560) 10.354 28.509 ( -1.470 -8.925 -1.205) 9.125 28.584 ( -1.286 -6.055 0.092) 6.191 29.324 ( 2.381 -0.388 -0.759) 2.529 30.623 ( 2.652 23.095 0.827) 23.261 ======================= Grid point 33 (23/140) ======================= q-point: ( 0.67 0.33 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 7.23e-05 7.23e-05 7.23e-05 7.23e-05 7.23e-05 7.23e-05 7.23e-05 7.23e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 140 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.670 ( -0.000 0.667 -0.000) 0.667 1.993 ( 0.000 -9.945 0.000) 9.945 2.093 ( -0.000 0.020 -0.000) 0.020 2.301 ( 0.000 -4.782 0.000) 4.782 2.502 ( 0.000 -8.604 0.000) 8.604 2.698 ( 0.000 -4.673 0.000) 4.673 2.740 ( 0.000 -13.026 0.000) 13.026 2.782 ( 0.000 -4.680 0.000) 4.680 2.877 ( 0.000 -9.745 0.000) 9.745 2.966 ( -0.000 7.522 -0.000) 7.522 3.062 ( 0.000 -3.328 0.000) 3.328 3.179 ( 0.000 -4.274 0.000) 4.274 3.353 ( -0.000 4.922 -0.000) 4.922 3.358 ( 0.000 -3.636 0.000) 3.636 3.616 ( 0.000 -6.868 0.000) 6.868 3.803 ( 0.000 -0.130 0.000) 0.130 3.916 ( -0.000 1.377 -0.000) 1.377 4.390 ( 0.000 -4.371 0.000) 4.371 4.436 ( 0.000 -2.431 0.000) 2.431 4.609 ( -0.000 4.883 -0.000) 4.883 4.653 ( -0.000 2.228 -0.000) 2.228 4.808 ( -0.000 1.864 -0.000) 1.864 4.896 ( 0.000 -0.525 0.000) 0.525 5.152 ( 0.000 -10.252 0.000) 10.252 5.194 ( -0.000 7.470 -0.000) 7.470 5.414 ( 0.000 -4.479 0.000) 4.479 5.598 ( 0.000 -8.169 0.000) 8.169 5.829 ( -0.000 2.003 -0.000) 2.003 5.852 ( -0.000 3.253 -0.000) 3.253 6.162 ( -0.000 5.978 -0.000) 5.978 6.228 ( -0.000 3.425 -0.000) 3.425 6.461 ( 0.000 -4.333 0.000) 4.333 6.486 ( -0.000 3.298 -0.000) 3.298 6.763 ( -0.000 1.912 -0.000) 1.912 6.844 ( -0.000 1.896 -0.000) 1.896 6.917 ( -0.000 1.068 -0.000) 1.068 7.060 ( 0.000 -0.604 0.000) 0.604 7.277 ( 0.000 -4.130 0.000) 4.130 7.675 ( -0.000 1.576 -0.000) 1.576 7.786 ( 0.000 -1.487 0.000) 1.487 8.576 ( 0.000 -0.609 0.000) 0.609 8.917 ( 0.000 -10.341 0.000) 10.341 9.041 ( 0.000 -8.543 0.000) 8.543 9.141 ( 0.000 -8.652 0.000) 8.652 9.358 ( 0.000 -4.043 0.000) 4.043 9.460 ( 0.000 -8.540 0.000) 8.540 9.720 ( -0.000 10.569 -0.000) 10.569 10.129 ( 0.000 -4.225 0.000) 4.225 10.211 ( -0.000 6.152 -0.000) 6.152 10.891 ( -0.000 4.445 -0.000) 4.445 11.097 ( 0.000 -1.303 0.000) 1.303 11.198 ( -0.000 0.086 -0.000) 0.086 11.455 ( -0.000 3.248 -0.000) 3.248 11.483 ( 0.000 -7.268 0.000) 7.268 11.597 ( -0.000 2.056 -0.000) 2.056 11.668 ( -0.000 8.989 -0.000) 8.989 11.990 ( 0.000 -7.428 0.000) 7.428 12.175 ( -0.000 2.100 -0.000) 2.100 12.181 ( 0.000 -4.877 0.000) 4.877 12.389 ( -0.000 1.219 -0.000) 1.219 12.539 ( -0.000 6.988 -0.000) 6.988 12.606 ( 0.000 -6.321 0.000) 6.321 12.691 ( 0.000 -5.929 0.000) 5.929 13.012 ( -0.000 13.527 -0.000) 13.527 14.743 ( -0.000 0.850 -0.000) 0.850 14.797 ( 0.000 -3.784 0.000) 3.784 15.084 ( -0.000 2.440 -0.000) 2.440 15.232 ( 0.000 -6.934 0.000) 6.934 15.292 ( -0.000 5.642 -0.000) 5.642 15.644 ( 0.000 -0.521 0.000) 0.521 15.685 ( -0.000 0.279 -0.000) 0.279 15.805 ( -0.000 4.260 -0.000) 4.260 15.914 ( -0.000 0.775 -0.000) 0.775 15.966 ( -0.000 4.237 -0.000) 4.237 16.166 ( 0.000 -0.349 0.000) 0.349 16.648 ( 0.000 -5.240 0.000) 5.240 17.374 ( -0.000 12.184 -0.000) 12.184 17.569 ( -0.000 5.294 -0.000) 5.294 17.692 ( 0.000 -2.679 0.000) 2.679 18.143 ( 0.000 -0.804 0.000) 0.804 25.752 ( -0.000 0.300 -0.000) 0.300 25.823 ( 0.000 -2.450 0.000) 2.450 25.866 ( -0.000 0.112 -0.000) 0.112 25.921 ( 0.000 -2.728 0.000) 2.728 26.021 ( -0.000 4.346 -0.000) 4.346 26.422 ( 0.000 -3.443 0.000) 3.443 26.557 ( 0.000 -0.273 0.000) 0.273 26.627 ( -0.000 0.325 -0.000) 0.325 27.162 ( 0.000 -4.621 0.000) 4.621 27.413 ( -0.000 10.004 -0.000) 10.004 28.002 ( 0.000 -5.175 0.000) 5.175 28.243 ( 0.000 -7.748 0.000) 7.748 28.634 ( 0.000 -5.894 0.000) 5.894 28.712 ( 0.000 -10.444 0.000) 10.444 29.342 ( 0.000 -0.471 0.000) 0.471 30.223 ( -0.000 25.532 -0.000) 25.532 ======================= Grid point 41 (24/140) ======================= q-point: ( 0.44 0.44 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 7.23e-05 7.23e-05 7.23e-05 7.23e-05 7.23e-05 7.23e-05 7.23e-05 7.23e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 140 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.499 ( -1.757 -0.000 5.255) 5.542 1.518 ( 0.133 0.000 3.058) 3.061 1.608 ( -1.937 -0.000 -3.562) 4.054 1.886 ( 0.779 0.000 2.565) 2.681 2.152 ( 18.201 0.000 3.457) 18.526 2.207 ( -0.498 -0.000 2.068) 2.127 2.503 ( -1.450 -0.000 3.522) 3.809 2.539 ( 2.741 0.000 1.128) 2.964 2.638 ( -10.782 -0.000 -1.245) 10.853 2.854 ( -0.882 -0.000 -9.878) 9.917 3.132 ( -5.213 -0.000 -2.673) 5.858 3.192 ( 5.132 0.000 1.099) 5.248 3.285 ( -0.914 -0.000 4.085) 4.186 3.625 ( 9.534 0.000 9.750) 13.637 3.768 ( -3.107 -0.000 -2.409) 3.932 3.881 ( 0.497 0.000 -10.739) 10.751 3.908 ( -1.429 -0.000 2.884) 3.219 3.976 ( -3.469 -0.000 -0.008) 3.469 4.250 ( 7.690 0.000 2.438) 8.067 4.266 ( -4.468 -0.000 -1.552) 4.730 4.661 ( -1.601 -0.000 0.973) 1.873 4.710 ( -1.709 -0.000 1.679) 2.396 4.994 ( 1.297 0.000 -1.995) 2.380 5.140 ( 2.600 0.000 10.566) 10.882 5.324 ( -3.103 -0.000 -0.479) 3.140 5.408 ( -1.588 -0.000 -8.904) 9.044 5.516 ( 1.438 0.000 -2.194) 2.623 5.933 ( 1.425 0.000 -3.384) 3.672 6.026 ( -4.807 -0.000 -2.663) 5.495 6.190 ( 0.937 0.000 4.302) 4.403 6.451 ( 3.673 0.000 -0.708) 3.740 6.542 ( 7.663 0.000 3.631) 8.480 6.591 ( -3.188 -0.000 -0.554) 3.235 6.849 ( 0.760 0.000 1.628) 1.796 6.933 ( 2.603 0.000 -0.072) 2.604 7.094 ( -5.692 -0.000 -3.795) 6.841 7.124 ( -9.040 -0.000 -1.456) 9.157 7.127 ( 1.255 0.000 1.915) 2.289 7.452 ( -1.549 -0.000 -0.524) 1.635 7.881 ( 2.176 0.000 0.388) 2.210 8.480 ( -3.344 -0.000 -2.218) 4.013 8.592 ( -1.453 -0.000 -1.037) 1.785 8.627 ( -1.934 -0.000 -1.702) 2.577 8.838 ( -0.076 -0.000 3.357) 3.357 9.124 ( 1.696 0.000 -1.877) 2.529 9.569 ( 1.803 0.000 -0.107) 1.806 9.844 ( -2.264 -0.000 -0.781) 2.395 10.138 ( 0.471 0.000 0.705) 0.847 10.267 ( -0.060 -0.000 4.221) 4.222 10.799 ( 1.412 0.000 11.660) 11.745 10.938 ( 1.600 0.000 0.394) 1.648 11.116 ( 1.593 0.000 -1.620) 2.272 11.170 ( -1.605 -0.000 -11.269) 11.383 11.524 ( -1.984 -0.000 0.020) 1.984 11.685 ( 6.990 0.000 5.780) 9.071 11.766 ( 1.926 0.000 0.243) 1.941 11.971 ( -3.500 -0.000 -0.368) 3.519 12.058 ( -2.240 -0.000 -3.218) 3.921 12.182 ( -1.584 -0.000 1.990) 2.544 12.247 ( -0.494 -0.000 1.439) 1.521 12.440 ( -1.511 -0.000 3.344) 3.669 12.579 ( 2.711 0.000 4.991) 5.680 12.922 ( -3.939 -0.000 -8.107) 9.014 13.518 ( 0.579 0.000 1.895) 1.981 14.828 ( 0.816 0.000 1.301) 1.536 14.874 ( -0.443 -0.000 -0.883) 0.988 14.928 ( -3.762 -0.000 -1.907) 4.217 15.191 ( 3.070 0.000 0.559) 3.121 15.553 ( 0.635 0.000 -1.421) 1.557 15.576 ( -4.474 -0.000 0.557) 4.509 15.778 ( 0.505 0.000 2.251) 2.307 15.893 ( 4.989 0.000 -4.103) 6.460 15.942 ( -5.506 -0.000 3.090) 6.314 16.103 ( 3.546 0.000 -3.907) 5.277 16.270 ( -0.240 -0.000 2.193) 2.206 16.321 ( -0.537 -0.000 -1.087) 1.212 17.607 ( 10.228 0.000 0.132) 10.229 17.748 ( -7.157 -0.000 0.134) 7.158 17.869 ( 0.707 0.000 -4.144) 4.204 18.098 ( -0.023 -0.000 -0.119) 0.121 25.706 ( 0.338 0.000 -0.566) 0.659 25.780 ( -0.048 -0.000 0.829) 0.830 25.791 ( 1.118 0.000 0.063) 1.119 25.858 ( -0.865 -0.000 0.526) 1.012 26.137 ( 0.242 0.000 2.730) 2.741 26.315 ( -1.200 -0.000 -0.554) 1.322 26.582 ( 1.947 0.000 1.269) 2.324 26.605 ( 0.168 0.000 -0.833) 0.850 27.067 ( -0.990 -0.000 3.656) 3.788 27.675 ( -0.407 -0.000 -4.524) 4.543 27.725 ( 6.315 0.000 10.060) 11.878 28.207 ( -8.693 -0.000 -9.278) 12.715 28.255 ( -0.725 -0.000 -0.581) 0.929 28.462 ( -0.069 -0.000 0.022) 0.072 29.321 ( 2.350 0.000 -1.884) 3.011 31.065 ( 0.892 0.000 -0.485) 1.015 ======================= Grid point 42 (25/140) ======================= q-point: ( 0.56 0.44 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 7.23e-05 7.23e-05 7.23e-05 7.23e-05 7.23e-05 7.23e-05 7.23e-05 7.23e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 140 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.451 ( 0.000 -2.098 0.000) 2.098 1.616 ( 0.000 -11.058 0.000) 11.058 1.874 ( 0.000 -20.269 0.000) 20.269 2.043 ( 0.000 -15.790 0.000) 15.790 2.242 ( 0.000 -4.064 0.000) 4.064 2.244 ( -0.000 0.267 -0.000) 0.267 2.523 ( 0.000 -2.736 0.000) 2.736 2.592 ( 0.000 -4.484 0.000) 4.484 2.612 ( 0.000 -4.095 0.000) 4.095 2.869 ( 0.000 -4.965 0.000) 4.965 3.102 ( -0.000 0.425 -0.000) 0.425 3.179 ( -0.000 3.946 -0.000) 3.946 3.292 ( 0.000 -0.354 0.000) 0.354 3.614 ( -0.000 7.280 -0.000) 7.280 3.672 ( -0.000 4.581 -0.000) 4.581 3.859 ( -0.000 7.584 -0.000) 7.584 3.914 ( 0.000 -0.484 0.000) 0.484 4.050 ( 0.000 -14.530 0.000) 14.530 4.237 ( 0.000 -4.342 0.000) 4.342 4.467 ( 0.000 -12.239 0.000) 12.239 4.656 ( -0.000 0.342 -0.000) 0.342 4.721 ( 0.000 -2.455 0.000) 2.455 4.967 ( -0.000 2.806 -0.000) 2.806 5.171 ( -0.000 2.902 -0.000) 2.902 5.303 ( 0.000 -0.540 0.000) 0.540 5.391 ( 0.000 -2.418 0.000) 2.418 5.468 ( -0.000 5.694 -0.000) 5.694 5.912 ( -0.000 2.001 -0.000) 2.001 5.963 ( -0.000 3.459 -0.000) 3.459 6.248 ( 0.000 -3.708 0.000) 3.708 6.402 ( -0.000 6.186 -0.000) 6.186 6.521 ( -0.000 6.867 -0.000) 6.867 6.573 ( -0.000 0.945 -0.000) 0.945 6.836 ( -0.000 2.233 -0.000) 2.233 6.931 ( -0.000 1.462 -0.000) 1.462 7.027 ( -0.000 4.918 -0.000) 4.918 7.044 ( -0.000 0.189 -0.000) 0.189 7.168 ( 0.000 -2.565 0.000) 2.565 7.538 ( 0.000 -8.297 0.000) 8.297 7.844 ( -0.000 4.489 -0.000) 4.489 8.526 ( 0.000 -5.130 0.000) 5.130 8.606 ( 0.000 -4.150 0.000) 4.150 8.696 ( 0.000 -8.812 0.000) 8.812 8.878 ( 0.000 -4.028 0.000) 4.028 9.145 ( 0.000 -2.606 0.000) 2.606 9.487 ( -0.000 5.754 -0.000) 5.754 9.945 ( 0.000 -8.081 0.000) 8.081 10.061 ( -0.000 8.117 -0.000) 8.117 10.299 ( 0.000 -0.996 0.000) 0.996 10.950 ( 0.000 -0.556 0.000) 0.556 10.973 ( 0.000 -14.324 0.000) 14.324 11.100 ( -0.000 3.119 -0.000) 3.119 11.148 ( 0.000 -4.023 0.000) 4.023 11.547 ( 0.000 -2.715 0.000) 2.715 11.705 ( -0.000 6.728 -0.000) 6.728 11.745 ( 0.000 -2.073 0.000) 2.073 11.923 ( -0.000 3.744 -0.000) 3.744 12.057 ( 0.000 -1.836 0.000) 1.836 12.199 ( 0.000 -0.912 0.000) 0.912 12.316 ( 0.000 -8.217 0.000) 8.217 12.434 ( -0.000 1.158 -0.000) 1.158 12.607 ( 0.000 -0.005 0.000) 0.005 12.824 ( -0.000 6.376 -0.000) 6.376 13.458 ( -0.000 8.020 -0.000) 8.020 14.799 ( -0.000 3.291 -0.000) 3.291 14.807 ( -0.000 3.894 -0.000) 3.894 14.983 ( 0.000 -5.731 0.000) 5.731 15.256 ( 0.000 -4.953 0.000) 4.953 15.400 ( -0.000 11.163 -0.000) 11.163 15.633 ( 0.000 -3.187 0.000) 3.187 15.742 ( -0.000 4.513 -0.000) 4.513 15.917 ( -0.000 1.296 -0.000) 1.296 15.922 ( 0.000 -1.277 0.000) 1.277 16.088 ( -0.000 2.214 -0.000) 2.214 16.213 ( -0.000 3.413 -0.000) 3.413 16.415 ( 0.000 -7.580 0.000) 7.580 17.662 ( -0.000 1.857 -0.000) 1.857 17.683 ( -0.000 0.956 -0.000) 0.956 17.789 ( -0.000 8.012 -0.000) 8.012 18.107 ( 0.000 -0.986 0.000) 0.986 25.719 ( 0.000 -1.413 0.000) 1.413 25.773 ( 0.000 -0.024 0.000) 0.024 25.828 ( 0.000 -2.651 0.000) 2.651 25.859 ( 0.000 -0.315 0.000) 0.315 26.129 ( -0.000 1.806 -0.000) 1.806 26.325 ( 0.000 -1.820 0.000) 1.820 26.570 ( -0.000 1.335 -0.000) 1.335 26.624 ( 0.000 -1.104 0.000) 1.104 27.076 ( 0.000 -0.671 0.000) 0.671 27.670 ( -0.000 0.918 -0.000) 0.918 27.820 ( 0.000 -4.114 0.000) 4.114 28.065 ( -0.000 2.867 -0.000) 2.867 28.357 ( 0.000 -8.177 0.000) 8.177 28.495 ( 0.000 -3.808 0.000) 3.808 29.326 ( 0.000 -0.143 0.000) 0.143 30.949 ( -0.000 13.723 -0.000) 13.723 ======================= Grid point 85 (26/140) ======================= q-point: ( 0.00 0.00 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 7.23e-05 7.23e-05 7.23e-05 7.23e-05 7.23e-05 7.23e-05 7.23e-05 7.23e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 135 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.533 ( 8.274 0.000 27.170) 28.402 0.617 ( -20.747 -0.000 31.341) 37.586 0.998 ( 18.166 0.000 49.884) 53.089 1.448 ( 1.124 0.000 5.904) 6.010 2.055 ( -1.154 -0.000 -1.495) 1.889 2.308 ( -1.227 -0.000 6.896) 7.004 2.427 ( -5.400 -0.000 -9.482) 10.911 2.500 ( 14.039 0.000 -10.461) 17.508 2.630 ( -9.292 -0.000 2.630) 9.657 2.709 ( -2.520 -0.000 3.969) 4.701 2.986 ( 0.143 0.000 4.816) 4.818 3.311 ( -1.235 -0.000 -11.263) 11.330 3.516 ( 0.822 0.000 -7.342) 7.388 3.614 ( -0.334 -0.000 -5.834) 5.843 3.671 ( -0.328 -0.000 8.316) 8.322 3.891 ( -2.356 -0.000 9.197) 9.494 4.121 ( 0.106 0.000 -7.597) 7.598 4.302 ( 1.351 0.000 3.713) 3.951 4.370 ( 5.113 0.000 2.072) 5.517 4.520 ( 5.689 0.000 -7.300) 9.255 4.629 ( -0.026 -0.000 0.430) 0.431 4.670 ( -9.819 -0.000 -5.426) 11.219 4.701 ( -5.835 -0.000 4.493) 7.364 5.254 ( 6.084 0.000 2.344) 6.520 5.288 ( -4.083 -0.000 2.057) 4.572 5.300 ( -4.232 -0.000 1.322) 4.433 5.537 ( 5.474 0.000 -12.553) 13.695 5.775 ( -0.227 -0.000 -6.470) 6.474 6.088 ( 2.415 0.000 0.185) 2.422 6.237 ( -4.253 -0.000 6.243) 7.554 6.323 ( 8.160 0.000 -2.278) 8.471 6.415 ( 2.729 0.000 1.959) 3.359 6.540 ( -5.339 -0.000 6.801) 8.646 6.806 ( -3.436 -0.000 2.228) 4.095 6.868 ( -2.304 -0.000 -4.300) 4.878 7.108 ( 23.713 0.000 0.578) 23.720 7.311 ( -2.115 -0.000 -3.078) 3.735 7.576 ( -8.965 -0.000 -8.455) 12.323 7.866 ( 5.763 0.000 5.727) 8.125 7.888 ( -0.961 -0.000 2.580) 2.753 8.453 ( -6.075 -0.000 2.798) 6.688 8.861 ( -0.870 -0.000 -4.147) 4.237 8.909 ( 5.444 0.000 -5.979) 8.086 9.073 ( -3.607 -0.000 -4.617) 5.859 9.399 ( 4.326 0.000 3.278) 5.428 9.438 ( -1.091 -0.000 -2.256) 2.506 9.969 ( -2.838 -0.000 2.214) 3.599 10.110 ( 4.154 0.000 -0.480) 4.182 10.364 ( -17.660 -0.000 2.220) 17.799 10.371 ( 3.802 0.000 2.715) 4.672 10.614 ( 3.472 0.000 5.250) 6.295 10.982 ( -0.793 -0.000 -2.327) 2.458 11.115 ( 0.286 0.000 5.650) 5.657 11.305 ( -1.448 -0.000 6.490) 6.649 11.666 ( 20.936 0.000 -11.142) 23.716 11.801 ( -1.225 -0.000 -0.553) 1.345 12.001 ( -1.052 -0.000 -0.564) 1.194 12.008 ( 7.823 0.000 3.909) 8.745 12.313 ( 4.197 0.000 -13.184) 13.836 12.502 ( -0.063 -0.000 -1.712) 1.713 12.563 ( 3.795 0.000 -0.572) 3.838 12.738 ( 8.357 0.000 1.304) 8.458 13.047 ( -12.008 -0.000 18.683) 22.209 14.152 ( -8.144 -0.000 -5.851) 10.027 14.954 ( 1.907 0.000 -0.127) 1.911 14.976 ( -21.877 -0.000 -1.552) 21.932 15.046 ( -2.455 -0.000 0.230) 2.466 15.101 ( 13.029 0.000 -2.287) 13.228 15.246 ( 14.572 0.000 4.346) 15.206 15.574 ( -5.837 -0.000 5.542) 8.049 15.652 ( 1.766 0.000 -6.087) 6.338 15.906 ( -2.145 -0.000 0.143) 2.150 16.122 ( -3.790 -0.000 -6.275) 7.330 16.279 ( 8.001 0.000 -8.612) 11.755 16.568 ( 43.540 0.000 1.470) 43.565 16.608 ( -8.679 -0.000 3.090) 9.213 16.931 ( -74.287 -0.000 4.953) 74.452 17.113 ( 6.394 0.000 1.276) 6.520 17.707 ( -3.886 -0.000 1.895) 4.324 18.004 ( 3.517 0.000 -2.611) 4.380 25.641 ( 0.371 0.000 1.776) 1.814 25.695 ( 0.406 0.000 0.118) 0.422 25.901 ( 0.069 0.000 1.059) 1.062 25.939 ( -4.869 -0.000 -2.363) 5.412 26.113 ( -7.246 -0.000 3.866) 8.213 26.243 ( 3.770 0.000 1.157) 3.943 26.573 ( -3.390 -0.000 -1.697) 3.791 26.626 ( -0.433 -0.000 -1.623) 1.680 27.170 ( 3.987 0.000 2.763) 4.851 27.821 ( -14.010 -0.000 -8.661) 16.471 28.242 ( -77.656 -0.000 6.053) 77.892 28.417 ( -1.116 -0.000 -2.480) 2.719 28.444 ( 1.297 0.000 -2.862) 3.142 28.622 ( 4.457 0.000 -0.617) 4.500 29.411 ( 117.218 0.000 3.762) 117.279 29.509 ( -10.971 -0.000 1.272) 11.045 ======================= Grid point 86 (27/140) ======================= q-point: ( 0.11 0.00 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 7.23e-05 7.23e-05 7.23e-05 7.23e-05 7.23e-05 7.23e-05 7.23e-05 7.23e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 243 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.743 ( -2.554 -11.443 23.290) 26.075 1.005 ( 8.402 -22.171 19.369) 30.615 1.493 ( 16.288 -12.512 31.415) 37.533 1.685 ( 7.186 -17.537 15.572) 24.529 2.143 ( -6.466 -10.492 -5.668) 13.565 2.311 ( -4.827 -2.425 -5.472) 7.690 2.441 ( 1.219 -9.978 3.632) 10.689 2.603 ( 13.065 -6.474 -10.296) 17.850 2.670 ( -9.086 -9.208 6.339) 14.406 2.754 ( -2.736 -6.447 2.818) 7.549 3.022 ( 0.702 -0.749 5.583) 5.676 3.222 ( -1.471 1.787 -11.982) 12.204 3.463 ( 1.019 2.136 -4.801) 5.352 3.565 ( -1.197 1.493 -6.581) 6.853 3.726 ( 0.988 -1.001 8.270) 8.389 3.903 ( -5.074 0.491 1.259) 5.251 4.038 ( -1.556 4.106 -7.504) 8.694 4.262 ( -3.185 6.587 2.930) 7.882 4.419 ( -2.172 -1.530 -2.165) 3.427 4.518 ( 3.346 2.515 0.489) 4.214 4.560 ( -3.684 -1.058 3.418) 5.136 4.632 ( 3.642 -2.585 1.449) 4.695 4.774 ( 1.583 -3.670 -3.028) 5.014 5.198 ( -6.070 2.872 1.868) 6.970 5.343 ( -0.739 -4.862 -0.270) 4.925 5.376 ( 6.577 -2.690 0.661) 7.137 5.508 ( 5.454 1.037 -13.153) 14.277 5.774 ( -2.512 -4.441 -8.046) 9.527 6.047 ( 2.902 6.480 0.491) 7.117 6.196 ( -2.979 4.536 5.052) 7.414 6.354 ( 2.662 1.983 -0.918) 3.444 6.481 ( 7.942 0.623 -0.265) 7.970 6.529 ( -0.248 -0.479 7.401) 7.420 6.703 ( -1.017 5.515 5.230) 7.668 6.770 ( -3.714 4.576 -2.511) 6.407 7.258 ( 9.690 0.877 -4.406) 10.681 7.286 ( -2.120 -1.627 -2.200) 3.462 7.511 ( -8.258 -1.851 -10.810) 13.728 7.781 ( -7.593 6.425 3.699) 10.612 7.884 ( -2.578 3.377 4.657) 6.304 8.540 ( 2.467 -8.781 4.272) 10.072 8.888 ( -0.232 -6.737 -5.640) 8.790 8.943 ( -2.881 -4.967 -7.730) 9.629 9.102 ( -3.800 -9.362 -7.382) 12.513 9.354 ( -1.260 6.062 1.690) 6.418 9.495 ( 2.786 -4.271 2.767) 5.802 9.896 ( -11.093 5.592 10.041) 15.973 9.928 ( 2.216 11.128 9.062) 14.521 10.238 ( -3.124 -1.433 3.421) 4.849 10.676 ( 4.246 -1.183 5.137) 6.769 10.737 ( 3.913 -16.145 -7.506) 18.229 10.961 ( 1.487 0.832 -2.232) 2.808 11.178 ( 2.730 -3.301 3.360) 5.445 11.368 ( -0.535 -4.169 5.811) 7.172 11.651 ( 8.363 6.256 -7.653) 12.948 11.795 ( -1.935 -1.026 -0.365) 2.220 11.940 ( 1.193 4.170 -1.364) 4.546 12.064 ( 4.890 2.613 2.098) 5.929 12.213 ( 2.707 6.810 2.640) 7.789 12.417 ( -5.837 2.172 -9.448) 11.316 12.479 ( -5.304 3.203 0.508) 6.217 12.869 ( 8.288 -1.333 -3.685) 9.168 13.131 ( -9.522 -6.660 9.090) 14.753 13.899 ( -25.677 4.968 7.176) 27.120 14.788 ( -7.197 6.359 4.939) 10.800 14.992 ( -1.459 5.341 0.662) 5.576 15.082 ( 5.195 3.281 -0.091) 6.145 15.102 ( 4.782 -5.069 -2.753) 7.493 15.389 ( 7.116 -2.393 -0.677) 7.538 15.482 ( -1.951 5.096 1.498) 5.659 15.680 ( 2.443 -2.131 -4.625) 5.649 15.780 ( -1.116 11.557 -1.107) 11.663 15.954 ( -6.135 0.234 0.806) 6.192 16.305 ( 2.693 1.030 0.928) 3.029 16.545 ( -22.332 -3.584 3.280) 22.854 16.563 ( -0.399 -1.399 1.850) 2.353 16.890 ( 23.493 9.234 -1.831) 25.309 17.211 ( 4.728 -3.393 3.922) 7.018 17.872 ( 4.404 -9.378 -12.563) 16.284 18.053 ( 2.642 -3.972 -3.389) 5.852 25.660 ( 0.241 -0.759 1.816) 1.983 25.715 ( 0.777 -1.577 0.492) 1.825 25.874 ( -5.053 1.190 2.766) 5.882 25.914 ( -0.505 -0.981 1.396) 1.780 26.039 ( 0.410 2.679 6.030) 6.611 26.342 ( 2.715 -2.872 -3.677) 5.398 26.575 ( -3.754 -2.485 -3.929) 5.975 26.652 ( -0.943 -5.127 -3.707) 6.397 27.093 ( 2.331 9.589 11.946) 15.495 27.595 ( -20.931 1.936 -3.228) 21.267 28.122 ( -18.806 -9.696 4.385) 21.608 28.457 ( -5.352 -11.959 -5.089) 14.055 28.520 ( -1.591 -7.677 -1.320) 7.951 28.668 ( 2.756 -1.780 1.103) 3.461 29.379 ( -9.692 4.452 -2.864) 11.043 29.865 ( 63.362 21.686 -5.794) 67.220 ======================= Grid point 87 (28/140) ======================= q-point: ( 0.22 0.00 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 7.23e-05 7.23e-05 7.23e-05 7.23e-05 7.23e-05 7.23e-05 7.23e-05 7.23e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 243 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.092 ( 7.781 -14.341 15.123) 22.247 1.493 ( 5.156 -18.916 13.027) 23.540 1.906 ( 4.194 -14.682 6.118) 16.449 2.024 ( -3.492 -8.251 11.389) 14.491 2.269 ( 6.728 -11.856 5.538) 14.714 2.408 ( -2.579 -10.336 -2.384) 10.917 2.631 ( 4.401 -7.299 -1.059) 8.589 2.759 ( -0.821 -6.434 0.490) 6.504 2.898 ( 0.140 -17.597 1.549) 17.666 2.933 ( 0.616 -13.054 3.476) 13.523 3.085 ( -0.393 -3.772 6.732) 7.727 3.142 ( 1.448 -0.679 -10.173) 10.298 3.416 ( -0.598 1.912 -2.379) 3.110 3.480 ( -0.441 3.718 -5.472) 6.630 3.753 ( -1.749 0.892 0.558) 2.041 3.887 ( -7.143 4.594 -3.794) 9.302 3.906 ( -0.709 -4.952 0.439) 5.021 4.092 ( -3.228 9.199 -0.045) 9.749 4.379 ( -5.548 1.693 -1.751) 6.059 4.511 ( 1.645 -0.222 2.790) 3.246 4.638 ( 4.264 -2.082 7.539) 8.908 4.744 ( 5.932 -2.638 -8.372) 10.594 4.827 ( 3.267 -2.235 6.384) 7.511 5.113 ( -6.964 1.788 -0.033) 7.190 5.316 ( -1.066 2.009 -12.410) 12.617 5.471 ( -0.065 -6.145 0.522) 6.167 5.553 ( 10.655 -1.680 -3.658) 11.390 5.769 ( -3.649 -1.833 -5.770) 7.069 5.976 ( 4.768 4.303 0.328) 6.431 6.104 ( -1.937 5.890 1.928) 6.493 6.293 ( -1.308 5.179 1.764) 5.626 6.454 ( 2.699 3.263 0.150) 4.237 6.643 ( -8.000 1.847 3.504) 8.927 6.650 ( 2.833 -3.068 -0.269) 4.185 6.718 ( 6.016 -0.975 3.194) 6.880 7.225 ( 3.428 6.934 -6.779) 10.285 7.272 ( -1.505 -0.388 -2.641) 3.064 7.385 ( -6.200 2.563 -5.018) 8.378 7.646 ( -10.262 3.306 2.413) 11.048 7.816 ( -1.335 4.324 3.551) 5.752 8.752 ( 3.050 -9.695 2.936) 10.579 8.967 ( -4.439 -6.561 -6.761) 10.415 9.019 ( -1.770 -10.379 -3.858) 11.214 9.202 ( -4.146 -10.253 -7.691) 13.471 9.266 ( -3.535 3.398 6.678) 8.285 9.560 ( -5.629 -2.671 -1.478) 6.403 9.798 ( -0.868 7.625 12.249) 14.454 9.885 ( 0.609 -0.297 7.984) 8.013 10.256 ( -0.780 -0.476 1.526) 1.779 10.776 ( 4.917 -3.538 5.624) 8.266 10.876 ( -0.461 -0.934 -0.399) 1.115 10.995 ( 9.160 -2.929 -3.849) 10.358 11.269 ( 2.598 -4.370 -3.668) 6.269 11.479 ( 1.012 -4.793 2.931) 5.709 11.582 ( 5.335 2.946 -4.122) 7.357 11.805 ( -4.590 -2.655 2.393) 5.818 11.900 ( 6.516 2.837 -3.582) 7.958 12.016 ( 1.887 7.177 1.973) 7.679 12.170 ( 2.744 4.364 7.671) 9.242 12.284 ( -4.254 1.968 -9.944) 10.993 12.417 ( -3.757 -0.063 -2.436) 4.478 12.851 ( 4.557 6.113 -7.012) 10.359 13.153 ( -10.139 -0.358 8.116) 12.993 13.681 ( -16.088 7.185 6.738) 18.864 14.692 ( -4.143 3.127 7.249) 8.915 14.887 ( 2.700 6.152 1.856) 6.970 15.050 ( -0.546 1.055 -2.304) 2.592 15.212 ( 0.416 -5.145 -1.494) 5.374 15.395 ( -3.265 -0.769 0.062) 3.355 15.492 ( 4.812 -0.407 1.853) 5.172 15.597 ( 1.423 7.579 -2.459) 8.094 15.723 ( 5.404 -1.139 -7.579) 9.378 15.915 ( -6.680 0.728 1.613) 6.910 16.276 ( -2.566 2.220 2.702) 4.337 16.472 ( -7.247 0.987 0.445) 7.327 16.646 ( -0.406 -6.390 1.047) 6.487 16.846 ( 10.079 8.567 0.270) 13.230 17.329 ( 6.098 -2.769 3.726) 7.664 17.923 ( 4.837 -0.609 -10.318) 11.412 18.103 ( 2.237 -1.664 -3.740) 4.664 25.685 ( 0.003 -1.264 1.575) 2.020 25.763 ( 1.607 -2.456 0.523) 2.981 25.856 ( -2.567 -0.022 3.806) 4.591 25.937 ( -0.970 -1.247 1.723) 2.338 26.039 ( 0.492 1.389 3.211) 3.532 26.379 ( 3.940 -1.085 -2.649) 4.870 26.561 ( -3.201 -1.503 -3.391) 4.899 26.683 ( -2.494 -3.285 -8.805) 9.723 27.053 ( 1.082 5.617 15.505) 16.527 27.437 ( -8.426 1.977 -1.862) 8.853 28.129 ( -7.202 -2.175 1.578) 7.687 28.591 ( -3.254 -7.859 -7.592) 11.402 28.676 ( -6.240 -15.048 0.745) 16.307 28.747 ( -1.297 -6.475 1.749) 6.831 29.215 ( -5.218 4.683 -4.770) 8.481 29.834 ( 36.621 23.774 -0.320) 43.663 ======================= Grid point 88 (29/140) ======================= q-point: ( 0.33 0.00 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 7.23e-05 7.23e-05 7.23e-05 7.23e-05 7.23e-05 7.23e-05 7.23e-05 7.23e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 243 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.440 ( 9.496 -10.365 10.880) 17.776 1.801 ( -2.591 -11.034 6.421) 13.027 2.075 ( -0.500 -9.293 -5.454) 10.787 2.247 ( 2.115 -7.994 11.780) 14.393 2.490 ( 0.905 -6.280 1.630) 6.550 2.572 ( 2.756 -7.353 6.886) 10.444 2.742 ( 0.147 -4.816 -0.130) 4.820 2.832 ( 2.490 -1.529 -5.269) 6.025 3.034 ( -2.717 -6.512 1.364) 7.187 3.074 ( -0.104 0.564 -5.901) 5.929 3.212 ( -0.373 -10.249 4.935) 11.381 3.245 ( 0.187 -3.769 -1.391) 4.022 3.341 ( -5.139 0.334 -4.773) 7.022 3.486 ( 3.237 -2.983 2.565) 5.095 3.693 ( -10.226 3.902 -1.041) 10.994 3.774 ( 3.525 -0.173 -1.241) 3.742 3.961 ( -1.636 0.939 -1.985) 2.738 4.069 ( 5.140 -7.517 3.124) 9.627 4.307 ( -2.019 2.178 3.351) 4.478 4.542 ( -0.721 0.256 3.979) 4.052 4.702 ( 1.583 1.479 -3.281) 3.932 4.745 ( 6.770 1.317 -0.912) 6.957 4.911 ( 4.162 0.403 2.581) 4.914 5.024 ( -9.183 0.853 -3.236) 9.774 5.264 ( 1.887 -3.770 -8.977) 9.918 5.561 ( -3.403 -5.031 0.797) 6.126 5.617 ( 9.143 1.512 -3.176) 9.797 5.765 ( -2.396 -3.440 -1.077) 4.328 5.963 ( 1.439 6.332 1.581) 6.683 6.017 ( 3.454 -1.415 -4.773) 6.059 6.231 ( -0.651 2.622 5.428) 6.063 6.428 ( 2.115 1.531 -1.554) 3.039 6.529 ( -13.358 3.029 1.591) 13.789 6.699 ( 1.917 -2.788 0.004) 3.383 6.850 ( 6.735 -3.211 3.463) 8.226 7.064 ( -2.714 5.842 -4.089) 7.630 7.223 ( -4.471 2.332 -5.720) 7.625 7.351 ( 5.508 -0.431 0.440) 5.542 7.531 ( -7.753 3.325 2.834) 8.899 7.753 ( -0.386 4.367 1.860) 4.762 8.871 ( -3.333 -2.522 1.140) 4.333 9.006 ( -3.501 -4.054 -2.792) 6.040 9.134 ( -3.680 -8.401 -2.205) 9.433 9.277 ( -2.497 -3.314 5.647) 7.008 9.321 ( -1.677 -8.529 -4.763) 9.912 9.517 ( -1.812 0.275 -2.535) 3.129 9.741 ( -3.458 2.873 8.447) 9.569 9.972 ( 2.433 -2.193 5.625) 6.509 10.249 ( -0.132 1.553 0.595) 1.668 10.821 ( -1.381 3.058 2.107) 3.962 10.946 ( 4.345 -6.375 3.889) 8.639 11.088 ( 9.160 0.147 -1.554) 9.293 11.326 ( 0.635 -4.123 -6.558) 7.773 11.508 ( 0.106 -0.935 -2.848) 3.000 11.631 ( 3.600 -0.534 0.093) 3.640 11.801 ( 1.073 5.039 0.499) 5.177 11.882 ( 2.045 -1.450 0.282) 2.523 11.958 ( 1.542 -0.075 -1.290) 2.012 12.160 ( 1.259 5.400 8.823) 10.421 12.224 ( 2.185 -1.622 -5.651) 6.272 12.395 ( -0.873 -1.761 -5.362) 5.711 12.705 ( 2.673 8.335 -7.519) 11.539 13.078 ( -10.383 4.005 6.778) 13.030 13.455 ( -11.206 10.135 4.269) 15.701 14.696 ( -0.163 -1.593 5.729) 5.948 14.856 ( 0.058 0.816 0.878) 1.200 15.023 ( -1.399 -0.566 -0.708) 1.667 15.296 ( -0.042 -5.432 -0.185) 5.435 15.318 ( -1.085 7.829 -1.553) 8.055 15.541 ( 3.608 0.160 -1.777) 4.025 15.556 ( 0.180 -2.566 2.792) 3.797 15.731 ( 3.055 1.275 -6.188) 7.018 15.852 ( -3.062 1.003 0.085) 3.223 16.239 ( -2.031 1.416 1.171) 2.739 16.377 ( -5.370 4.660 2.806) 7.644 16.750 ( -6.909 -6.754 0.816) 9.696 16.812 ( 11.848 4.115 0.931) 12.577 17.418 ( 4.439 -0.815 2.974) 5.405 17.893 ( 2.247 1.419 -7.669) 8.117 18.120 ( 2.080 -0.498 -2.502) 3.292 25.721 ( 0.307 -1.776 1.869) 2.596 25.811 ( 0.870 -1.573 -0.710) 1.933 25.865 ( -0.944 -0.670 4.120) 4.280 25.952 ( -1.437 -0.625 1.392) 2.096 26.020 ( -0.126 2.511 1.735) 3.054 26.415 ( 5.349 -0.238 -3.150) 6.212 26.547 ( -2.711 -1.330 -1.990) 3.617 26.656 ( -3.057 -1.857 -8.463) 9.188 27.055 ( 0.631 3.720 14.915) 15.385 27.362 ( -1.856 2.071 -1.872) 3.352 28.122 ( -4.540 -1.660 1.871) 5.183 28.609 ( -5.204 -3.394 -6.552) 9.029 28.831 ( -4.392 -4.943 -2.631) 7.116 28.880 ( -7.666 -14.672 -1.886) 16.661 29.159 ( 2.549 -1.984 0.536) 3.274 29.677 ( 23.690 22.579 1.509) 32.762 ======================= Grid point 89 (30/140) ======================= q-point: ( 0.44 0.00 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 7.23e-05 7.23e-05 7.23e-05 7.23e-05 7.23e-05 7.23e-05 7.23e-05 7.23e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 243 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.645 ( 1.461 -2.006 9.531) 9.849 1.948 ( -1.074 -6.524 0.458) 6.628 2.120 ( 0.288 2.596 -1.320) 2.926 2.375 ( -2.028 -1.791 1.626) 3.157 2.558 ( 2.569 -0.535 7.883) 8.308 2.708 ( -0.980 -1.224 2.496) 2.948 2.797 ( 4.421 1.346 -5.598) 7.259 2.833 ( 1.254 -3.718 1.522) 4.209 3.017 ( -0.975 1.443 -4.983) 5.278 3.145 ( -2.962 -6.183 -0.139) 6.858 3.168 ( -3.123 0.372 -9.998) 10.481 3.278 ( -0.515 1.320 -0.123) 1.423 3.414 ( -2.779 -5.260 2.037) 6.288 3.519 ( 0.205 0.970 -1.770) 2.029 3.585 ( -3.898 -1.237 5.532) 6.880 3.807 ( 0.485 0.429 1.902) 2.009 4.023 ( 2.003 -6.024 0.636) 6.380 4.172 ( 4.569 1.416 2.372) 5.339 4.345 ( 2.823 -1.038 5.537) 6.301 4.501 ( -5.900 4.606 3.879) 8.431 4.659 ( 3.388 0.229 -9.407) 10.001 4.737 ( 6.269 5.854 0.569) 8.596 4.926 ( -7.870 -1.020 -5.520) 9.667 4.940 ( 4.016 -0.013 -0.219) 4.022 5.366 ( 2.175 -8.058 -1.697) 8.518 5.584 ( -0.710 -1.066 -5.367) 5.518 5.643 ( 5.894 1.797 3.541) 7.107 5.799 ( -3.770 -1.959 -0.042) 4.248 5.853 ( -2.874 2.735 -2.291) 4.581 6.127 ( 8.473 -4.351 -0.435) 9.535 6.229 ( -1.032 0.213 2.823) 3.013 6.370 ( -12.685 4.150 3.340) 13.758 6.430 ( 2.951 -0.490 -0.861) 3.113 6.771 ( 0.860 -3.854 1.467) 4.212 6.898 ( 1.520 1.452 -2.176) 3.025 7.033 ( -1.458 -1.675 6.075) 6.469 7.125 ( -4.199 -1.526 -8.284) 9.412 7.420 ( 1.440 0.030 -0.386) 1.491 7.467 ( 4.379 2.188 7.339) 8.822 7.676 ( -0.068 4.699 -0.918) 4.788 8.844 ( -6.769 -0.026 1.277) 6.889 9.032 ( -0.200 -2.517 -0.167) 2.530 9.226 ( -2.658 -5.044 -0.721) 5.747 9.325 ( -5.237 -2.943 -1.794) 6.269 9.328 ( 1.424 2.376 -1.956) 3.391 9.571 ( 2.254 -2.622 4.601) 5.755 9.741 ( -5.399 -4.021 1.562) 6.911 10.013 ( 3.507 3.198 4.612) 6.618 10.210 ( -1.085 1.792 -2.144) 2.998 10.765 ( -1.936 2.745 1.001) 3.505 11.077 ( 1.225 -2.852 3.424) 4.621 11.107 ( 7.249 3.986 -1.819) 8.470 11.380 ( 1.120 -6.596 -7.663) 10.173 11.514 ( -3.013 6.154 -3.019) 7.488 11.547 ( -0.876 -1.622 -0.802) 2.011 11.784 ( -0.040 0.456 3.470) 3.500 11.981 ( 3.870 -0.013 1.470) 4.140 11.993 ( 4.336 -5.053 -3.395) 7.474 12.082 ( 0.645 7.063 7.846) 10.576 12.284 ( 3.197 -3.198 -0.693) 4.575 12.411 ( 1.847 -3.436 -7.219) 8.205 12.616 ( 5.145 0.783 -4.496) 6.877 12.937 ( -8.469 5.995 2.025) 10.572 13.230 ( -7.938 8.899 2.203) 12.127 14.781 ( 2.373 -3.974 3.381) 5.732 14.830 ( -3.131 1.404 0.280) 3.443 15.053 ( 1.433 -0.648 0.740) 1.738 15.162 ( -0.011 5.425 -1.396) 5.602 15.396 ( -1.695 -5.875 1.020) 6.199 15.546 ( 2.790 1.697 -0.799) 3.362 15.611 ( 0.748 -1.430 -0.550) 1.705 15.653 ( -0.585 4.444 -2.401) 5.084 15.868 ( 0.767 -2.795 -0.727) 2.988 16.196 ( -2.132 1.703 -0.635) 2.802 16.310 ( -5.023 0.134 5.980) 7.811 16.752 ( -1.651 0.126 -1.567) 2.280 16.896 ( 4.379 -2.049 3.920) 6.224 17.452 ( 1.273 0.587 1.820) 2.298 17.865 ( 0.548 -1.159 -5.114) 5.273 18.129 ( 1.980 0.032 -2.140) 2.916 25.758 ( -0.473 -0.842 2.575) 2.750 25.822 ( -0.410 -0.714 -0.493) 0.959 25.894 ( 0.221 -0.005 2.609) 2.618 25.949 ( -1.134 0.575 1.195) 1.745 25.976 ( -0.440 1.984 -0.292) 2.053 26.432 ( 6.436 0.763 -5.640) 8.591 26.549 ( -2.452 -1.729 -0.343) 3.020 26.632 ( -1.815 -1.317 -3.340) 4.022 27.090 ( 2.617 2.279 14.632) 15.038 27.298 ( -1.051 2.262 -5.027) 5.612 28.129 ( -3.607 -1.467 2.222) 4.483 28.590 ( -5.006 -3.285 -6.142) 8.577 28.815 ( -2.027 -0.454 -7.650) 7.927 29.033 ( -6.778 -11.029 -0.290) 12.949 29.282 ( 0.547 -7.067 2.768) 7.609 29.481 ( 15.777 19.170 3.273) 25.042 ======================= Grid point 90 (31/140) ======================= q-point: (-0.44 0.00 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 7.23e-05 7.23e-05 7.23e-05 7.23e-05 7.23e-05 7.23e-05 7.23e-05 7.23e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 243 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.620 ( -10.836 5.532 8.732) 14.976 1.910 ( -4.392 10.255 -4.789) 12.140 2.041 ( 3.755 6.813 4.618) 9.047 2.352 ( 1.754 4.519 1.122) 4.976 2.596 ( -2.589 7.920 -5.796) 10.150 2.602 ( 1.355 2.432 4.405) 5.211 2.789 ( 0.999 5.586 -0.685) 5.716 2.855 ( 1.710 -2.001 -3.049) 4.028 2.993 ( 0.265 0.114 -1.306) 1.337 3.146 ( -2.373 1.930 -7.246) 7.866 3.168 ( 1.322 0.188 -3.162) 3.433 3.240 ( 0.331 -3.004 2.414) 3.868 3.460 ( -4.055 -2.205 2.354) 5.181 3.528 ( 0.834 -1.984 0.205) 2.162 3.683 ( 2.760 -5.289 4.459) 7.448 3.763 ( -2.677 3.012 0.297) 4.040 4.144 ( 0.868 -4.269 4.095) 5.979 4.199 ( 4.934 0.959 5.793) 7.669 4.300 ( -4.937 12.148 0.823) 13.139 4.360 ( -2.053 2.231 1.786) 3.518 4.650 ( 1.415 2.905 -2.548) 4.115 4.712 ( 7.749 -1.401 -7.215) 10.680 4.843 ( -3.145 3.908 -6.417) 8.145 5.005 ( 3.097 -3.687 1.746) 5.122 5.482 ( -1.296 -3.997 -1.467) 4.451 5.569 ( -0.450 -1.903 -7.661) 7.907 5.677 ( 7.295 1.024 3.608) 8.203 5.772 ( -0.386 2.388 4.014) 4.687 5.814 ( -5.710 -1.032 -1.604) 6.020 6.163 ( -5.201 0.830 -0.794) 5.327 6.259 ( -1.410 -0.093 3.578) 3.847 6.291 ( 1.646 -1.523 -0.285) 2.261 6.482 ( 4.178 -1.777 0.151) 4.543 6.849 ( -2.160 -2.963 4.054) 5.466 6.872 ( -2.189 1.348 0.318) 2.590 7.012 ( -1.671 -2.331 -2.719) 3.952 7.221 ( 0.672 -9.231 1.262) 9.341 7.388 ( -1.626 1.000 0.755) 2.053 7.523 ( 4.421 4.239 5.275) 8.083 7.639 ( 7.838 -0.184 -1.053) 7.911 8.811 ( -7.227 -2.255 0.721) 7.605 9.106 ( 5.979 -2.863 2.609) 7.124 9.201 ( 1.273 6.024 -3.236) 6.956 9.283 ( -2.550 -1.588 -5.282) 6.076 9.340 ( -2.893 -0.996 2.913) 4.224 9.602 ( -1.274 1.743 5.425) 5.839 9.756 ( -2.120 1.195 0.280) 2.449 9.954 ( -0.514 8.180 2.417) 8.545 10.196 ( 2.742 -2.262 -1.949) 4.054 10.706 ( -3.251 2.047 -0.473) 3.870 11.056 ( 3.569 6.192 -1.203) 7.247 11.098 ( -3.296 -0.438 1.136) 3.514 11.316 ( -1.109 6.737 -6.252) 9.258 11.510 ( 1.724 -6.550 -3.977) 7.855 11.638 ( -1.059 -8.098 -0.630) 8.191 11.788 ( -2.244 -0.690 2.934) 3.757 11.888 ( -1.959 8.959 0.016) 9.171 11.981 ( 0.657 4.445 0.867) 4.576 12.154 ( 4.342 -0.633 4.135) 6.029 12.383 ( 3.795 -4.770 0.903) 6.162 12.464 ( 1.311 -4.754 -2.212) 5.405 12.708 ( 4.803 -6.409 -5.395) 9.656 12.802 ( 1.076 2.948 -1.644) 3.543 13.092 ( -2.519 2.611 0.509) 3.664 14.771 ( -3.892 2.342 2.118) 5.012 14.839 ( 1.283 2.390 0.553) 2.769 15.026 ( 3.631 -0.000 0.984) 3.762 15.211 ( 1.017 -5.949 0.161) 6.037 15.455 ( -1.557 -0.718 3.577) 3.967 15.514 ( 0.732 2.088 -2.668) 3.466 15.530 ( -0.161 5.259 -2.819) 5.968 15.667 ( 1.687 -2.401 -1.546) 3.317 15.922 ( 1.039 -3.202 -1.062) 3.530 16.167 ( -4.188 -0.962 0.615) 4.341 16.348 ( -3.185 -4.227 6.780) 8.602 16.724 ( 1.623 1.685 -2.864) 3.698 16.952 ( -1.854 -0.527 5.539) 5.865 17.445 ( -2.954 0.295 1.698) 3.421 17.902 ( 0.596 -5.331 -3.994) 6.688 18.129 ( 2.044 0.395 -2.274) 3.084 25.753 ( -2.554 1.089 2.280) 3.593 25.839 ( 0.332 -0.685 0.390) 0.855 25.869 ( -1.264 3.228 1.431) 3.751 25.909 ( -0.547 2.026 -0.819) 2.253 25.989 ( 1.007 -1.677 0.151) 1.962 26.447 ( 6.898 -0.163 -6.855) 9.726 26.552 ( -2.223 -0.724 0.926) 2.515 26.640 ( 0.125 -0.730 1.119) 1.342 27.138 ( 2.177 4.403 11.438) 12.448 27.251 ( 2.110 -1.639 -3.877) 4.708 28.130 ( -2.750 -0.693 1.117) 3.048 28.583 ( -3.217 -2.955 -6.289) 7.657 28.755 ( 0.700 2.705 -6.613) 7.179 29.127 ( -1.402 -0.939 -2.254) 2.816 29.255 ( 2.054 6.665 4.332) 8.210 29.477 ( -1.950 -7.249 3.015) 8.089 ======================= Grid point 91 (32/140) ======================= q-point: (-0.33 0.00 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 7.23e-05 7.23e-05 7.23e-05 7.23e-05 7.23e-05 7.23e-05 7.23e-05 7.23e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 243 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.409 ( -19.375 10.339 11.293) 24.694 1.565 ( -7.279 21.292 -1.779) 22.572 1.941 ( 1.061 14.211 5.839) 15.400 2.181 ( 2.796 17.995 -2.084) 18.330 2.413 ( -0.124 7.352 -2.248) 7.689 2.572 ( -2.147 2.090 -1.159) 3.213 2.662 ( 4.410 7.969 -3.545) 9.773 2.922 ( 6.105 3.778 -4.735) 8.600 2.959 ( 1.169 0.903 -4.270) 4.518 3.008 ( -1.815 6.906 2.776) 7.661 3.100 ( -0.628 6.122 2.150) 6.519 3.355 ( -2.721 -5.451 -0.848) 6.151 3.461 ( -3.564 6.868 3.080) 8.328 3.541 ( -0.684 -3.253 3.319) 4.697 3.636 ( -0.438 1.162 -2.211) 2.536 3.888 ( 3.618 -6.149 -0.877) 7.188 4.045 ( -4.217 5.506 3.567) 7.799 4.209 ( 5.655 4.536 10.187) 12.503 4.296 ( 8.361 -0.997 -1.320) 8.523 4.374 ( -7.364 -7.308 4.112) 11.160 4.581 ( -3.680 2.413 -1.125) 4.542 4.671 ( 1.200 9.535 -7.383) 12.119 4.789 ( 7.520 -3.315 -9.148) 12.297 5.100 ( 1.162 -3.876 2.745) 4.890 5.479 ( -3.004 0.408 -2.745) 4.090 5.546 ( 1.189 -0.526 -8.037) 8.142 5.705 ( -1.414 5.723 4.446) 7.384 5.789 ( 2.691 -2.806 0.763) 3.962 5.798 ( -0.688 -2.699 0.986) 2.955 6.124 ( -3.829 -1.435 -0.394) 4.108 6.247 ( -3.438 -0.229 3.927) 5.224 6.344 ( 4.691 -1.292 -4.724) 6.782 6.530 ( 3.629 -0.256 -0.151) 3.641 6.770 ( -11.391 2.504 0.222) 11.665 6.864 ( -1.842 1.568 3.521) 4.272 7.143 ( 3.659 -9.539 -0.523) 10.230 7.364 ( 0.287 -1.980 1.289) 2.380 7.394 ( 2.315 -3.303 4.243) 5.854 7.511 ( 2.223 -2.221 -2.184) 3.827 7.736 ( 10.795 -0.143 2.268) 11.032 8.806 ( -6.146 -1.782 0.539) 6.422 9.067 ( 0.455 8.141 -1.226) 8.246 9.194 ( 7.885 2.679 0.074) 8.328 9.269 ( 1.056 0.271 0.131) 1.098 9.355 ( -1.380 -1.566 -0.038) 2.088 9.589 ( -0.584 -1.160 1.055) 1.673 9.676 ( 0.637 8.328 5.596) 10.054 9.784 ( -5.174 8.059 0.659) 9.600 10.270 ( 5.252 -0.921 1.152) 5.455 10.646 ( -4.613 0.659 -2.007) 5.074 10.952 ( -2.291 5.589 2.191) 6.426 11.074 ( -5.361 -0.819 -0.158) 5.425 11.222 ( 5.507 2.512 -9.202) 11.014 11.539 ( -2.158 2.123 -4.669) 5.564 11.701 ( -5.935 2.352 0.474) 6.401 11.787 ( 0.517 -2.057 -2.739) 3.464 11.831 ( 2.084 -1.777 2.487) 3.699 11.894 ( -1.242 1.591 0.407) 2.060 12.151 ( -3.541 3.558 5.873) 7.726 12.452 ( 3.468 -1.740 -2.150) 4.436 12.570 ( 4.639 -2.741 3.624) 6.494 12.668 ( 0.366 0.711 -11.214) 11.242 13.026 ( 13.605 -13.391 2.169) 19.213 13.109 ( 2.573 -3.405 0.792) 4.341 14.728 ( -2.818 1.464 5.645) 6.477 14.797 ( -0.774 -0.236 -1.279) 1.513 15.106 ( 3.697 -2.255 2.880) 5.201 15.290 ( 2.285 -1.045 -1.528) 2.941 15.415 ( -1.524 3.558 -0.525) 3.906 15.440 ( 1.831 3.860 1.573) 4.552 15.527 ( -2.979 -4.587 -1.777) 5.751 15.709 ( 1.860 -2.161 -3.014) 4.149 15.981 ( 3.577 -3.033 -3.737) 5.997 16.150 ( -7.081 -0.673 3.700) 8.018 16.435 ( -0.828 -3.121 4.099) 5.218 16.711 ( 3.547 -0.003 -1.706) 3.936 16.944 ( -8.062 -0.231 5.667) 9.858 17.418 ( -8.338 -0.752 3.507) 9.076 17.990 ( -0.001 -5.947 -4.635) 7.540 18.136 ( 2.780 -1.380 -3.265) 4.505 25.720 ( -2.714 1.466 1.962) 3.655 25.800 ( -2.216 2.963 0.852) 3.797 25.833 ( -0.157 1.906 0.499) 1.977 25.892 ( 0.786 0.118 0.196) 0.819 26.019 ( 1.084 -0.540 0.088) 1.215 26.464 ( 4.822 -0.695 -10.055) 11.173 26.568 ( 1.102 -0.316 6.674) 6.772 26.656 ( 0.330 0.192 1.895) 1.933 27.070 ( -1.928 4.728 -1.412) 5.298 27.377 ( 11.016 -3.947 9.490) 15.066 28.121 ( -0.879 0.264 -0.670) 1.137 28.567 ( -1.690 -1.105 -5.986) 6.317 28.677 ( 3.391 4.980 -4.458) 7.495 28.962 ( 3.732 14.110 -3.580) 15.028 29.332 ( -5.506 -8.380 7.598) 12.581 29.572 ( -12.329 -9.983 -3.990) 16.358 ======================= Grid point 92 (33/140) ======================= q-point: (-0.22 0.00 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 7.23e-05 7.23e-05 7.23e-05 7.23e-05 7.23e-05 7.23e-05 7.23e-05 7.23e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 243 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.115 ( -21.414 14.103 18.314) 31.510 1.121 ( -7.969 24.487 7.517) 26.826 1.546 ( -10.892 29.657 2.729) 31.711 1.845 ( 3.653 22.576 0.190) 22.871 2.365 ( 8.094 3.824 2.308) 9.245 2.484 ( 2.863 8.906 -5.357) 10.780 2.542 ( -4.357 4.348 -0.832) 6.211 2.712 ( 5.735 16.517 -7.095) 18.869 2.820 ( -0.100 11.222 3.139) 11.653 3.004 ( -1.008 2.200 1.536) 2.866 3.044 ( -1.360 8.757 2.525) 9.215 3.226 ( -5.833 -1.824 1.203) 6.229 3.454 ( -0.032 -1.266 -0.655) 1.425 3.601 ( 1.806 -3.070 -3.695) 5.132 3.649 ( -1.163 0.053 3.024) 3.241 3.957 ( 1.583 -6.177 -0.996) 6.454 4.085 ( 1.002 -2.417 -1.188) 2.873 4.193 ( 1.591 6.180 8.819) 10.886 4.376 ( 4.080 -2.039 1.371) 4.763 4.448 ( 1.283 -1.741 -3.172) 3.839 4.477 ( -2.261 2.330 -2.460) 4.074 4.607 ( -0.421 -3.151 4.818) 5.773 4.840 ( 6.176 -1.835 -10.696) 12.486 5.179 ( 0.470 -2.992 3.940) 4.970 5.400 ( -5.809 2.676 -3.482) 7.282 5.519 ( 0.835 3.214 -5.348) 6.295 5.594 ( 0.271 5.061 0.384) 5.083 5.860 ( 1.992 -3.764 -2.030) 4.717 5.876 ( 2.647 -4.336 -0.236) 5.086 6.146 ( -3.071 -3.915 1.157) 5.109 6.265 ( -1.541 -2.873 0.584) 3.312 6.355 ( 4.380 1.434 -2.626) 5.304 6.530 ( -1.529 2.717 0.643) 3.184 6.669 ( -8.003 -0.833 1.020) 8.110 6.830 ( -3.772 0.913 3.274) 5.078 7.232 ( 1.869 0.819 -3.733) 4.254 7.392 ( -2.313 -1.090 -0.082) 2.558 7.538 ( 9.959 -7.180 4.771) 13.172 7.619 ( 1.874 -7.062 -1.100) 7.388 7.800 ( 8.301 2.112 -1.477) 8.692 8.715 ( -4.160 8.153 1.002) 9.208 8.992 ( -0.631 0.934 0.176) 1.141 9.138 ( 6.295 8.426 -3.834) 11.195 9.235 ( 2.110 5.671 1.281) 6.185 9.353 ( -1.737 -1.019 -3.868) 4.361 9.552 ( -0.915 8.223 2.505) 8.644 9.633 ( -2.587 -0.425 8.558) 8.951 9.756 ( 1.212 -6.852 7.532) 10.254 10.287 ( 4.188 4.024 2.201) 6.211 10.592 ( -4.020 0.817 -0.204) 4.107 10.911 ( -1.705 -1.277 2.775) 3.498 11.047 ( -7.312 -2.015 -1.652) 7.762 11.183 ( 12.920 5.643 -13.073) 19.227 11.410 ( -1.447 5.720 -3.121) 6.675 11.543 ( -7.509 7.897 -2.070) 11.092 11.819 ( 1.221 -0.035 0.917) 1.528 11.853 ( 0.997 -1.119 4.271) 4.526 11.978 ( 0.986 -5.592 -2.091) 6.051 12.091 ( -5.671 0.727 7.160) 9.162 12.491 ( 3.795 -1.392 -5.108) 6.514 12.620 ( 0.360 -0.396 -10.372) 10.386 12.652 ( 8.835 0.832 2.990) 9.365 13.167 ( 3.709 -0.942 -1.105) 3.983 13.416 ( 16.921 -13.245 9.613) 23.541 14.751 ( -1.101 -2.629 7.240) 7.781 14.856 ( -2.736 -8.504 0.080) 8.934 15.140 ( 0.054 1.412 0.665) 1.561 15.245 ( 5.981 8.006 -0.508) 10.006 15.374 ( -8.920 -2.237 -2.298) 9.479 15.438 ( 2.342 -0.998 3.628) 4.432 15.586 ( -1.115 -5.409 -2.331) 5.994 15.737 ( 1.560 -1.402 -3.239) 3.859 16.036 ( 7.368 -1.259 -7.260) 10.420 16.115 ( -9.246 0.118 7.920) 12.175 16.446 ( 3.997 3.133 -1.770) 5.378 16.767 ( 5.104 -0.116 3.465) 6.170 16.912 ( -15.748 -5.691 3.269) 17.061 17.376 ( -16.020 -2.683 6.467) 17.483 18.017 ( -0.267 -0.678 -4.891) 4.945 18.199 ( 0.714 -6.295 -8.803) 10.846 25.680 ( -1.679 2.133 1.093) 2.926 25.749 ( -1.922 1.961 1.035) 2.934 25.819 ( -1.027 -0.617 3.830) 4.013 25.898 ( 0.722 0.467 1.207) 1.482 26.018 ( 0.609 1.385 -0.228) 1.530 26.445 ( 2.577 0.050 -10.872) 11.174 26.642 ( 4.020 -0.386 6.143) 7.352 26.659 ( 0.306 0.245 4.502) 4.519 26.964 ( -2.828 3.633 -3.131) 5.567 27.631 ( 17.130 -6.180 14.403) 23.218 28.104 ( 5.376 2.851 -0.902) 6.152 28.545 ( 4.035 2.191 -2.120) 5.057 28.607 ( 5.148 4.340 -4.386) 8.036 28.736 ( 1.831 12.953 -2.872) 13.393 29.458 ( -8.436 -8.110 4.808) 12.651 29.549 ( -26.767 -9.392 -13.592) 31.455 ======================= Grid point 93 (34/140) ======================= q-point: (-0.11 0.00 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 7.23e-05 7.23e-05 7.23e-05 7.23e-05 7.23e-05 7.23e-05 7.23e-05 7.23e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 243 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.753 ( -6.494 20.818 22.937) 31.649 0.796 ( -11.857 22.526 19.729) 32.206 0.957 ( -14.038 25.678 25.785) 39.004 1.546 ( 3.339 15.698 3.989) 16.537 2.223 ( 0.535 15.948 -1.737) 16.051 2.371 ( 4.350 7.947 4.118) 9.952 2.466 ( -7.167 -1.167 -3.048) 7.875 2.501 ( 10.958 7.491 -10.077) 16.666 2.704 ( -1.614 4.565 5.896) 7.630 2.815 ( -6.205 9.715 0.096) 11.528 2.982 ( -0.858 1.497 3.139) 3.582 3.317 ( 0.107 -6.177 -6.737) 9.141 3.482 ( 0.622 -3.682 -1.990) 4.232 3.619 ( -0.375 -1.009 -1.908) 2.191 3.660 ( -0.175 0.609 3.730) 3.783 3.948 ( -2.864 6.738 2.851) 7.856 4.119 ( -0.174 -3.560 -5.674) 6.701 4.222 ( 3.648 -3.671 3.876) 6.466 4.362 ( 4.667 3.619 -0.995) 5.989 4.481 ( 5.383 -1.378 -0.355) 5.567 4.547 ( 1.475 -5.526 -0.559) 5.747 4.679 ( -7.126 -4.246 4.219) 9.306 4.825 ( 1.304 2.005 -9.567) 9.861 5.243 ( -0.333 -1.897 2.902) 3.483 5.286 ( -4.104 3.506 -0.539) 5.425 5.399 ( -2.527 6.290 1.446) 6.931 5.576 ( 5.035 -0.780 -12.482) 13.482 5.842 ( 3.716 4.744 -5.853) 8.400 6.010 ( 0.860 -7.262 -0.175) 7.315 6.204 ( -3.538 -3.932 3.873) 6.556 6.298 ( 3.754 0.048 -3.438) 5.091 6.392 ( 1.741 -1.518 4.595) 5.143 6.476 ( -3.877 -3.121 6.086) 7.862 6.661 ( -2.872 -0.780 7.200) 7.791 6.842 ( -2.956 -4.730 -0.984) 5.663 7.162 ( 7.743 9.437 -4.726) 13.090 7.356 ( -3.961 1.073 -1.583) 4.398 7.698 ( -1.503 -1.668 -8.530) 8.820 7.763 ( 12.107 -2.774 5.183) 13.459 7.799 ( 3.845 -1.423 0.385) 4.118 8.552 ( -5.866 6.105 1.684) 8.632 8.936 ( -0.976 4.155 -4.301) 6.059 8.999 ( 5.146 9.797 -5.827) 12.506 9.154 ( 1.282 5.424 -1.240) 5.710 9.368 ( -3.165 -3.687 0.357) 4.872 9.443 ( -1.546 2.844 1.238) 3.466 9.773 ( -0.374 -12.524 15.979) 20.306 9.931 ( -0.110 -6.377 7.716) 10.011 10.251 ( 0.005 2.773 3.773) 4.683 10.575 ( 0.721 0.347 3.361) 3.455 10.891 ( -2.016 13.327 -21.546) 25.415 10.969 ( -1.171 -2.201 -0.167) 2.499 11.111 ( 4.021 3.978 1.759) 5.924 11.361 ( -4.874 6.749 3.032) 8.860 11.429 ( 20.851 -2.206 0.623) 20.976 11.819 ( -1.656 0.387 0.787) 1.874 11.907 ( 1.020 -1.700 6.060) 6.377 12.016 ( 0.723 -0.091 0.241) 0.768 12.164 ( -1.230 -8.047 6.167) 10.212 12.494 ( 6.223 1.807 -8.361) 10.578 12.581 ( -3.049 -1.258 -6.598) 7.376 12.714 ( 12.596 3.073 0.980) 13.002 13.145 ( -1.351 6.526 5.303) 8.517 13.845 ( 26.163 -12.992 10.480) 31.035 14.870 ( 1.002 -7.253 5.689) 9.272 14.995 ( -2.476 -8.233 0.091) 8.598 15.068 ( 1.546 6.518 -1.524) 6.870 15.184 ( -1.379 1.113 2.706) 3.234 15.258 ( -15.274 3.423 -6.202) 16.837 15.518 ( -0.054 -4.275 3.069) 5.263 15.676 ( 2.016 -2.281 -0.457) 3.079 15.782 ( 0.140 -9.509 0.239) 9.513 16.032 ( -3.597 -1.231 -0.638) 3.855 16.143 ( 7.327 -0.821 4.759) 8.775 16.416 ( 10.149 4.417 -3.897) 11.735 16.740 ( -0.620 7.251 4.362) 8.484 16.970 ( -14.084 -12.729 0.693) 18.997 17.318 ( -33.549 -8.443 6.545) 35.208 17.987 ( -0.621 0.614 -7.048) 7.102 18.145 ( -8.463 6.352 -21.404) 23.877 25.644 ( -0.495 1.414 1.285) 1.974 25.711 ( -0.462 1.678 -0.016) 1.740 25.896 ( -0.839 -2.251 2.722) 3.630 25.908 ( -3.367 -5.870 7.920) 10.418 25.991 ( 0.723 1.459 0.582) 1.729 26.388 ( 1.913 3.567 -11.035) 11.753 26.638 ( -0.779 0.531 -1.485) 1.758 26.681 ( 1.314 6.144 1.048) 6.370 26.971 ( 0.091 -8.582 7.696) 11.528 27.886 ( -5.131 -6.247 -0.636) 8.109 28.222 ( 30.743 -2.794 13.872) 33.843 28.513 ( 11.138 10.893 -2.278) 15.745 28.586 ( 5.437 2.200 -2.782) 6.492 28.622 ( 31.538 5.918 11.216) 33.992 29.177 ( -59.993 3.744 -33.065) 68.604 29.539 ( -8.953 -4.001 5.233) 11.115 ======================= Grid point 95 (35/140) ======================= q-point: ( 0.11 0.11 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 7.23e-05 7.23e-05 7.23e-05 7.23e-05 7.23e-05 7.23e-05 7.23e-05 7.23e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 135 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.856 ( 14.829 0.000 20.089) 24.969 0.985 ( 15.222 0.000 23.463) 27.968 1.494 ( -0.218 -0.000 7.088) 7.091 1.836 ( 22.199 0.000 37.282) 43.391 1.973 ( -5.218 -0.000 -4.879) 7.144 2.204 ( -9.668 -0.000 -2.689) 10.035 2.397 ( 5.293 0.000 4.054) 6.667 2.496 ( -5.499 -0.000 -1.717) 5.761 2.623 ( 2.277 0.000 1.744) 2.869 2.722 ( 3.764 0.000 1.582) 4.083 3.058 ( 1.275 0.000 7.003) 7.118 3.131 ( -3.612 -0.000 -17.377) 17.748 3.451 ( 0.318 0.000 -8.302) 8.308 3.522 ( -3.038 -0.000 -7.721) 8.297 3.774 ( 2.231 0.000 9.256) 9.521 3.923 ( -2.660 -0.000 4.365) 5.111 4.029 ( -0.703 -0.000 -10.212) 10.236 4.292 ( -6.108 -0.000 2.355) 6.546 4.326 ( -11.512 -0.000 -2.991) 11.894 4.527 ( -0.680 -0.000 -4.862) 4.910 4.606 ( 9.353 0.000 4.252) 10.274 4.617 ( -0.267 -0.000 3.561) 3.571 4.757 ( 1.452 0.000 5.129) 5.331 5.179 ( -6.857 -0.000 -3.508) 7.702 5.297 ( 1.575 0.000 2.682) 3.111 5.417 ( 6.472 0.000 -1.590) 6.665 5.532 ( 12.096 0.000 -9.159) 15.173 5.661 ( -4.222 -0.000 -9.041) 9.979 6.128 ( 2.279 0.000 0.032) 2.280 6.244 ( -2.828 -0.000 6.530) 7.116 6.398 ( 1.524 0.000 -1.264) 1.980 6.504 ( -6.798 -0.000 6.328) 9.288 6.552 ( 11.752 0.000 -0.133) 11.753 6.778 ( -3.062 -0.000 -3.237) 4.456 6.787 ( -0.620 -0.000 0.936) 1.123 7.261 ( -1.003 -0.000 -2.458) 2.654 7.309 ( -8.081 -0.000 -0.097) 8.081 7.388 ( 10.063 0.000 -8.216) 12.990 7.829 ( -9.488 -0.000 1.815) 9.660 7.862 ( -8.954 -0.000 5.365) 10.438 8.522 ( 6.213 0.000 6.037) 8.663 8.783 ( -3.095 -0.000 -6.385) 7.096 8.847 ( -2.349 -0.000 -6.954) 7.339 8.939 ( -5.951 -0.000 -6.275) 8.648 9.414 ( 1.056 0.000 -1.631) 1.943 9.460 ( -6.308 -0.000 1.044) 6.394 9.886 ( -3.749 -0.000 2.461) 4.485 10.126 ( -0.941 -0.000 0.783) 1.224 10.269 ( -3.766 -0.000 7.845) 8.702 10.513 ( 6.729 0.000 7.940) 10.408 10.732 ( 4.581 0.000 4.854) 6.675 10.963 ( 2.276 0.000 -4.117) 4.704 11.197 ( 3.138 0.000 3.120) 4.425 11.371 ( 0.617 0.000 7.284) 7.310 11.694 ( 2.108 0.000 -7.338) 7.635 11.773 ( -2.173 -0.000 -2.317) 3.176 11.967 ( -1.048 -0.000 1.005) 1.452 12.133 ( 6.122 0.000 -2.116) 6.478 12.310 ( 7.780 0.000 -7.036) 10.489 12.340 ( -8.345 -0.000 -5.750) 10.134 12.482 ( -14.441 -0.000 5.256) 15.368 12.839 ( 1.046 0.000 2.718) 2.912 13.052 ( -8.556 -0.000 13.559) 16.033 13.741 ( -24.867 -0.000 10.433) 26.967 14.856 ( -2.837 -0.000 0.492) 2.880 14.992 ( -3.179 -0.000 -1.040) 3.345 15.008 ( 3.406 0.000 1.645) 3.782 15.282 ( 12.096 0.000 -2.239) 12.301 15.372 ( -5.695 -0.000 0.697) 5.737 15.588 ( 8.709 0.000 -1.611) 8.857 15.615 ( 2.469 0.000 -6.920) 7.348 15.863 ( -3.284 -0.000 -0.121) 3.286 15.941 ( -9.298 -0.000 -1.532) 9.423 16.270 ( 1.102 0.000 -7.933) 8.009 16.387 ( -14.572 -0.000 12.299) 19.069 16.483 ( -8.003 -0.000 -0.023) 8.003 17.247 ( 4.282 0.000 6.775) 8.015 17.310 ( 41.185 0.000 -20.061) 45.811 17.715 ( 3.908 0.000 -0.301) 3.920 18.037 ( 3.070 0.000 -1.225) 3.306 25.668 ( 0.536 0.000 1.747) 1.828 25.710 ( 1.153 0.000 0.327) 1.198 25.842 ( -4.577 -0.000 0.847) 4.655 25.907 ( -0.625 -0.000 1.060) 1.230 26.108 ( -2.223 -0.000 6.885) 7.235 26.337 ( 5.492 0.000 2.543) 6.052 26.486 ( -4.527 -0.000 -2.445) 5.145 26.605 ( 0.204 0.000 -2.228) 2.237 27.299 ( 6.349 0.000 6.768) 9.279 27.402 ( -24.269 -0.000 9.530) 26.073 27.868 ( -10.392 -0.000 3.664) 11.019 28.364 ( -2.326 -0.000 -2.182) 3.190 28.441 ( 1.266 0.000 -1.911) 2.292 28.685 ( 1.511 0.000 1.423) 2.076 29.308 ( -9.732 -0.000 -6.869) 11.912 30.456 ( 46.606 0.000 -20.642) 50.973 ======================= Grid point 96 (36/140) ======================= q-point: ( 0.22 0.11 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 7.23e-05 7.23e-05 7.23e-05 7.23e-05 7.23e-05 7.23e-05 7.23e-05 7.23e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 243 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.097 ( 19.031 -5.345 15.366) 25.037 1.354 ( 11.384 -12.995 17.075) 24.290 1.668 ( -2.099 -14.367 0.055) 14.520 1.939 ( -4.742 -5.134 2.199) 7.327 2.159 ( -4.290 -13.053 9.935) 16.956 2.259 ( 10.934 -4.508 4.396) 12.617 2.513 ( -2.221 -7.039 2.343) 7.744 2.612 ( 2.807 -12.594 10.654) 16.733 2.667 ( -2.896 -4.323 3.847) 6.471 2.835 ( 10.975 -6.126 1.296) 12.635 3.036 ( -2.696 -2.449 -17.636) 18.008 3.115 ( 2.815 -0.980 9.147) 9.620 3.402 ( -1.842 1.117 -7.658) 7.955 3.467 ( -1.526 -1.708 -7.712) 8.045 3.789 ( -2.865 7.167 -0.928) 7.774 3.880 ( 2.131 -1.789 6.871) 7.413 3.936 ( -3.818 6.696 -3.877) 8.628 4.186 ( -8.924 5.766 0.960) 10.668 4.254 ( -7.665 -4.232 -5.234) 10.201 4.554 ( 3.606 -2.224 -3.446) 5.462 4.656 ( 0.872 -3.032 3.166) 4.469 4.715 ( 6.895 -0.647 4.430) 8.221 4.817 ( -0.104 -3.616 7.311) 8.157 5.091 ( -4.287 2.174 -4.992) 6.930 5.328 ( 1.637 2.444 -0.762) 3.039 5.403 ( 2.317 -0.139 -7.204) 7.569 5.600 ( 3.829 -2.450 -2.307) 5.098 5.648 ( 5.298 -3.290 -9.307) 11.203 6.093 ( 2.625 5.206 -0.108) 5.832 6.212 ( -1.266 5.172 4.942) 7.265 6.354 ( -2.556 3.005 0.021) 3.945 6.492 ( -5.618 -0.419 2.431) 6.136 6.617 ( 2.754 3.061 -3.992) 5.736 6.737 ( 3.009 2.624 6.807) 7.891 6.759 ( 3.323 0.707 0.716) 3.472 7.226 ( -3.570 -1.019 -1.518) 4.011 7.292 ( -8.081 -2.504 -4.276) 9.479 7.365 ( 6.609 7.177 -4.185) 10.616 7.687 ( -6.986 6.557 3.632) 10.247 7.825 ( -8.309 -0.747 2.050) 8.591 8.655 ( 4.357 -5.742 4.275) 8.380 8.797 ( -4.287 -8.591 -6.185) 11.421 8.828 ( -2.638 -3.785 -2.575) 5.284 8.947 ( -6.264 -8.802 -6.153) 12.433 9.353 ( -4.468 4.543 2.962) 7.028 9.424 ( -7.671 -3.226 -0.831) 8.364 9.905 ( 2.044 -1.349 3.397) 4.188 10.020 ( 0.099 10.095 5.252) 11.380 10.264 ( 0.128 0.089 5.811) 5.813 10.766 ( 3.691 -9.126 3.597) 10.480 10.814 ( 4.748 -4.625 3.412) 7.455 10.976 ( 5.429 -2.067 -5.236) 7.821 11.224 ( 1.822 -0.847 -5.422) 5.782 11.444 ( 1.947 -3.287 8.380) 9.210 11.645 ( 2.257 3.720 -6.188) 7.565 11.746 ( -4.245 -1.793 0.655) 4.654 11.970 ( 3.432 1.674 2.381) 4.500 12.139 ( 2.075 3.028 -1.500) 3.965 12.234 ( -4.876 1.580 -8.217) 9.685 12.308 ( 5.913 4.100 1.992) 7.466 12.375 ( -9.007 1.358 4.209) 10.035 12.896 ( 0.135 -2.201 -4.344) 4.871 13.049 ( -13.015 -1.971 9.742) 16.376 13.629 ( -16.198 1.149 8.201) 18.193 14.770 ( -2.317 5.548 3.745) 7.083 14.958 ( -2.338 1.738 -0.711) 2.999 15.107 ( -0.039 -5.736 -0.102) 5.737 15.233 ( 7.597 11.325 -0.620) 13.651 15.321 ( -6.070 -0.797 1.343) 6.268 15.566 ( 6.944 2.358 -2.400) 7.716 15.698 ( 6.230 -2.771 -6.335) 9.307 15.749 ( 0.454 8.941 -1.310) 9.048 15.877 ( -3.877 -0.665 -0.088) 3.934 16.292 ( -1.805 -0.333 -2.677) 3.246 16.337 ( -10.550 -3.714 2.738) 11.515 16.505 ( -5.847 -6.800 2.045) 9.198 17.205 ( 13.650 14.582 -0.576) 19.983 17.391 ( 14.369 1.487 0.898) 14.474 17.860 ( 6.545 -6.099 -9.785) 13.258 18.073 ( 2.378 -2.000 -1.114) 3.301 25.680 ( 0.388 -0.366 1.215) 1.327 25.740 ( 1.614 -1.922 0.195) 2.518 25.833 ( -2.826 -1.327 2.034) 3.726 25.915 ( -1.079 -0.933 1.137) 1.823 26.102 ( -0.424 2.415 6.371) 6.826 26.392 ( 4.801 -0.521 -1.467) 5.048 26.476 ( -3.723 -2.802 -0.826) 4.732 26.607 ( -0.170 -1.034 -3.711) 3.856 27.219 ( -6.465 6.004 12.954) 15.673 27.400 ( -0.033 -0.265 2.398) 2.412 27.948 ( -9.409 -11.749 1.600) 15.137 28.360 ( -3.312 -4.769 -3.602) 6.833 28.497 ( -0.562 -5.668 -0.891) 5.765 28.692 ( -4.484 -1.687 0.563) 4.824 29.200 ( -2.782 1.587 -7.354) 8.021 30.475 ( 31.120 19.701 -11.090) 38.465 ======================= Grid point 97 (37/140) ======================= q-point: ( 0.33 0.11 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 7.23e-05 7.23e-05 7.23e-05 7.23e-05 7.23e-05 7.23e-05 7.23e-05 7.23e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 243 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.442 ( 18.312 -8.621 11.458) 23.258 1.645 ( -2.964 -9.250 7.946) 12.549 1.854 ( 1.206 -13.287 -2.250) 13.530 2.142 ( 2.314 -12.628 3.702) 13.362 2.371 ( -0.378 -10.196 5.411) 11.549 2.485 ( 2.414 -11.477 9.634) 15.178 2.615 ( -4.878 -7.634 -0.905) 9.105 2.747 ( 0.609 -5.719 -3.685) 6.831 2.840 ( -4.958 -9.252 3.020) 10.923 3.014 ( 0.775 -6.262 -9.352) 11.281 3.038 ( 1.648 -5.710 0.374) 5.955 3.257 ( 6.358 -3.273 8.998) 11.493 3.301 ( -4.765 2.397 -8.187) 9.772 3.523 ( 7.799 -2.153 0.864) 8.137 3.665 ( -4.434 -2.689 -2.939) 5.961 3.727 ( -8.615 9.036 -0.161) 12.486 4.015 ( 0.735 -0.576 7.454) 7.512 4.041 ( 2.160 0.570 -0.271) 2.250 4.270 ( -3.176 -4.714 -3.075) 6.463 4.596 ( 4.027 0.555 2.916) 5.003 4.712 ( 3.059 -1.459 -9.233) 9.835 4.746 ( -3.188 -0.910 4.437) 5.539 4.920 ( -1.993 -1.518 2.017) 3.216 5.024 ( 4.183 2.243 0.182) 4.750 5.232 ( 0.641 3.694 -3.654) 5.235 5.447 ( -1.259 -4.437 -1.247) 4.777 5.639 ( -4.067 -6.170 -6.415) 9.786 5.706 ( 10.150 1.375 -4.417) 11.155 6.034 ( 1.669 3.491 -2.637) 4.682 6.110 ( 2.427 7.163 0.886) 7.615 6.292 ( -1.918 2.915 3.567) 4.990 6.445 ( -8.485 0.510 1.354) 8.608 6.521 ( 0.612 5.583 -0.116) 5.618 6.728 ( 3.980 2.094 1.652) 4.792 6.868 ( 5.409 -2.945 5.080) 7.984 7.107 ( -6.427 6.651 -6.522) 11.317 7.202 ( -5.302 2.424 -3.485) 6.792 7.365 ( -0.074 -2.709 2.475) 3.670 7.567 ( -0.698 5.322 2.702) 6.009 7.795 ( -4.049 0.261 1.426) 4.300 8.751 ( -4.472 -4.592 -1.552) 6.595 8.891 ( -6.692 -8.574 -1.836) 11.030 8.939 ( 2.185 -8.857 1.378) 9.226 9.053 ( -6.317 -12.130 -4.578) 14.422 9.297 ( -2.099 -0.423 4.132) 4.654 9.427 ( -5.840 -3.277 -1.305) 6.823 9.879 ( -0.240 9.576 4.808) 10.718 9.979 ( 2.767 -2.814 3.411) 5.217 10.284 ( 0.774 1.227 2.670) 3.039 10.872 ( 1.352 1.767 0.849) 2.381 10.910 ( 4.658 -4.684 4.947) 8.253 11.103 ( 7.434 -5.237 -2.391) 9.403 11.223 ( 1.492 -4.127 -11.213) 12.042 11.539 ( 2.258 3.293 0.622) 4.041 11.608 ( 4.140 -4.465 -1.219) 6.210 11.771 ( -4.056 -3.379 1.975) 5.637 11.982 ( 4.847 3.478 1.328) 6.112 12.000 ( -3.295 6.712 -2.819) 7.991 12.209 ( 3.371 -0.725 -1.848) 3.912 12.306 ( 1.638 3.178 9.022) 9.705 12.335 ( -0.579 -0.202 -3.180) 3.238 12.819 ( 1.518 7.149 -8.872) 11.495 13.016 ( -16.870 -2.727 6.490) 18.280 13.495 ( -13.721 5.532 5.328) 15.724 14.717 ( -1.155 1.456 5.473) 5.780 14.885 ( -3.563 3.276 -0.113) 4.842 15.101 ( 5.928 8.410 -0.186) 10.291 15.176 ( -3.382 -5.628 -0.018) 6.566 15.353 ( -2.251 -2.705 0.222) 3.526 15.583 ( 5.875 1.294 -0.656) 6.052 15.611 ( 2.219 6.033 1.044) 6.512 15.745 ( 5.705 0.233 -6.784) 8.867 15.849 ( -0.924 0.934 -2.231) 2.589 16.245 ( -3.202 1.605 1.204) 3.779 16.331 ( -10.311 -2.441 0.154) 10.597 16.598 ( -4.410 -7.191 1.939) 8.655 17.082 ( 15.148 12.320 1.511) 19.584 17.477 ( 7.178 0.457 4.073) 8.266 17.882 ( 1.820 0.476 -9.359) 9.546 18.111 ( 1.767 -1.216 -1.509) 2.622 25.705 ( 0.741 -1.414 1.195) 1.994 25.785 ( 0.981 -1.924 -0.835) 2.315 25.856 ( -1.215 -1.762 3.056) 3.731 25.927 ( -1.769 -1.060 0.972) 2.280 26.082 ( -0.285 2.987 4.296) 5.241 26.421 ( 2.032 -1.788 -4.898) 5.596 26.503 ( 0.599 -1.038 2.242) 2.542 26.588 ( -0.906 -0.368 -4.761) 4.860 27.162 ( -4.595 2.356 9.559) 10.864 27.413 ( 4.104 3.309 4.566) 6.974 28.033 ( -6.300 -5.354 0.512) 8.283 28.409 ( -8.661 -7.810 -8.405) 14.376 28.601 ( -3.755 -9.808 -0.211) 10.504 28.698 ( -6.579 -5.144 -2.072) 8.604 29.175 ( 5.164 -0.308 -1.457) 5.374 30.265 ( 22.249 24.450 -3.840) 33.280 ======================= Grid point 98 (38/140) ======================= q-point: ( 0.44 0.11 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 7.23e-05 7.23e-05 7.23e-05 7.23e-05 7.23e-05 7.23e-05 7.23e-05 7.23e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 243 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.692 ( 4.643 -1.776 9.841) 11.025 1.827 ( 3.784 -10.498 5.372) 12.384 2.047 ( 0.530 -8.269 -2.519) 8.660 2.326 ( 0.867 -5.917 0.628) 6.013 2.552 ( -0.196 -7.353 5.485) 9.175 2.657 ( -2.229 -4.724 1.212) 5.362 2.726 ( 2.499 -7.200 1.843) 7.841 2.789 ( -1.085 -2.643 -4.492) 5.323 2.952 ( -4.573 -9.252 -1.015) 10.370 3.033 ( -0.265 1.294 -3.947) 4.162 3.110 ( -3.470 -0.532 -7.324) 8.122 3.255 ( -2.959 -8.616 1.088) 9.175 3.304 ( 0.947 1.682 -2.247) 2.962 3.547 ( -2.389 3.957 3.239) 5.644 3.559 ( -5.002 -0.689 3.933) 6.401 3.800 ( 0.961 -5.027 -0.248) 5.124 3.957 ( -0.043 -0.799 2.431) 2.560 4.209 ( 6.651 -3.355 2.878) 7.986 4.374 ( 7.931 -5.841 4.600) 10.871 4.592 ( 0.102 5.638 4.264) 7.069 4.655 ( 0.498 2.289 -7.503) 7.860 4.775 ( -5.627 -5.677 -6.259) 10.153 4.869 ( 1.008 4.484 -0.247) 4.602 5.011 ( 5.813 3.945 -0.481) 7.041 5.253 ( 1.106 -4.348 1.226) 4.650 5.499 ( -3.536 -4.326 -2.227) 6.015 5.689 ( -0.775 -5.189 -5.915) 7.906 5.726 ( 3.304 -0.004 1.929) 3.826 5.904 ( -2.222 6.536 -4.105) 8.031 6.141 ( 9.849 -1.976 -0.272) 10.049 6.238 ( -3.129 2.596 -1.040) 4.196 6.362 ( -9.705 2.521 7.283) 12.393 6.469 ( 3.839 2.628 -0.344) 4.665 6.751 ( 2.700 -0.708 1.036) 2.977 6.926 ( 0.992 2.371 -2.574) 3.637 7.000 ( -2.739 -2.405 4.493) 5.786 7.077 ( -6.407 4.020 -4.127) 8.616 7.397 ( -5.416 -1.660 1.395) 5.834 7.569 ( 8.898 0.338 4.418) 9.940 7.747 ( -1.603 3.537 0.089) 3.884 8.748 ( -8.763 -2.326 -0.435) 9.077 8.966 ( -3.614 -6.288 0.349) 7.261 9.101 ( 1.254 -7.108 1.084) 7.299 9.165 ( -6.325 -8.771 -2.521) 11.104 9.372 ( 2.918 -0.568 1.508) 3.334 9.448 ( -3.673 -9.425 -1.683) 10.255 9.749 ( -2.480 6.882 3.716) 8.205 10.066 ( 3.289 -2.835 2.297) 4.912 10.245 ( -1.122 4.243 0.249) 4.396 10.829 ( 1.709 4.006 0.080) 4.356 11.054 ( 2.992 -4.002 3.532) 6.119 11.167 ( 2.392 -2.207 -3.269) 4.613 11.295 ( 7.396 -2.975 -5.670) 9.782 11.480 ( -0.786 1.316 -1.844) 2.398 11.653 ( 0.577 5.983 -1.754) 6.261 11.777 ( -5.122 0.596 0.742) 5.209 11.906 ( 3.001 -5.095 -4.108) 7.200 12.033 ( 4.696 -0.520 4.874) 6.788 12.238 ( 2.289 2.973 5.070) 6.308 12.318 ( 5.599 0.459 1.936) 5.942 12.335 ( 3.038 -0.290 -4.218) 5.206 12.667 ( 1.038 5.322 -6.805) 8.701 12.927 ( -14.011 1.366 2.261) 14.258 13.290 ( -13.212 7.736 2.506) 15.514 14.754 ( 1.225 -2.684 3.601) 4.656 14.818 ( -4.058 1.038 0.412) 4.209 15.058 ( 2.673 1.192 1.666) 3.368 15.264 ( -2.562 -5.825 -1.601) 6.562 15.288 ( -0.442 5.807 -0.331) 5.833 15.596 ( 3.347 0.846 0.963) 3.584 15.619 ( 4.698 -0.062 1.352) 4.889 15.708 ( 0.812 3.557 -3.926) 5.360 15.839 ( 3.057 -0.702 -3.508) 4.706 16.192 ( -5.030 1.868 -1.164) 5.490 16.275 ( -9.349 -0.417 4.747) 10.493 16.677 ( -2.976 -4.685 0.516) 5.575 17.051 ( 14.189 7.091 3.592) 16.263 17.513 ( 3.353 2.525 3.348) 5.369 17.822 ( -1.938 0.575 -7.185) 7.464 18.129 ( 1.478 -0.479 -1.688) 2.294 25.747 ( 0.672 -1.742 1.631) 2.479 25.804 ( -0.275 -0.794 -0.803) 1.162 25.899 ( 0.540 -1.586 2.698) 3.176 25.929 ( -2.209 -0.777 0.160) 2.347 26.034 ( -0.763 4.030 1.679) 4.432 26.437 ( 1.584 -1.914 -7.327) 7.737 26.523 ( 1.572 0.645 2.212) 2.790 26.592 ( -0.144 -1.839 0.448) 1.899 27.165 ( -1.175 -1.011 5.527) 5.740 27.372 ( 2.508 7.202 4.138) 8.677 28.064 ( -4.416 -3.400 0.365) 5.585 28.409 ( -8.615 -6.651 -8.561) 13.848 28.707 ( -4.468 -5.223 -4.436) 8.180 28.781 ( -4.466 -11.932 -0.374) 12.745 29.253 ( 5.173 -2.523 3.465) 6.718 29.987 ( 15.499 24.335 -1.046) 28.870 ======================= Grid point 99 (39/140) ======================= q-point: (-0.44 0.11 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 7.23e-05 7.23e-05 7.23e-05 7.23e-05 7.23e-05 7.23e-05 7.23e-05 7.23e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 243 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.694 ( -6.414 5.569 8.666) 12.135 1.985 ( 4.152 0.758 0.574) 4.259 2.134 ( 0.498 -2.691 2.334) 3.596 2.378 ( 1.395 -1.172 2.950) 3.467 2.611 ( -5.609 -0.524 -8.385) 10.102 2.693 ( 3.921 3.069 3.101) 5.866 2.805 ( 0.203 -3.041 0.252) 3.058 2.875 ( -0.496 5.135 -5.080) 7.240 2.892 ( -0.482 -9.388 -4.958) 10.627 3.051 ( -0.932 -1.490 -1.543) 2.339 3.113 ( -2.950 -3.972 -0.171) 4.950 3.267 ( -0.907 -0.391 0.953) 1.372 3.396 ( -2.805 -6.247 2.380) 7.250 3.487 ( -2.585 0.101 0.347) 2.610 3.632 ( 4.119 -4.889 1.571) 6.583 3.804 ( -0.801 2.008 -0.320) 2.185 4.029 ( -5.390 -5.522 5.835) 9.675 4.303 ( 6.492 0.392 7.119) 9.643 4.444 ( -2.426 8.478 0.300) 8.823 4.495 ( 5.335 6.320 3.518) 8.988 4.600 ( -1.306 -1.472 -8.945) 9.159 4.752 ( 0.617 1.095 -6.615) 6.734 4.850 ( 2.912 -0.137 -0.931) 3.060 5.019 ( 5.161 0.600 0.772) 5.252 5.357 ( -1.554 -6.519 0.427) 6.715 5.497 ( -1.161 -2.073 -8.697) 9.016 5.734 ( 0.730 -1.115 0.979) 1.654 5.788 ( 0.112 -2.514 3.517) 4.324 5.800 ( -0.125 2.863 0.430) 2.898 6.132 ( -5.465 1.845 -1.576) 5.980 6.274 ( 9.425 -2.220 -2.339) 9.962 6.295 ( -6.371 2.228 5.611) 8.777 6.490 ( 4.499 -1.245 0.461) 4.690 6.795 ( -0.911 -2.479 0.649) 2.719 6.873 ( -4.309 1.499 1.268) 4.735 6.964 ( -2.228 0.934 -4.804) 5.377 7.098 ( -0.013 -6.459 5.194) 8.288 7.381 ( -3.384 -0.571 0.630) 3.489 7.633 ( -0.147 4.649 2.090) 5.099 7.704 ( 8.845 -0.741 0.679) 8.902 8.709 ( -8.785 -1.716 1.139) 9.023 9.071 ( 1.578 -6.796 1.950) 7.244 9.189 ( -0.369 -3.057 -0.122) 3.082 9.237 ( -2.536 -4.831 -2.210) 5.887 9.344 ( 2.460 3.303 -1.643) 4.434 9.638 ( -3.208 -9.631 -1.864) 10.321 9.653 ( -1.855 2.029 6.187) 6.770 10.108 ( -0.045 7.407 3.593) 8.233 10.162 ( 0.677 -1.872 -3.065) 3.655 10.770 ( 1.524 4.789 0.511) 5.051 11.070 ( -1.650 0.831 -3.708) 4.143 11.184 ( 1.274 4.686 2.519) 5.471 11.366 ( 6.095 -1.037 -7.631) 9.821 11.473 ( 1.651 1.756 0.575) 2.478 11.536 ( -1.000 -0.855 1.881) 2.295 11.734 ( -6.388 -0.938 0.627) 6.487 11.988 ( 1.523 1.229 -4.946) 5.319 12.070 ( 1.979 2.528 3.402) 4.678 12.252 ( 6.999 1.491 7.174) 10.133 12.330 ( 2.613 -0.600 -1.296) 2.977 12.389 ( 4.002 -3.188 -3.661) 6.291 12.631 ( 1.526 -2.282 -6.582) 7.131 12.813 ( -5.261 0.808 -0.586) 5.355 13.104 ( -10.343 3.620 2.629) 11.269 14.765 ( -3.222 1.175 -0.518) 3.469 14.853 ( 0.945 -3.834 3.445) 5.240 15.097 ( 1.460 -0.375 1.650) 2.235 15.148 ( 0.641 3.574 -2.431) 4.370 15.375 ( -1.802 -5.821 2.028) 6.423 15.587 ( 2.625 3.481 -1.355) 4.565 15.627 ( 3.658 4.885 -2.565) 6.620 15.659 ( 2.562 -0.045 0.192) 2.570 15.873 ( 1.264 -2.511 -1.329) 3.109 16.107 ( -7.967 0.102 -0.657) 7.995 16.275 ( -6.148 -2.945 6.744) 9.589 16.713 ( -0.568 -1.562 -1.306) 2.114 17.062 ( 8.945 5.750 4.465) 11.533 17.480 ( 0.070 3.952 1.254) 4.146 17.799 ( -2.256 -3.587 -4.324) 6.054 18.135 ( 1.318 -0.021 -2.048) 2.436 25.762 ( -1.660 0.724 1.595) 2.413 25.825 ( 1.178 -1.650 0.122) 2.031 25.902 ( -1.572 1.027 0.745) 2.021 25.953 ( -0.144 1.710 1.492) 2.274 25.962 ( -0.307 0.236 -1.187) 1.248 26.439 ( 2.534 -1.084 -8.067) 8.525 26.551 ( 1.095 -0.562 5.477) 5.613 26.628 ( 0.222 -1.485 1.593) 2.189 27.201 ( -0.036 -0.968 -8.446) 8.501 27.298 ( 2.137 4.649 13.688) 14.613 28.084 ( -2.529 -2.443 -0.922) 3.636 28.432 ( -5.451 -6.356 -5.079) 9.793 28.718 ( -1.672 -2.222 -5.027) 5.745 28.949 ( -3.997 -11.471 0.430) 12.155 29.330 ( 1.086 -0.406 2.823) 3.052 29.700 ( 9.385 20.219 0.384) 22.294 ======================= Grid point 100 (40/140) ======================= q-point: (-0.33 0.11 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 7.23e-05 7.23e-05 7.23e-05 7.23e-05 7.23e-05 7.23e-05 7.23e-05 7.23e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 243 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.520 ( -12.153 10.883 9.832) 19.047 1.853 ( -0.663 15.163 2.846) 15.442 2.165 ( 1.961 4.970 7.309) 9.054 2.417 ( 4.708 7.223 0.144) 8.623 2.465 ( -3.541 2.100 -6.653) 7.824 2.593 ( -1.357 5.726 -6.661) 8.888 2.779 ( 2.617 4.855 -4.546) 7.147 2.892 ( 1.499 -3.806 2.800) 4.957 2.998 ( 0.492 1.961 -1.376) 2.445 3.038 ( -0.685 -3.962 -4.779) 6.245 3.138 ( -1.569 -3.664 -0.668) 4.041 3.314 ( 1.772 2.707 6.892) 7.614 3.429 ( -1.789 -5.136 0.344) 5.450 3.514 ( -2.973 -1.917 1.571) 3.871 3.701 ( 0.009 5.189 -0.525) 5.215 3.814 ( 5.060 -6.381 -0.186) 8.145 4.119 ( -7.652 -6.192 8.412) 12.948 4.221 ( -5.124 9.070 -0.619) 10.436 4.363 ( 0.924 4.492 3.990) 6.078 4.421 ( 7.415 4.495 3.259) 9.264 4.557 ( -4.623 1.400 -3.101) 5.740 4.753 ( 6.411 -1.967 -8.602) 10.907 4.812 ( 3.444 6.061 -5.304) 8.760 5.073 ( 2.551 -2.122 2.888) 4.399 5.410 ( -3.075 -2.608 -3.427) 5.291 5.504 ( 2.810 -2.691 -7.670) 8.600 5.727 ( -2.711 0.470 -0.329) 2.771 5.787 ( 0.663 1.784 2.677) 3.285 5.840 ( 1.440 -0.198 6.742) 6.897 6.083 ( -2.767 -0.275 -0.660) 2.858 6.232 ( -5.761 1.218 1.701) 6.129 6.357 ( 7.752 -1.325 -2.145) 8.152 6.552 ( 4.968 -0.973 -1.348) 5.239 6.736 ( -9.149 3.127 -0.770) 9.700 6.872 ( -2.600 -0.593 3.911) 4.733 7.005 ( 1.735 -7.670 -2.084) 8.135 7.258 ( 0.240 -8.988 3.854) 9.783 7.381 ( -0.727 -1.703 0.642) 1.960 7.538 ( -0.136 4.493 -1.522) 4.746 7.802 ( 6.708 -1.501 -0.184) 6.876 8.704 ( -5.854 -3.529 3.299) 7.590 9.188 ( -1.169 0.493 0.443) 1.344 9.217 ( 3.013 -1.174 -2.851) 4.311 9.267 ( 7.203 -0.944 -0.175) 7.267 9.331 ( -0.144 -1.674 1.367) 2.166 9.579 ( -6.393 0.774 3.836) 7.496 9.766 ( 1.036 -0.599 1.142) 1.655 9.929 ( -2.935 10.673 0.773) 11.096 10.237 ( 2.065 -4.755 0.270) 5.191 10.698 ( 0.782 5.517 2.538) 6.122 11.009 ( -3.814 1.115 -4.551) 6.042 11.067 ( -3.628 8.097 2.751) 9.289 11.295 ( 6.858 4.901 -7.281) 11.138 11.535 ( 1.045 -0.019 1.554) 1.873 11.618 ( 0.437 -7.289 -0.804) 7.346 11.745 ( -3.820 -4.475 1.681) 6.119 11.856 ( -0.801 8.187 -0.913) 8.276 12.020 ( 1.880 7.538 0.279) 7.774 12.209 ( -4.170 4.941 3.824) 7.511 12.408 ( 1.524 -3.235 -4.888) 6.056 12.512 ( 4.402 -8.477 0.949) 9.599 12.599 ( -0.614 -0.690 -13.078) 13.110 12.932 ( 8.804 -10.508 2.839) 14.000 13.064 ( -3.244 -3.207 5.678) 7.284 14.711 ( -4.430 1.671 1.533) 4.977 14.878 ( 0.956 3.372 1.463) 3.798 15.098 ( 3.816 -2.022 -0.131) 4.320 15.207 ( -1.856 -5.846 0.199) 6.137 15.438 ( -2.332 -2.732 0.135) 3.595 15.527 ( 1.338 4.411 0.757) 4.671 15.549 ( 4.890 7.055 -1.494) 8.713 15.686 ( 3.569 -0.865 -2.712) 4.565 15.931 ( 2.281 -3.878 -1.340) 4.695 16.073 ( -8.268 -2.832 0.828) 8.778 16.335 ( -6.796 -5.693 8.011) 11.949 16.714 ( 1.412 0.456 -2.904) 3.261 17.024 ( 2.326 6.427 4.235) 8.041 17.410 ( -2.853 3.337 0.731) 4.450 17.858 ( -0.398 -6.357 -3.694) 7.363 18.132 ( 1.466 0.137 -2.717) 3.091 25.734 ( -2.148 1.413 1.783) 3.129 25.834 ( -0.697 1.888 -0.132) 2.017 25.877 ( -0.028 3.153 0.586) 3.207 25.895 ( -0.142 -0.345 0.422) 0.564 26.003 ( 0.563 -2.005 0.044) 2.083 26.434 ( 2.228 -0.613 -7.702) 8.041 26.611 ( 2.267 -0.953 8.611) 8.955 26.655 ( -0.504 -1.042 0.673) 1.339 27.103 ( -1.409 3.882 -9.436) 10.300 27.405 ( 3.309 -4.727 10.790) 12.236 28.104 ( 0.926 -1.570 -1.067) 2.112 28.477 ( -2.258 -4.470 -1.090) 5.125 28.711 ( 1.356 0.012 -4.659) 4.853 29.092 ( -1.626 -6.210 -0.592) 6.447 29.254 ( -2.478 8.069 0.109) 8.442 29.515 ( 0.466 6.948 1.426) 7.108 ======================= Grid point 101 (41/140) ======================= q-point: (-0.22 0.11 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 7.23e-05 7.23e-05 7.23e-05 7.23e-05 7.23e-05 7.23e-05 7.23e-05 7.23e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 243 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.262 ( -14.927 14.082 14.367) 25.051 1.569 ( 0.875 21.756 11.950) 24.837 1.967 ( -2.252 20.746 3.963) 21.241 2.216 ( 3.412 16.710 0.572) 17.064 2.459 ( 0.827 3.917 -6.660) 7.770 2.485 ( 1.603 -1.133 -0.052) 1.964 2.675 ( 2.589 8.237 -4.974) 9.965 2.885 ( 0.302 5.810 -6.376) 8.631 2.974 ( 2.073 -0.438 -0.662) 2.220 3.058 ( 0.636 2.415 5.095) 5.675 3.130 ( 1.453 6.534 2.233) 7.057 3.291 ( -3.677 2.526 0.929) 4.557 3.445 ( -3.056 5.550 2.639) 6.863 3.541 ( -1.533 -3.521 -0.248) 3.848 3.636 ( 1.418 -1.738 0.617) 2.326 3.904 ( 1.370 -1.066 -0.766) 1.897 4.054 ( 0.215 1.866 -1.762) 2.575 4.242 ( -8.868 -2.210 4.885) 10.363 4.313 ( -6.464 -6.470 -3.123) 9.664 4.461 ( 4.491 4.499 6.300) 8.950 4.496 ( 5.426 1.021 5.240) 7.611 4.696 ( 2.931 6.572 -4.308) 8.387 4.798 ( 6.297 -2.604 -10.932) 12.882 5.143 ( 0.170 -2.826 2.980) 4.111 5.389 ( -1.050 0.532 -2.833) 3.068 5.518 ( 2.596 -0.041 -8.645) 9.027 5.696 ( -2.424 5.829 2.083) 6.648 5.743 ( -1.644 -2.772 -0.087) 3.224 5.899 ( 1.808 -1.335 3.323) 4.012 6.081 ( -1.640 -1.709 -0.192) 2.376 6.204 ( -2.710 -2.196 -0.306) 3.502 6.419 ( 7.277 0.421 -1.551) 7.452 6.580 ( 2.286 2.041 -0.463) 3.099 6.610 ( -5.120 1.782 -0.976) 5.508 6.845 ( -5.588 1.942 4.071) 7.182 7.150 ( 0.312 -7.826 -3.003) 8.388 7.350 ( -1.159 -2.171 -2.036) 3.194 7.470 ( -3.332 -5.781 -2.172) 7.017 7.541 ( 6.510 -5.520 6.223) 10.563 7.834 ( 1.149 -0.284 -5.388) 5.517 8.751 ( -1.646 -1.212 4.301) 4.762 9.098 ( 1.605 7.915 3.571) 8.830 9.213 ( 1.643 0.707 -4.787) 5.110 9.284 ( -0.614 3.472 -5.002) 6.120 9.399 ( 4.098 -1.383 3.722) 5.706 9.628 ( -7.931 0.758 0.924) 8.020 9.651 ( 3.891 1.260 3.050) 5.102 9.796 ( -1.115 7.513 9.073) 11.833 10.315 ( -0.826 -2.668 -1.340) 3.097 10.642 ( 2.325 4.416 5.619) 7.516 10.920 ( -4.456 3.228 2.372) 5.992 10.967 ( -2.325 0.788 -3.837) 4.555 11.274 ( 9.494 1.941 -6.196) 11.501 11.482 ( -0.681 4.457 -1.777) 4.846 11.622 ( -3.216 6.895 -1.352) 7.728 11.787 ( 1.253 -5.807 -1.565) 6.143 11.877 ( 0.344 -4.916 3.705) 6.165 11.908 ( 2.007 5.389 0.568) 5.779 12.101 ( -8.188 3.284 4.334) 9.829 12.440 ( 0.273 -3.112 -6.082) 6.837 12.540 ( -1.170 -1.190 -11.541) 11.661 12.683 ( 7.034 -5.513 -2.019) 9.163 13.115 ( -0.353 -6.010 2.323) 6.453 13.317 ( 10.947 -15.995 9.579) 21.620 14.676 ( -5.865 -1.272 4.271) 7.366 14.840 ( 1.125 1.667 1.210) 2.347 15.164 ( 2.948 -0.412 0.172) 2.982 15.258 ( -6.332 -3.809 -1.374) 7.516 15.434 ( -0.453 2.752 -1.525) 3.179 15.450 ( 5.783 4.340 -2.634) 7.695 15.518 ( 0.038 -0.298 4.047) 4.058 15.713 ( 3.556 -1.118 -4.733) 6.025 16.035 ( 7.632 -4.715 -1.189) 9.050 16.056 ( -8.478 -1.495 2.297) 8.910 16.421 ( -7.400 -6.014 7.001) 11.830 16.697 ( -0.085 0.110 -3.148) 3.151 16.937 ( -2.324 5.930 4.126) 7.589 17.334 ( -4.696 3.041 1.787) 5.873 17.938 ( 0.751 -4.831 -5.796) 7.582 18.132 ( 1.917 -0.707 -4.412) 4.862 25.704 ( -1.783 1.500 1.957) 3.043 25.783 ( -0.832 2.849 0.802) 3.074 25.837 ( -0.185 1.467 1.124) 1.857 25.914 ( 0.523 -0.170 1.827) 1.908 26.028 ( 0.188 -0.515 -0.421) 0.691 26.416 ( 1.687 0.154 -7.426) 7.617 26.654 ( -0.847 0.041 -0.974) 1.291 26.707 ( 2.903 -1.874 11.461) 11.970 26.979 ( -1.965 3.827 -9.198) 10.154 27.570 ( -2.277 -8.873 3.795) 9.916 28.151 ( 4.160 -1.704 1.488) 4.735 28.554 ( 4.708 -2.991 4.879) 7.411 28.704 ( 6.862 1.084 -4.019) 8.026 28.961 ( 2.022 14.240 -2.635) 14.622 29.251 ( -8.082 -5.944 -2.075) 10.245 29.408 ( -6.807 3.149 -0.189) 7.503 ======================= Grid point 102 (42/140) ======================= q-point: (-0.11 0.11 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 7.23e-05 7.23e-05 7.23e-05 7.23e-05 7.23e-05 7.23e-05 7.23e-05 7.23e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 243 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.971 ( -14.529 16.124 18.980) 28.832 1.284 ( 2.706 23.298 18.261) 29.725 1.598 ( 7.843 26.980 16.335) 32.500 1.934 ( 3.479 20.738 6.094) 21.893 2.348 ( -6.973 1.869 -8.404) 11.078 2.474 ( -1.126 11.257 -4.006) 12.001 2.531 ( 8.761 4.323 -0.636) 9.790 2.735 ( 4.166 11.667 -2.913) 12.727 2.851 ( 0.079 13.286 2.244) 13.474 2.978 ( -4.012 8.598 1.460) 9.600 3.054 ( -2.158 10.654 4.374) 11.718 3.185 ( -0.249 -5.366 -0.966) 5.458 3.435 ( -0.311 -2.412 -2.156) 3.250 3.557 ( -1.126 -2.998 -4.853) 5.815 3.699 ( 1.080 -0.113 5.705) 5.807 3.958 ( -0.762 -1.759 -2.147) 2.879 4.032 ( -3.006 -2.260 -6.690) 7.674 4.166 ( -6.495 -2.902 -0.337) 7.122 4.398 ( -0.459 -3.750 2.871) 4.745 4.467 ( 1.583 -0.142 4.147) 4.441 4.597 ( 4.659 -0.994 5.960) 7.630 4.611 ( 1.259 4.237 -0.041) 4.420 4.817 ( 4.852 -0.442 -10.999) 12.030 5.188 ( -4.140 -2.540 2.379) 5.409 5.365 ( 4.345 2.903 0.732) 5.277 5.458 ( -1.193 2.820 -7.622) 8.214 5.560 ( -0.665 4.856 -5.482) 7.354 5.845 ( -0.310 -5.627 -1.747) 5.900 5.923 ( 2.065 -1.119 -1.043) 2.570 6.119 ( -2.373 -4.361 1.779) 5.274 6.275 ( 2.241 -5.888 0.594) 6.328 6.418 ( 2.029 1.890 -0.270) 2.786 6.516 ( 3.878 4.413 3.192) 6.686 6.640 ( 0.482 -2.967 1.059) 3.187 6.779 ( -6.884 1.169 2.684) 7.480 7.218 ( 2.689 -2.165 -5.200) 6.241 7.340 ( -2.125 0.294 -2.967) 3.661 7.536 ( -4.893 -7.714 -4.665) 10.257 7.747 ( 4.983 -6.550 5.584) 9.945 7.792 ( -4.790 -0.947 -4.698) 6.776 8.685 ( 0.109 9.586 2.652) 9.947 9.022 ( 2.699 6.508 -0.610) 7.072 9.107 ( -2.497 7.133 -7.595) 10.715 9.247 ( -0.622 -3.230 -0.004) 3.290 9.345 ( -0.944 10.734 -3.554) 11.346 9.524 ( 1.843 1.775 3.588) 4.407 9.735 ( -2.507 0.488 13.801) 14.035 9.829 ( -3.819 -7.865 8.050) 11.885 10.290 ( -3.426 1.846 -0.418) 3.915 10.640 ( 4.474 2.658 6.192) 8.089 10.894 ( -1.451 0.892 -1.140) 2.049 10.937 ( 1.521 -0.610 -3.627) 3.980 11.246 ( 4.769 6.341 -4.234) 8.994 11.459 ( 0.679 4.528 2.388) 5.164 11.488 ( 7.890 -0.221 -3.267) 8.543 11.833 ( 1.696 1.419 -1.566) 2.710 11.878 ( -2.442 -1.790 1.940) 3.596 11.977 ( 0.121 -4.567 1.074) 4.693 12.089 ( -1.906 -3.825 7.130) 8.312 12.451 ( -2.575 -3.083 -8.020) 8.970 12.494 ( -1.201 -0.744 -8.744) 8.858 12.799 ( 7.819 -2.617 -1.478) 8.377 13.192 ( -1.998 -1.687 2.575) 3.670 13.724 ( 5.145 -17.294 8.399) 19.902 14.718 ( -8.752 -6.465 8.270) 13.667 14.862 ( -1.007 -4.025 0.063) 4.150 15.123 ( -3.929 3.848 -0.645) 5.537 15.214 ( -0.814 3.862 -4.376) 5.893 15.380 ( 6.429 4.997 3.223) 8.757 15.448 ( -1.591 -1.845 -1.520) 2.871 15.590 ( 1.194 -6.504 0.417) 6.626 15.727 ( 2.690 -0.429 -5.351) 6.005 16.010 ( -7.012 0.794 1.733) 7.266 16.190 ( 10.566 -4.254 2.422) 11.645 16.486 ( 1.671 -2.919 2.186) 4.011 16.673 ( -10.728 -2.155 -0.410) 10.950 16.841 ( -4.766 4.115 4.170) 7.553 17.255 ( -2.605 3.996 2.686) 5.474 17.958 ( 1.998 -0.447 -8.506) 8.749 18.126 ( 1.913 0.823 -8.039) 8.305 25.675 ( -0.715 1.655 1.604) 2.413 25.741 ( -0.115 2.247 0.942) 2.440 25.845 ( -1.556 -1.383 4.940) 5.361 25.922 ( 0.054 0.650 2.268) 2.359 26.020 ( 0.179 1.014 -0.091) 1.034 26.384 ( 1.619 0.952 -6.831) 7.084 26.629 ( -1.706 0.669 -2.387) 3.009 26.783 ( 0.830 4.036 -0.210) 4.126 26.906 ( 0.007 -3.499 4.770) 5.916 27.659 ( -12.727 -7.986 -3.954) 15.537 28.211 ( -3.218 -2.460 1.812) 4.437 28.625 ( 3.851 1.538 0.414) 4.167 28.685 ( -0.400 9.458 -2.815) 9.876 28.875 ( -0.060 5.554 5.457) 7.786 29.150 ( 20.379 -0.219 -5.965) 21.235 29.412 ( -3.768 -5.499 1.361) 6.804 ======================= Grid point 105 (43/140) ======================= q-point: ( 0.22 0.22 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 7.23e-05 7.23e-05 7.23e-05 7.23e-05 7.23e-05 7.23e-05 7.23e-05 7.23e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 135 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.302 ( 19.134 0.000 5.380) 19.876 1.404 ( 11.038 0.000 16.542) 19.886 1.526 ( 4.032 0.000 1.468) 4.291 1.836 ( -3.838 -0.000 -4.612) 6.000 1.985 ( -13.718 -0.000 10.450) 17.245 2.344 ( 10.130 0.000 2.079) 10.341 2.386 ( -7.250 -0.000 -2.263) 7.595 2.629 ( -5.677 -0.000 8.811) 10.481 2.704 ( 11.714 0.000 19.794) 23.001 2.876 ( 12.205 0.000 -1.243) 12.268 2.892 ( -1.382 -0.000 -18.083) 18.136 3.191 ( 5.585 0.000 14.752) 15.774 3.368 ( -6.449 -0.000 -8.304) 10.514 3.371 ( 0.578 0.000 -7.218) 7.242 3.880 ( -3.632 -0.000 -3.290) 4.901 3.890 ( 0.542 0.000 -5.018) 5.047 3.928 ( 2.479 0.000 2.117) 3.260 4.123 ( -11.675 -0.000 1.725) 11.802 4.196 ( -6.280 -0.000 -0.740) 6.324 4.466 ( -2.111 -0.000 -5.712) 6.090 4.671 ( 1.707 0.000 2.547) 3.066 4.800 ( -2.282 -0.000 5.946) 6.369 4.803 ( 6.103 0.000 5.579) 8.269 5.074 ( 1.130 0.000 -2.870) 3.085 5.384 ( 5.185 0.000 1.658) 5.443 5.397 ( 2.464 0.000 -10.446) 10.733 5.491 ( -5.990 -0.000 -7.593) 9.671 5.706 ( 12.771 0.000 -2.474) 13.008 6.165 ( 1.981 0.000 1.150) 2.291 6.288 ( 0.866 0.000 6.561) 6.618 6.311 ( -8.272 -0.000 -5.467) 9.915 6.472 ( -4.536 -0.000 5.697) 7.283 6.658 ( 3.920 0.000 -4.300) 5.819 6.784 ( 2.668 0.000 2.538) 3.682 6.813 ( 2.744 0.000 0.921) 2.894 7.164 ( -6.154 -0.000 2.623) 6.689 7.220 ( -2.699 -0.000 -0.563) 2.757 7.495 ( 6.289 0.000 -4.250) 7.590 7.632 ( -16.211 -0.000 -0.841) 16.233 7.782 ( -3.821 -0.000 1.709) 4.186 8.639 ( -6.167 -0.000 -7.308) 9.562 8.666 ( 2.038 0.000 3.226) 3.816 8.795 ( -5.903 -0.000 -2.984) 6.614 8.799 ( 2.256 0.000 3.880) 4.489 9.262 ( -14.811 -0.000 -0.183) 14.812 9.444 ( 4.063 0.000 -0.720) 4.127 9.894 ( 0.592 0.000 -2.572) 2.639 10.125 ( -0.116 -0.000 0.922) 0.929 10.305 ( -1.868 -0.000 7.099) 7.340 10.702 ( 5.300 0.000 10.062) 11.373 10.842 ( 4.271 0.000 3.304) 5.400 10.973 ( 5.194 0.000 -5.536) 7.592 11.192 ( -0.023 -0.000 -10.054) 10.054 11.488 ( 3.183 0.000 11.530) 11.961 11.665 ( 2.514 0.000 -5.210) 5.785 11.687 ( -5.350 -0.000 -1.901) 5.678 12.045 ( 5.563 0.000 6.639) 8.661 12.134 ( -2.813 -0.000 -1.985) 3.443 12.173 ( -5.146 -0.000 -7.337) 8.962 12.355 ( -8.283 -0.000 6.376) 10.453 12.398 ( 8.413 0.000 -1.116) 8.487 12.803 ( -11.716 -0.000 6.777) 13.535 13.013 ( -5.013 -0.000 -1.317) 5.184 13.585 ( -8.524 -0.000 6.392) 10.654 14.835 ( -1.267 -0.000 1.343) 1.846 14.928 ( -3.473 -0.000 -0.682) 3.540 15.082 ( 3.237 0.000 1.621) 3.620 15.203 ( -12.327 -0.000 1.968) 12.483 15.448 ( 7.808 0.000 -1.356) 7.925 15.618 ( 5.708 0.000 -5.050) 7.622 15.698 ( 8.520 0.000 -5.199) 9.981 15.806 ( -3.395 -0.000 -0.906) 3.514 15.868 ( 0.951 0.000 -0.225) 0.977 16.172 ( -4.715 -0.000 -4.674) 6.639 16.349 ( -4.975 -0.000 7.539) 9.032 16.380 ( -4.431 -0.000 -0.933) 4.528 17.371 ( 3.211 0.000 7.310) 7.984 17.590 ( 20.627 0.000 -15.718) 25.933 17.795 ( 4.894 0.000 0.587) 4.929 18.071 ( 2.235 0.000 -0.650) 2.327 25.686 ( 0.362 0.000 0.467) 0.591 25.734 ( 1.696 0.000 0.002) 1.696 25.811 ( -1.859 -0.000 1.988) 2.722 25.903 ( -1.228 -0.000 1.158) 1.688 26.147 ( -1.015 -0.000 5.281) 5.377 26.378 ( -1.319 -0.000 -5.001) 5.172 26.471 ( 3.178 0.000 5.512) 6.363 26.592 ( 0.613 0.000 -1.585) 1.699 27.222 ( -10.408 -0.000 4.521) 11.348 27.492 ( 7.765 0.000 9.984) 12.648 27.769 ( -6.748 -0.000 3.166) 7.454 28.311 ( -2.502 -0.000 -0.829) 2.636 28.444 ( 0.870 0.000 -0.981) 1.311 28.598 ( -12.444 -0.000 -5.367) 13.552 29.180 ( 3.485 0.000 -5.024) 6.114 30.780 ( 21.525 0.000 -14.280) 25.831 ======================= Grid point 106 (44/140) ======================= q-point: ( 0.33 0.22 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 7.23e-05 7.23e-05 7.23e-05 7.23e-05 7.23e-05 7.23e-05 7.23e-05 7.23e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 243 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.476 ( -0.551 -9.290 -8.293) 12.466 1.530 ( 10.578 -3.978 12.479) 16.835 1.725 ( 13.407 -7.431 8.217) 17.392 1.921 ( 0.214 -12.092 -3.278) 12.530 2.133 ( -6.388 -18.416 12.856) 23.350 2.359 ( -6.433 -5.056 -4.625) 9.398 2.449 ( 4.723 -5.334 -1.174) 7.220 2.653 ( -5.682 -3.377 5.701) 8.729 2.811 ( 0.388 0.420 7.783) 7.804 2.856 ( 0.757 -5.445 -10.126) 11.521 3.005 ( 7.887 -2.468 0.074) 8.265 3.256 ( -5.806 1.737 -7.847) 9.915 3.301 ( 1.682 -0.921 2.967) 3.533 3.480 ( 11.152 -7.845 11.018) 17.530 3.686 ( -3.660 8.172 -6.531) 11.083 3.860 ( -3.496 7.941 0.441) 8.688 4.031 ( 4.741 -3.617 8.249) 10.179 4.048 ( -5.647 -0.103 -0.761) 5.699 4.120 ( -4.052 -3.145 -5.012) 7.172 4.512 ( -3.924 -8.392 -5.684) 10.869 4.675 ( 0.060 1.167 0.071) 1.170 4.800 ( 1.952 2.489 0.680) 3.236 4.871 ( -0.467 -3.015 0.739) 3.139 5.107 ( 6.506 0.155 5.761) 8.691 5.307 ( -0.293 4.909 -5.089) 7.077 5.413 ( 2.440 -0.369 -2.828) 3.753 5.469 ( -3.380 -3.712 -5.846) 7.706 5.784 ( 9.549 0.483 -2.440) 9.868 6.108 ( -2.421 6.011 -2.006) 6.784 6.204 ( -1.437 2.679 -1.789) 3.528 6.328 ( -0.102 1.067 4.555) 4.679 6.441 ( -2.645 2.984 4.456) 5.979 6.625 ( 2.457 4.158 -2.400) 5.393 6.801 ( 2.831 1.754 -0.906) 3.452 6.866 ( 1.747 -3.683 5.822) 7.108 7.134 ( -3.586 4.424 -2.240) 6.120 7.185 ( -4.937 1.304 -0.374) 5.120 7.337 ( -8.031 3.938 1.906) 9.145 7.677 ( -4.015 -7.732 -1.369) 8.820 7.710 ( 0.665 6.099 0.088) 6.136 8.639 ( -6.167 -7.849 -5.213) 11.261 8.689 ( -2.656 -2.645 1.393) 3.999 8.814 ( -5.426 -7.858 -1.475) 9.662 8.889 ( 3.368 -3.513 7.863) 9.247 9.191 ( -10.351 -3.953 -0.706) 11.102 9.431 ( 2.880 3.294 0.244) 4.382 9.929 ( 0.344 -4.918 -2.868) 5.703 10.054 ( 0.290 8.008 1.926) 8.242 10.318 ( -0.186 0.414 3.549) 3.578 10.878 ( 3.452 -5.843 3.903) 7.829 10.907 ( 3.886 -3.133 4.290) 6.582 11.028 ( 6.762 -6.093 -4.159) 10.007 11.119 ( -1.135 0.832 -12.649) 12.728 11.591 ( 4.390 -2.019 8.666) 9.922 11.630 ( 1.918 3.835 -3.716) 5.674 11.674 ( -3.574 -3.728 -0.616) 5.201 12.046 ( -3.393 4.310 -4.078) 6.835 12.063 ( -1.086 2.768 0.674) 3.049 12.187 ( 3.631 -3.964 0.162) 5.378 12.323 ( -5.128 0.758 7.133) 8.817 12.437 ( 8.430 3.069 1.884) 9.167 12.778 ( -14.336 -4.763 3.115) 15.424 12.918 ( -6.114 3.851 -5.949) 9.360 13.525 ( -6.598 4.281 4.611) 9.117 14.778 ( -0.935 3.972 3.010) 5.071 14.910 ( -3.407 2.131 -0.052) 4.018 15.070 ( -4.280 -1.739 -0.040) 4.620 15.213 ( -2.778 -4.128 1.252) 5.131 15.378 ( 5.130 9.508 -0.056) 10.804 15.634 ( 5.042 0.720 -2.957) 5.889 15.720 ( 2.211 2.609 -1.864) 3.895 15.770 ( 1.564 1.405 -2.053) 2.938 15.861 ( 6.202 1.414 -4.226) 7.637 16.176 ( -7.254 -5.013 -1.535) 8.950 16.278 ( -3.552 3.080 3.482) 5.850 16.458 ( -3.280 -7.210 2.846) 8.417 17.374 ( 8.597 7.629 3.117) 11.909 17.593 ( 11.140 4.270 -1.526) 12.028 17.853 ( 1.291 -0.895 -4.899) 5.145 18.095 ( 1.421 -1.318 -0.665) 2.049 25.697 ( 0.701 -0.828 0.411) 1.160 25.759 ( 1.216 -1.337 -0.682) 1.932 25.825 ( -1.077 -1.864 2.048) 2.972 25.905 ( -1.658 -0.660 1.301) 2.209 26.143 ( -0.843 2.063 3.339) 4.014 26.358 ( -1.482 -1.697 -4.408) 4.950 26.531 ( 3.530 -0.826 4.249) 5.586 26.581 ( 0.691 1.111 -1.380) 1.902 27.163 ( -6.218 0.612 1.627) 6.456 27.563 ( 6.806 3.464 11.408) 13.729 27.850 ( -5.659 -9.715 3.034) 11.645 28.256 ( -6.472 1.345 -4.848) 8.198 28.465 ( -4.534 -3.699 -2.050) 6.200 28.527 ( -6.276 -6.370 -5.085) 10.287 29.211 ( 6.559 -0.319 0.030) 6.567 30.725 ( 16.399 15.081 -9.874) 24.369 ======================= Grid point 107 (45/140) ======================= q-point: ( 0.44 0.22 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 7.23e-05 7.23e-05 7.23e-05 7.23e-05 7.23e-05 7.23e-05 7.23e-05 7.23e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 243 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.596 ( -3.847 -12.397 0.783) 13.004 1.812 ( 11.348 -7.640 9.393) 16.594 1.933 ( 6.551 -3.861 2.386) 7.970 2.152 ( 2.129 -15.200 -3.674) 15.782 2.376 ( -7.340 -7.513 -10.758) 15.035 2.483 ( -0.610 -16.808 7.994) 18.622 2.606 ( 0.876 -10.151 -0.717) 10.213 2.701 ( -2.633 -4.224 1.608) 5.231 2.827 ( -3.821 -2.987 3.235) 5.830 2.967 ( 1.027 -7.600 0.625) 7.695 3.053 ( 1.841 0.628 -1.991) 2.784 3.163 ( -3.746 0.060 -4.419) 5.794 3.307 ( -0.349 0.242 -6.463) 6.477 3.539 ( -4.668 2.129 -1.201) 5.269 3.654 ( -5.619 7.873 9.011) 13.219 3.748 ( 6.911 -2.953 6.700) 10.068 3.973 ( -3.156 1.663 0.532) 3.607 4.194 ( 4.476 -6.065 1.087) 7.616 4.283 ( 8.396 -12.608 2.040) 15.284 4.569 ( -6.009 -5.775 -7.593) 11.274 4.651 ( -0.187 0.915 -1.060) 1.412 4.755 ( 7.075 4.546 -2.586) 8.799 4.893 ( -1.694 -0.132 -1.572) 2.315 5.125 ( 1.544 5.037 -1.621) 5.512 5.273 ( 3.908 0.533 5.350) 6.647 5.419 ( -2.912 -0.273 2.418) 3.795 5.496 ( -3.572 -8.500 -7.350) 11.791 5.804 ( 5.882 2.820 0.106) 6.524 5.961 ( -4.176 5.386 -4.418) 8.122 6.201 ( 7.792 0.382 0.310) 7.807 6.268 ( -2.639 4.492 -2.565) 5.807 6.397 ( -2.905 3.902 7.310) 8.781 6.564 ( 3.113 4.664 -0.004) 5.607 6.783 ( 1.688 1.631 -1.599) 2.840 6.959 ( -6.146 0.584 2.738) 6.753 6.985 ( 3.196 1.472 1.949) 4.022 7.089 ( -6.117 4.229 -0.668) 7.466 7.311 ( -7.248 -2.580 1.903) 7.926 7.660 ( 4.924 1.780 1.184) 5.368 7.737 ( -1.848 -2.463 -1.202) 3.305 8.663 ( -6.122 -1.892 1.464) 6.573 8.782 ( -3.602 -9.931 0.153) 10.565 8.931 ( -4.122 -10.792 -1.656) 11.671 9.023 ( -0.205 -6.358 5.774) 8.591 9.240 ( -3.769 -8.781 -0.333) 9.561 9.409 ( 1.224 1.387 0.474) 1.910 9.906 ( -0.286 10.081 1.784) 10.242 10.014 ( 1.711 -5.138 -2.271) 5.872 10.302 ( -0.749 2.499 -0.119) 2.611 10.902 ( 2.478 2.197 -2.585) 4.201 11.038 ( 2.289 -0.936 0.421) 2.508 11.080 ( 3.385 -6.205 -6.112) 9.344 11.239 ( 6.532 -10.561 0.550) 12.430 11.542 ( 1.561 5.762 -3.173) 6.760 11.667 ( -1.919 -1.966 0.563) 2.804 11.739 ( 1.733 -3.450 0.840) 3.951 11.892 ( -3.554 5.553 -3.299) 7.372 12.062 ( 1.095 -0.793 2.364) 2.723 12.273 ( 4.246 -2.461 -1.707) 5.196 12.319 ( -2.337 0.724 6.495) 6.940 12.461 ( 9.243 3.344 4.185) 10.684 12.713 ( -4.767 3.887 -8.783) 10.722 12.789 ( -14.991 -2.431 0.968) 15.217 13.364 ( -8.341 10.041 2.362) 13.266 14.754 ( 0.107 0.316 3.162) 3.179 14.820 ( -4.188 3.004 0.489) 5.177 15.123 ( -1.678 -6.233 -1.171) 6.561 15.169 ( 1.412 7.063 1.517) 7.361 15.336 ( 0.075 0.253 -0.319) 0.414 15.642 ( 2.572 1.254 -1.641) 3.298 15.671 ( 1.926 2.013 1.376) 3.107 15.752 ( 3.108 2.277 -2.500) 4.593 15.866 ( 7.214 1.660 -5.625) 9.297 16.156 ( -8.617 -0.030 0.137) 8.618 16.238 ( -4.127 0.674 4.820) 6.381 16.569 ( -2.081 -6.643 2.108) 7.274 17.328 ( 13.942 9.368 3.028) 17.067 17.607 ( 4.193 2.840 3.680) 6.260 17.793 ( -3.525 2.587 -6.040) 7.457 18.119 ( 0.838 -0.937 -1.259) 1.779 25.730 ( 1.037 -1.805 0.882) 2.261 25.782 ( 0.191 -1.159 -0.786) 1.413 25.869 ( -0.378 -2.717 0.866) 2.877 25.908 ( -1.959 -0.497 1.518) 2.528 26.099 ( -0.966 3.453 0.633) 3.641 26.366 ( -0.501 -2.571 -4.383) 5.106 26.559 ( 0.045 0.490 0.220) 0.539 26.593 ( 3.539 -0.207 3.837) 5.224 27.130 ( -3.030 -1.148 -2.058) 3.839 27.573 ( 3.502 8.045 11.057) 14.115 27.950 ( -4.604 -5.724 -0.573) 7.368 28.191 ( -7.736 -6.163 -5.793) 11.463 28.535 ( -3.401 -8.679 -1.168) 9.395 28.597 ( -2.144 -6.939 -2.510) 7.684 29.281 ( 5.202 -1.163 3.530) 6.393 30.478 ( 12.451 22.184 -6.165) 26.176 ======================= Grid point 108 (46/140) ======================= q-point: ( 0.56 0.22 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 7.23e-05 7.23e-05 7.23e-05 7.23e-05 7.23e-05 7.23e-05 7.23e-05 7.23e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 243 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.746 ( -4.310 -1.873 7.741) 9.055 2.007 ( -0.014 -7.355 0.999) 7.423 2.034 ( 7.274 -3.598 2.158) 8.398 2.330 ( -3.281 -5.697 -2.296) 6.964 2.437 ( 1.534 -10.239 -8.114) 13.154 2.690 ( -3.737 -8.078 -10.368) 13.664 2.719 ( -0.522 -5.361 1.909) 5.715 2.774 ( 2.013 -3.091 1.807) 4.107 2.931 ( 0.598 -1.485 1.422) 2.141 2.975 ( -2.952 -1.170 0.646) 3.241 3.069 ( 1.202 -1.736 3.303) 3.920 3.224 ( -4.214 -5.557 1.158) 7.070 3.247 ( 0.663 -3.701 -5.802) 6.914 3.491 ( -6.008 1.719 4.292) 7.581 3.604 ( 2.312 -2.081 2.702) 4.120 3.821 ( 0.198 0.718 4.186) 4.251 3.962 ( -3.331 -1.823 2.727) 4.676 4.354 ( 6.712 -5.106 5.649) 10.151 4.471 ( -5.579 -3.466 -5.692) 8.691 4.549 ( 5.033 0.763 -5.427) 7.441 4.629 ( 1.754 3.118 0.146) 3.581 4.755 ( 4.517 1.910 -1.462) 5.118 4.848 ( 0.560 0.101 -5.897) 5.924 5.070 ( 4.380 1.005 -1.580) 4.763 5.290 ( -3.603 -0.356 2.569) 4.439 5.405 ( -2.186 -2.563 -4.600) 5.702 5.632 ( -2.476 -9.010 2.294) 9.621 5.818 ( 5.310 1.555 4.651) 7.228 5.852 ( -0.675 3.045 -0.754) 3.209 6.142 ( -2.708 4.483 -3.081) 6.076 6.296 ( 6.583 -1.528 -0.783) 6.803 6.327 ( -1.977 3.118 3.017) 4.768 6.525 ( 1.762 2.102 1.381) 3.071 6.764 ( -0.745 -0.286 -2.418) 2.547 6.884 ( -3.974 2.820 3.205) 5.832 6.969 ( -2.326 3.620 -1.866) 4.690 7.063 ( 0.573 -2.191 7.410) 7.748 7.314 ( -4.864 -3.353 -0.490) 5.928 7.685 ( -1.338 1.314 -0.423) 1.922 7.743 ( 4.523 -0.613 -1.119) 4.699 8.647 ( -5.730 -0.662 3.805) 6.910 8.941 ( -0.572 -9.850 3.491) 10.466 9.071 ( -3.566 -9.188 -0.143) 9.857 9.137 ( 0.419 -5.562 0.498) 5.600 9.364 ( -1.420 -3.434 -1.045) 3.860 9.448 ( 1.950 -8.054 1.622) 8.444 9.746 ( -1.754 8.370 2.328) 8.863 10.101 ( 1.448 -4.538 -2.336) 5.306 10.221 ( -1.506 5.448 -0.719) 5.698 10.849 ( 1.811 3.267 -4.534) 5.874 11.045 ( 1.506 -1.331 -6.616) 6.915 11.216 ( 1.889 -3.469 4.744) 6.173 11.394 ( 6.096 1.498 -2.712) 6.838 11.485 ( 2.967 -1.781 4.057) 5.333 11.622 ( -2.202 5.503 -0.965) 6.006 11.699 ( -4.318 3.327 0.872) 5.520 11.909 ( 3.120 -6.939 -7.493) 10.678 12.111 ( 2.293 -1.083 1.868) 3.150 12.299 ( -3.519 -0.290 0.974) 3.663 12.325 ( 4.180 0.758 -0.716) 4.308 12.502 ( 7.727 5.194 4.462) 10.324 12.587 ( -0.720 -0.211 -7.042) 7.082 12.742 ( -8.719 -2.697 -0.188) 9.129 13.120 ( -10.573 9.231 1.486) 14.114 14.758 ( -1.606 0.461 -0.878) 1.887 14.804 ( -0.707 -2.840 3.087) 4.254 15.094 ( 0.618 2.154 0.434) 2.283 15.201 ( -1.113 -1.979 -3.498) 4.170 15.315 ( 0.585 0.345 3.654) 3.716 15.628 ( 1.238 0.743 -2.710) 3.071 15.675 ( 0.581 0.543 -1.048) 1.316 15.733 ( 6.147 3.324 1.179) 7.087 15.863 ( 3.865 0.668 -3.710) 5.399 16.064 ( -8.816 2.538 1.234) 9.257 16.234 ( -3.963 -0.857 6.132) 7.351 16.657 ( -0.786 -4.270 0.611) 4.385 17.293 ( 11.171 9.481 3.553) 15.077 17.574 ( 0.563 5.534 1.729) 5.825 17.714 ( -3.665 -1.312 -2.988) 4.907 18.129 ( 0.743 -0.493 -1.941) 2.136 25.763 ( -0.567 -0.415 1.037) 1.253 25.805 ( 1.376 -1.885 0.005) 2.334 25.893 ( -2.352 -0.532 0.003) 2.411 25.923 ( 0.013 -2.035 0.769) 2.176 26.023 ( -0.842 4.286 -1.093) 4.503 26.388 ( 0.959 -2.338 -4.888) 5.503 26.573 ( 0.409 -0.955 3.939) 4.074 26.630 ( 1.447 0.097 2.893) 3.236 27.125 ( -1.265 -2.332 -8.192) 8.611 27.472 ( -1.074 8.650 8.593) 12.239 28.003 ( -1.262 -4.649 -1.119) 4.945 28.270 ( -2.557 -7.693 1.170) 8.191 28.625 ( -0.943 -4.992 -3.260) 6.037 28.729 ( -2.276 -11.359 0.084) 11.585 29.348 ( 1.802 -0.800 3.745) 4.232 30.138 ( 7.801 24.061 -4.543) 25.698 ======================= Grid point 109 (47/140) ======================= q-point: (-0.33 0.22 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 7.23e-05 7.23e-05 7.23e-05 7.23e-05 7.23e-05 7.23e-05 7.23e-05 7.23e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 243 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.656 ( -7.601 8.527 7.454) 13.640 2.054 ( 2.306 5.276 2.337) 6.214 2.175 ( -0.256 -6.834 5.325) 8.667 2.365 ( -5.100 -4.197 -6.181) 9.046 2.540 ( 6.460 0.408 0.348) 6.482 2.630 ( -1.425 3.614 -12.768) 13.346 2.784 ( -1.024 -2.967 -3.081) 4.398 2.868 ( -0.352 -1.238 -0.410) 1.351 2.895 ( 4.216 -6.757 -0.996) 8.026 3.070 ( 1.282 2.299 -0.970) 2.806 3.089 ( -0.203 -1.305 5.527) 5.683 3.256 ( -1.748 -7.271 1.267) 7.585 3.395 ( -1.339 -6.730 3.801) 7.844 3.458 ( -2.603 -0.173 3.495) 4.361 3.723 ( 4.976 -6.380 -0.269) 8.096 3.793 ( -0.157 3.861 0.545) 3.902 3.990 ( -7.068 -3.893 6.790) 10.546 4.335 ( -5.267 6.162 -6.048) 10.114 4.446 ( -4.047 6.965 -1.325) 8.163 4.532 ( 6.982 -0.753 4.435) 8.306 4.590 ( 2.773 3.261 2.088) 4.763 4.731 ( 3.045 -0.248 -6.807) 7.461 4.848 ( 1.802 0.492 -7.946) 8.163 5.103 ( 3.998 1.166 2.880) 5.063 5.305 ( -3.206 -6.037 -6.191) 9.223 5.437 ( 1.640 -3.212 -2.724) 4.520 5.714 ( -1.617 -2.280 -0.389) 2.823 5.827 ( 1.072 1.843 4.393) 4.883 5.882 ( 1.956 -0.009 8.734) 8.950 6.066 ( -0.974 1.006 -2.757) 3.093 6.224 ( -6.314 3.030 0.917) 7.063 6.392 ( 7.813 -0.651 -2.013) 8.095 6.546 ( 1.170 -2.280 0.252) 2.575 6.733 ( -3.113 2.476 0.215) 3.984 6.853 ( -1.265 -1.477 1.797) 2.648 6.927 ( -1.414 -0.499 0.118) 1.504 7.159 ( 0.610 -5.194 5.899) 7.883 7.334 ( -2.582 -2.577 -1.065) 3.800 7.601 ( -1.317 4.483 -3.238) 5.685 7.792 ( 1.316 -1.964 -3.007) 3.825 8.653 ( -2.509 -1.668 6.199) 6.893 9.120 ( 0.790 -7.635 5.244) 9.297 9.173 ( -0.753 -5.462 0.602) 5.547 9.226 ( 1.313 -4.293 -2.589) 5.182 9.376 ( 3.034 0.262 -0.255) 3.056 9.559 ( -3.302 1.035 0.289) 3.473 9.708 ( -0.770 -5.975 5.716) 8.305 10.061 ( -1.930 7.401 -3.837) 8.557 10.192 ( 0.841 -2.498 1.247) 2.916 10.791 ( 1.286 3.020 -2.208) 3.956 11.016 ( 1.269 3.057 -4.288) 5.417 11.185 ( -3.510 6.969 2.067) 8.072 11.385 ( 6.043 1.955 -6.272) 8.927 11.547 ( 0.529 -0.360 3.648) 3.704 11.577 ( 1.938 2.125 3.486) 4.519 11.660 ( -2.734 -3.657 3.779) 5.927 11.943 ( 1.239 1.858 -6.968) 7.318 12.118 ( 1.507 3.071 -0.424) 3.447 12.245 ( -7.296 1.629 -3.376) 8.203 12.357 ( 2.465 -1.515 -2.290) 3.690 12.457 ( 0.414 0.515 -0.837) 1.067 12.567 ( 4.845 3.574 -7.129) 9.331 12.822 ( 2.878 -9.385 2.508) 10.131 13.002 ( -6.542 -2.621 5.982) 9.243 14.730 ( -1.324 1.844 0.910) 2.446 14.869 ( -1.200 -3.747 -0.004) 3.935 15.109 ( -0.988 -3.466 0.058) 3.605 15.139 ( 1.891 4.062 -3.037) 5.413 15.384 ( -1.346 -3.393 3.683) 5.185 15.595 ( 1.276 2.526 -2.642) 3.872 15.652 ( 1.326 2.594 -0.811) 3.024 15.731 ( 5.587 2.569 -1.147) 6.256 15.887 ( 2.337 -2.463 -0.360) 3.415 15.978 ( -7.582 0.245 1.933) 7.829 16.264 ( -4.373 -2.370 7.419) 8.932 16.705 ( 0.708 -1.686 -1.008) 2.088 17.195 ( 1.789 9.679 2.355) 10.121 17.475 ( -0.382 5.475 -0.968) 5.574 17.754 ( 0.633 -4.532 0.018) 4.576 18.130 ( 0.997 -0.136 -2.580) 2.769 25.750 ( -1.340 1.156 1.290) 2.190 25.850 ( 1.329 -0.427 0.258) 1.419 25.880 ( -1.624 -0.773 0.674) 1.920 25.931 ( -0.800 2.694 -1.842) 3.360 25.973 ( 0.319 -1.124 0.690) 1.356 26.404 ( 1.943 -1.124 -5.281) 5.738 26.621 ( -0.782 -2.027 1.299) 2.531 26.657 ( 1.174 -0.444 7.389) 7.494 27.076 ( -1.569 0.782 -13.132) 13.248 27.412 ( -2.897 0.978 7.024) 7.661 28.075 ( 1.977 -3.292 1.531) 4.134 28.398 ( 1.828 -6.107 5.672) 8.533 28.676 ( 1.856 -2.894 -3.409) 4.841 28.906 ( -2.140 -11.127 -0.050) 11.331 29.350 ( -1.432 2.986 1.206) 3.525 29.774 ( 2.409 20.852 -3.820) 21.336 ======================= Grid point 110 (48/140) ======================= q-point: (-0.22 0.22 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 7.23e-05 7.23e-05 7.23e-05 7.23e-05 7.23e-05 7.23e-05 7.23e-05 7.23e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 243 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.466 ( -6.934 12.111 10.418) 17.415 1.934 ( 1.701 13.444 8.529) 16.012 2.184 ( -3.760 6.364 1.210) 7.490 2.363 ( -1.970 -0.648 -3.141) 3.763 2.509 ( 1.961 3.873 -6.683) 7.969 2.536 ( 6.029 5.604 2.493) 8.600 2.776 ( 2.409 2.916 -4.740) 6.064 2.870 ( -2.471 -1.782 -2.442) 3.905 3.009 ( 1.695 2.207 0.461) 2.821 3.068 ( 5.386 -4.387 -0.300) 6.953 3.131 ( 0.595 -2.227 1.537) 2.770 3.404 ( -1.048 -1.369 7.161) 7.366 3.409 ( -0.533 -1.310 1.225) 1.871 3.489 ( -2.191 -1.350 2.426) 3.537 3.700 ( -0.041 6.200 -0.685) 6.238 3.837 ( -0.484 -5.250 -4.314) 6.812 4.065 ( -7.443 -5.467 3.827) 9.996 4.174 ( -0.881 3.675 -0.501) 3.812 4.263 ( -5.836 7.919 -0.461) 9.848 4.539 ( 0.443 1.614 2.218) 2.779 4.637 ( 7.623 2.660 7.582) 11.076 4.750 ( 4.077 -1.806 -8.428) 9.535 4.764 ( 1.325 3.425 -8.596) 9.347 5.130 ( -0.765 -0.663 4.187) 4.308 5.346 ( 1.392 -3.548 -7.770) 8.654 5.490 ( 3.330 -1.697 -4.321) 5.713 5.712 ( -0.957 -0.198 -1.367) 1.681 5.793 ( -0.935 5.403 4.001) 6.788 5.913 ( -2.069 0.801 7.517) 7.837 6.052 ( 0.076 -0.628 -2.311) 2.396 6.158 ( -2.881 -0.236 -0.322) 2.908 6.436 ( 2.004 -1.009 -1.101) 2.499 6.592 ( 1.912 -1.805 -2.144) 3.393 6.670 ( 2.650 4.309 2.286) 5.552 6.848 ( -5.587 1.832 4.212) 7.233 6.997 ( 0.680 -8.021 -3.014) 8.596 7.280 ( 0.164 -4.806 -0.794) 4.874 7.355 ( -3.643 -3.454 1.083) 5.136 7.536 ( 0.820 -0.437 -0.949) 1.328 7.783 ( -2.994 -0.736 -6.009) 6.754 8.733 ( 1.315 -3.795 7.604) 8.599 9.215 ( 2.831 0.931 2.858) 4.130 9.235 ( 0.365 -0.391 -0.514) 0.742 9.254 ( -2.489 -1.167 -3.665) 4.581 9.416 ( 5.677 -0.034 -0.189) 5.680 9.525 ( -7.801 -3.472 7.084) 11.095 9.769 ( -0.906 4.430 0.024) 4.522 9.926 ( 0.460 4.425 2.630) 5.168 10.242 ( -1.119 -3.016 -0.177) 3.222 10.753 ( 0.807 2.686 4.657) 5.436 10.949 ( 2.028 3.288 -3.340) 5.107 11.035 ( -1.575 7.585 0.180) 7.748 11.361 ( 7.761 3.452 -3.560) 9.210 11.523 ( -1.232 2.540 0.089) 2.824 11.646 ( -0.088 -7.320 1.432) 7.460 11.702 ( -1.230 2.631 -2.695) 3.962 11.887 ( 1.976 1.542 5.005) 5.598 12.024 ( 0.305 6.520 -2.708) 7.067 12.113 ( -7.539 3.964 -1.039) 8.581 12.356 ( -0.622 -1.320 -7.075) 7.224 12.473 ( -0.416 -1.063 -5.604) 5.719 12.589 ( 6.995 -6.298 -8.239) 12.509 13.006 ( -3.559 -8.094 6.966) 11.256 13.175 ( 5.200 -13.232 8.027) 16.327 14.685 ( -1.483 2.818 2.729) 4.194 14.877 ( -1.182 1.427 -0.621) 1.954 15.134 ( 0.014 -3.430 -2.107) 4.026 15.164 ( -0.976 -3.460 -0.209) 3.601 15.400 ( -1.631 0.538 -0.722) 1.863 15.547 ( 0.037 2.974 0.571) 3.028 15.603 ( 1.319 4.180 0.225) 4.389 15.727 ( 5.479 1.233 -4.779) 7.374 15.939 ( -9.829 -3.251 5.228) 11.598 16.011 ( 8.817 -5.510 -1.685) 10.533 16.312 ( -6.395 -3.638 8.346) 11.126 16.716 ( 2.182 0.723 -2.466) 3.371 17.040 ( -4.950 8.023 1.667) 9.574 17.388 ( 0.333 4.372 -0.269) 4.393 17.844 ( 2.564 -4.742 -2.262) 5.847 18.125 ( 1.540 0.078 -3.217) 3.567 25.726 ( -1.209 1.421 2.081) 2.795 25.828 ( 0.149 2.280 -0.036) 2.286 25.868 ( -0.876 2.065 0.342) 2.269 25.916 ( 0.674 -1.121 1.786) 2.213 26.004 ( -0.272 -1.755 -0.375) 1.815 26.403 ( 2.172 0.058 -5.291) 5.719 26.629 ( -1.678 -0.850 -1.903) 2.676 26.745 ( 1.525 -2.438 11.486) 11.841 26.965 ( -2.222 2.660 -12.453) 12.927 27.434 ( -5.315 -3.933 1.631) 6.810 28.144 ( 0.440 -2.024 2.854) 3.527 28.572 ( 7.151 -5.368 9.720) 13.207 28.729 ( 7.010 -2.143 -2.224) 7.660 29.052 ( -1.680 -7.870 -2.137) 8.326 29.216 ( -1.246 10.774 -1.251) 10.918 29.474 ( -4.177 11.419 -3.939) 12.781 ======================= Grid point 111 (49/140) ======================= q-point: (-0.11 0.22 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 7.23e-05 7.23e-05 7.23e-05 7.23e-05 7.23e-05 7.23e-05 7.23e-05 7.23e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 243 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.258 ( -2.396 14.900 13.269) 20.096 1.728 ( 1.411 17.862 11.097) 21.075 2.039 ( 4.478 12.354 8.223) 15.501 2.215 ( -5.723 10.005 -1.459) 11.619 2.406 ( 4.152 10.458 1.167) 11.312 2.546 ( 0.014 1.393 0.345) 1.435 2.691 ( 6.870 6.778 -4.390) 10.603 2.851 ( 0.052 2.600 -2.316) 3.482 3.002 ( 2.149 0.931 1.238) 2.649 3.096 ( -0.656 4.920 3.134) 5.870 3.168 ( 3.524 1.960 -3.793) 5.536 3.269 ( -3.356 10.135 4.399) 11.547 3.427 ( -1.827 6.673 2.693) 7.424 3.481 ( -3.892 -2.071 -3.272) 5.491 3.691 ( 3.791 -3.910 2.057) 5.822 3.880 ( -4.909 -6.255 -5.750) 9.812 3.992 ( -1.152 3.709 -0.024) 3.884 4.090 ( -7.152 4.512 -4.721) 9.684 4.285 ( -1.550 -7.664 6.876) 10.413 4.536 ( -0.551 1.809 4.600) 4.974 4.635 ( 1.789 3.051 0.078) 3.537 4.732 ( 7.621 0.103 -3.032) 8.202 4.790 ( 5.237 -0.723 -2.763) 5.965 5.137 ( -5.011 -0.662 2.613) 5.690 5.362 ( 1.578 -1.437 -11.198) 11.400 5.493 ( 5.011 1.863 -1.677) 5.603 5.641 ( -3.129 6.478 -2.791) 7.716 5.766 ( 1.821 -1.849 1.594) 3.046 5.917 ( -1.387 -0.696 2.563) 2.996 6.055 ( -0.844 -1.629 -1.848) 2.604 6.195 ( 0.037 -4.425 2.226) 4.954 6.436 ( -0.718 0.228 -2.050) 2.184 6.615 ( 1.423 -0.856 -1.374) 2.155 6.670 ( 9.085 3.531 4.241) 10.630 6.763 ( -8.814 3.087 2.355) 9.632 7.120 ( 1.029 -7.644 -5.028) 9.207 7.295 ( -1.259 -0.932 -4.416) 4.686 7.383 ( -4.739 -3.784 -1.755) 6.313 7.634 ( -3.954 -7.732 2.230) 8.966 7.742 ( -1.398 -0.886 -2.221) 2.770 8.820 ( 2.937 1.391 4.676) 5.695 9.148 ( -4.863 5.424 -5.898) 9.373 9.177 ( 1.930 7.436 1.822) 7.895 9.210 ( -0.932 1.211 0.687) 1.675 9.463 ( -6.268 7.331 -5.354) 11.032 9.513 ( 3.500 -5.433 1.729) 6.690 9.717 ( -6.209 -1.843 10.032) 11.941 9.883 ( 1.805 5.698 7.620) 9.685 10.263 ( -2.148 -1.304 -1.098) 2.742 10.766 ( 2.582 2.046 8.032) 8.681 10.895 ( -0.709 2.754 1.178) 3.078 10.971 ( 7.528 1.483 -3.891) 8.603 11.340 ( 3.177 3.595 -2.416) 5.372 11.510 ( 6.377 0.088 -3.106) 7.094 11.574 ( -0.914 6.701 -0.384) 6.774 11.786 ( 1.726 -8.109 -2.394) 8.630 11.888 ( -3.031 3.242 2.229) 4.966 11.946 ( 1.896 1.563 -1.240) 2.752 12.065 ( -1.437 -1.941 7.716) 8.085 12.329 ( -2.808 -2.050 -10.402) 10.968 12.451 ( 0.476 0.011 -6.236) 6.254 12.727 ( 4.387 -8.274 -6.963) 11.670 13.122 ( -5.609 -5.453 8.133) 11.285 13.499 ( -0.052 -15.904 7.292) 17.496 14.659 ( -2.599 0.262 5.532) 6.117 14.838 ( -0.676 1.163 0.678) 1.506 15.116 ( -6.923 0.767 -2.494) 7.398 15.241 ( 5.217 -1.165 0.073) 5.346 15.374 ( -2.471 -2.075 -2.692) 4.202 15.517 ( 2.466 2.291 -0.780) 3.455 15.542 ( -0.972 2.475 2.327) 3.534 15.728 ( 5.454 0.421 -6.964) 8.856 15.936 ( -9.627 -2.821 3.591) 10.655 16.191 ( 9.510 -5.367 -0.150) 10.921 16.381 ( -5.656 -6.661 8.059) 11.887 16.692 ( 4.375 3.164 -3.461) 6.413 16.878 ( -8.669 5.546 1.841) 10.455 17.335 ( 2.504 3.507 1.649) 4.614 17.913 ( 3.428 -2.839 -6.469) 7.853 18.120 ( 2.066 0.223 -4.017) 4.522 25.704 ( -0.682 1.569 2.031) 2.656 25.792 ( 0.970 2.596 0.598) 2.835 25.849 ( -1.016 0.330 2.967) 3.153 25.941 ( -0.025 -0.017 2.590) 2.590 26.019 ( -0.358 -0.802 -0.531) 1.026 26.389 ( 2.656 0.809 -4.515) 5.300 26.609 ( -2.099 0.204 -2.762) 3.475 26.808 ( -2.560 2.091 -7.810) 8.481 26.897 ( 1.351 -2.525 9.846) 10.254 27.456 ( -7.942 -4.423 -1.622) 9.234 28.168 ( -3.607 -0.693 2.197) 4.280 28.669 ( 1.672 0.483 0.014) 1.741 28.829 ( 2.584 5.760 4.388) 7.688 29.030 ( -2.057 9.746 -1.210) 10.034 29.136 ( 4.509 -4.801 -1.486) 6.752 29.349 ( 8.174 -5.220 -3.506) 10.313 ======================= Grid point 115 (50/140) ======================= q-point: ( 0.33 0.33 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 7.23e-05 7.23e-05 7.23e-05 7.23e-05 7.23e-05 7.23e-05 7.23e-05 7.23e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 135 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.326 ( 2.223 0.000 -14.994) 15.158 1.531 ( -1.843 -0.000 -2.028) 2.740 1.840 ( 13.495 0.000 6.697) 15.066 1.867 ( 4.504 0.000 3.115) 5.477 1.942 ( -3.827 -0.000 17.694) 18.103 2.230 ( -3.498 -0.000 -7.916) 8.655 2.463 ( 6.157 0.000 -1.971) 6.465 2.581 ( -6.626 -0.000 -1.039) 6.707 2.806 ( 2.324 0.000 3.656) 4.333 2.809 ( -9.042 -0.000 3.401) 9.661 3.084 ( 11.379 0.000 2.328) 11.614 3.187 ( -6.494 -0.000 -5.633) 8.597 3.275 ( 0.120 0.000 -5.760) 5.761 3.620 ( 13.684 0.000 22.004) 25.912 3.766 ( -3.328 -0.000 -6.911) 7.671 3.782 ( -0.424 -0.000 -8.113) 8.124 4.004 ( -7.009 -0.000 1.917) 7.267 4.035 ( -2.035 -0.000 2.456) 3.190 4.135 ( 4.318 0.000 0.071) 4.318 4.340 ( -6.881 -0.000 -3.152) 7.569 4.686 ( -1.023 -0.000 0.116) 1.029 4.817 ( -4.337 -0.000 6.394) 7.726 4.855 ( 6.280 0.000 -9.905) 11.729 5.178 ( 4.008 0.000 4.668) 6.153 5.319 ( -2.059 -0.000 -9.219) 9.446 5.339 ( 1.802 0.000 -3.503) 3.939 5.490 ( 1.959 0.000 3.930) 4.391 5.848 ( 7.933 0.000 -0.622) 7.957 6.110 ( -8.939 -0.000 -3.798) 9.712 6.202 ( 0.940 0.000 0.126) 0.948 6.395 ( 4.482 0.000 4.244) 6.173 6.497 ( 1.512 0.000 6.211) 6.393 6.638 ( -1.845 -0.000 -2.341) 2.981 6.806 ( 0.831 0.000 -2.533) 2.666 6.884 ( 4.425 0.000 1.617) 4.712 7.161 ( -5.450 -0.000 1.277) 5.597 7.174 ( 0.098 0.000 4.884) 4.885 7.337 ( -17.728 -0.000 -2.643) 17.923 7.482 ( -2.985 -0.000 -0.909) 3.121 7.802 ( 5.231 0.000 -2.196) 5.673 8.482 ( -4.310 -0.000 -6.267) 7.606 8.674 ( -3.069 -0.000 5.434) 6.240 8.711 ( -4.824 -0.000 3.056) 5.710 8.915 ( -2.526 -0.000 7.303) 7.727 9.096 ( -1.810 -0.000 -0.715) 1.946 9.507 ( 4.463 0.000 -0.949) 4.563 9.829 ( -1.953 -0.000 -6.482) 6.770 10.136 ( 0.627 0.000 0.094) 0.634 10.325 ( -2.469 -0.000 2.268) 3.353 10.810 ( 0.757 0.000 -3.795) 3.870 10.927 ( 2.652 0.000 2.532) 3.667 11.013 ( 6.582 0.000 -4.943) 8.231 11.104 ( 1.652 0.000 -1.340) 2.127 11.587 ( -5.132 -0.000 -0.115) 5.133 11.664 ( 4.810 0.000 9.386) 10.547 11.683 ( 5.230 0.000 -4.788) 7.090 12.029 ( -4.740 -0.000 -4.979) 6.875 12.068 ( -2.653 -0.000 -0.924) 2.809 12.185 ( 3.939 0.000 1.792) 4.328 12.316 ( -4.591 -0.000 4.126) 6.173 12.546 ( 7.159 0.000 4.886) 8.668 12.631 ( -16.087 -0.000 5.155) 16.892 12.878 ( -3.325 -0.000 -10.188) 10.717 13.551 ( -2.802 -0.000 2.772) 3.941 14.838 ( -0.328 -0.000 1.508) 1.544 14.881 ( -1.623 -0.000 -0.345) 1.659 15.045 ( -10.397 -0.000 3.016) 10.825 15.141 ( 3.251 0.000 0.608) 3.307 15.518 ( 3.199 0.000 -0.222) 3.207 15.642 ( -1.858 -0.000 -1.775) 2.570 15.744 ( 4.299 0.000 -5.453) 6.944 15.765 ( 3.464 0.000 -3.819) 5.156 15.938 ( 7.581 0.000 -1.272) 7.687 16.071 ( -5.329 -0.000 1.477) 5.530 16.329 ( -1.605 -0.000 0.034) 1.606 16.355 ( -3.249 -0.000 5.948) 6.778 17.500 ( 5.764 0.000 5.043) 7.659 17.711 ( 11.583 0.000 -8.221) 14.204 17.841 ( -2.012 -0.000 3.007) 3.618 18.089 ( 0.991 0.000 -0.741) 1.237 25.693 ( 0.559 0.000 -0.109) 0.570 25.759 ( 1.898 0.000 -0.828) 2.071 25.808 ( -1.383 -0.000 1.964) 2.402 25.892 ( -1.753 -0.000 1.303) 2.184 26.162 ( -1.276 -0.000 0.742) 1.476 26.316 ( -0.984 -0.000 -3.004) 3.161 26.566 ( 2.620 0.000 3.079) 4.043 26.597 ( 0.725 0.000 0.493) 0.877 27.123 ( -4.686 -0.000 -1.872) 5.046 27.715 ( 6.938 0.000 9.535) 11.792 27.734 ( -4.872 -0.000 8.749) 10.014 28.271 ( -13.342 -0.000 -12.281) 18.134 28.274 ( -1.844 -0.000 0.345) 1.876 28.450 ( 0.770 0.000 -1.126) 1.364 29.266 ( 6.002 0.000 3.108) 6.759 30.908 ( 12.138 0.000 -11.193) 16.511 ======================= Grid point 116 (51/140) ======================= q-point: ( 0.44 0.33 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 7.23e-05 7.23e-05 7.23e-05 7.23e-05 7.23e-05 7.23e-05 7.23e-05 7.23e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 243 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.344 ( 0.542 -10.225 -10.863) 14.928 1.699 ( 0.327 -15.943 3.214) 16.267 1.870 ( -1.952 -8.307 -1.244) 8.623 2.037 ( 6.810 -5.498 -2.276) 9.043 2.129 ( 4.829 -7.623 2.897) 9.477 2.261 ( -1.209 -8.527 1.504) 8.743 2.507 ( 2.590 -3.299 -1.537) 4.467 2.589 ( -3.288 -6.406 -1.070) 7.279 2.730 ( -10.486 -1.043 -0.604) 10.555 2.908 ( 1.571 -4.726 10.492) 11.614 3.108 ( -1.488 1.184 -2.354) 3.026 3.146 ( 4.381 3.034 0.917) 5.407 3.256 ( -0.400 -0.793 -7.721) 7.772 3.572 ( -1.910 7.147 -4.425) 8.620 3.774 ( 0.493 1.365 14.271) 14.345 3.861 ( 1.987 6.225 1.806) 6.780 3.958 ( -4.992 0.451 -0.208) 5.017 4.027 ( 0.566 -11.629 -1.898) 11.796 4.209 ( 5.988 -5.206 2.460) 8.307 4.395 ( -0.794 -8.105 -5.287) 9.709 4.663 ( -0.535 1.297 -0.713) 1.574 4.826 ( -4.558 -1.606 3.636) 6.048 4.847 ( 5.427 0.232 -9.427) 10.880 5.170 ( -1.244 2.745 -3.783) 4.836 5.275 ( -1.285 -1.305 -6.865) 7.105 5.395 ( 4.173 -2.587 7.442) 8.916 5.479 ( 0.287 4.517 2.867) 5.358 5.891 ( 5.330 1.583 2.125) 5.952 5.996 ( -4.281 4.506 -0.856) 6.274 6.219 ( 1.004 -1.963 -3.290) 3.960 6.363 ( 3.610 7.307 0.839) 8.193 6.505 ( 1.144 4.868 4.948) 7.035 6.628 ( -1.048 0.526 -0.109) 1.178 6.791 ( -0.281 0.782 -4.529) 4.604 6.935 ( 1.715 -1.649 3.841) 4.518 7.072 ( -2.534 6.504 -0.384) 6.991 7.107 ( -6.293 3.235 2.925) 7.657 7.238 ( -6.497 -1.512 3.202) 7.399 7.565 ( -4.443 -8.698 -1.499) 9.881 7.786 ( 5.433 4.059 -2.149) 7.114 8.519 ( -2.214 -8.637 -3.888) 9.727 8.690 ( -3.529 -1.538 8.724) 9.536 8.756 ( -3.587 -6.465 3.613) 8.229 8.930 ( -6.072 -4.552 2.159) 7.890 9.138 ( 2.672 -2.777 3.110) 4.952 9.464 ( 1.555 4.518 -1.084) 4.899 9.892 ( 1.599 -8.418 -5.749) 10.318 10.066 ( -0.237 7.760 -0.135) 7.765 10.307 ( -1.972 0.102 -2.203) 2.959 10.843 ( -0.977 -6.945 -16.285) 17.731 10.958 ( 1.782 -1.703 -2.423) 3.456 11.084 ( 5.868 -3.379 0.019) 6.772 11.152 ( 4.311 -2.872 10.805) 11.983 11.583 ( -3.370 -2.470 -0.168) 4.182 11.652 ( 3.804 4.344 -3.019) 6.516 11.742 ( 2.432 -0.525 3.523) 4.313 11.939 ( -2.966 4.056 -2.940) 5.822 12.061 ( 0.029 -0.901 2.370) 2.536 12.236 ( 0.013 -3.567 -2.505) 4.359 12.308 ( -3.193 -1.046 2.665) 4.288 12.563 ( -11.251 -1.646 1.835) 11.518 12.591 ( 0.481 -0.297 0.520) 0.768 12.783 ( 1.651 5.481 -4.198) 7.099 13.482 ( -3.128 7.020 0.671) 7.714 14.797 ( 0.184 2.972 1.790) 3.475 14.854 ( -4.024 3.718 1.045) 5.577 15.016 ( -2.826 -4.124 1.851) 5.331 15.220 ( 2.241 -3.708 -0.129) 4.335 15.416 ( -0.336 9.826 0.150) 9.832 15.637 ( -0.772 -1.710 -1.814) 2.610 15.719 ( 1.383 2.852 -4.466) 5.477 15.798 ( 5.171 -0.399 -1.581) 5.422 15.944 ( 7.143 3.475 -3.169) 8.552 16.085 ( -5.299 -2.283 3.467) 6.731 16.269 ( -1.925 2.936 3.411) 4.895 16.448 ( -2.158 -7.050 3.105) 8.000 17.550 ( 9.473 3.018 4.007) 10.719 17.715 ( 6.951 4.506 -1.196) 8.370 17.797 ( -5.801 3.344 0.460) 6.711 18.101 ( 0.395 -0.980 -1.069) 1.503 25.711 ( 0.819 -1.486 0.261) 1.717 25.769 ( 0.931 -0.336 -0.605) 1.160 25.826 ( -0.865 -2.063 0.652) 2.331 25.890 ( -1.986 -0.621 1.330) 2.470 26.132 ( -1.462 1.863 -1.751) 2.945 26.312 ( 0.056 -1.512 -2.525) 2.944 26.575 ( 0.325 1.058 1.379) 1.768 26.624 ( 1.502 -1.006 2.444) 3.040 27.078 ( -2.995 -0.128 -4.453) 5.368 27.745 ( -1.419 2.391 11.785) 12.109 27.824 ( -1.964 -4.540 -1.279) 5.109 28.078 ( -3.201 2.017 -2.234) 4.394 28.369 ( -1.922 -8.143 -0.573) 8.386 28.485 ( 0.131 -3.974 -1.599) 4.285 29.328 ( 3.590 -0.153 5.599) 6.653 30.826 ( 9.591 13.039 -9.693) 18.867 ======================= Grid point 117 (52/140) ======================= q-point: (-0.44 -0.67 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 7.23e-05 7.23e-05 7.23e-05 7.23e-05 7.23e-05 7.23e-05 7.23e-05 7.23e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 243 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.572 ( -0.739 -17.134 -0.271) 17.152 1.855 ( -5.222 -6.555 1.303) 8.481 2.081 ( 4.813 -5.374 -0.820) 7.261 2.164 ( -0.779 -7.717 -8.010) 11.150 2.249 ( 6.337 -10.449 -3.084) 12.604 2.426 ( -5.003 -11.867 -3.573) 13.365 2.614 ( 0.796 -7.438 0.282) 7.485 2.679 ( -6.196 -5.185 -2.555) 8.474 2.775 ( -1.327 -12.174 4.083) 12.909 3.046 ( 1.554 0.706 3.589) 3.974 3.095 ( 2.618 0.655 6.703) 7.226 3.124 ( 0.221 -2.944 2.755) 4.038 3.190 ( -0.777 1.324 -12.469) 12.564 3.484 ( -0.942 1.486 -0.227) 1.774 3.686 ( -1.941 7.823 8.630) 11.808 3.860 ( -2.138 -0.943 6.545) 6.949 3.929 ( -1.982 0.083 0.426) 2.028 4.254 ( 1.677 -10.801 -1.103) 10.986 4.345 ( -0.650 -6.877 -0.694) 6.943 4.511 ( 7.243 -5.829 -8.464) 12.573 4.649 ( 0.839 -0.251 -1.295) 1.563 4.816 ( -4.356 0.674 -0.549) 4.442 4.839 ( 5.487 1.140 -7.088) 9.035 5.081 ( -1.320 1.996 -2.379) 3.374 5.281 ( -3.276 -5.034 -3.808) 7.112 5.366 ( -1.555 8.465 1.888) 8.811 5.537 ( 3.108 -4.845 6.425) 8.626 5.895 ( 0.364 2.615 3.539) 4.415 5.936 ( 5.384 3.013 5.955) 8.575 6.178 ( -2.183 3.628 -7.600) 8.700 6.342 ( 7.727 1.113 2.329) 8.147 6.398 ( -2.779 6.321 -0.107) 6.906 6.582 ( -2.404 3.003 1.811) 4.252 6.743 ( -0.613 0.640 -4.671) 4.754 6.938 ( -1.989 3.726 4.410) 6.106 7.009 ( -5.640 3.874 2.728) 7.367 7.083 ( 4.206 -2.216 6.067) 7.707 7.224 ( -4.079 -1.618 -0.612) 4.430 7.643 ( -1.831 -4.018 -2.525) 5.087 7.759 ( 1.946 1.339 -2.265) 3.273 8.605 ( -2.697 -3.392 2.023) 4.783 8.807 ( -0.045 -8.615 9.585) 12.888 8.886 ( -1.628 -9.977 0.947) 10.153 9.009 ( -3.908 -7.922 1.015) 8.892 9.256 ( 2.056 -6.938 4.473) 8.507 9.419 ( -0.067 0.793 -0.898) 1.200 9.902 ( -1.267 9.985 -0.385) 10.073 10.007 ( 1.840 -6.083 -4.490) 7.782 10.263 ( -1.105 2.106 -3.872) 4.544 10.830 ( 0.484 -1.820 -15.449) 15.563 10.992 ( 1.799 -2.779 -3.612) 4.900 11.199 ( 3.572 -3.854 3.749) 6.455 11.372 ( 4.726 -9.963 8.471) 13.905 11.540 ( 0.514 4.813 -1.445) 5.051 11.623 ( -1.445 -0.056 0.411) 1.503 11.760 ( 0.794 -0.411 -2.895) 3.030 11.835 ( -0.933 4.171 -2.220) 4.816 12.115 ( 2.120 -1.850 3.040) 4.142 12.243 ( -6.634 -1.115 -1.227) 6.838 12.342 ( 3.580 -2.005 -2.340) 4.723 12.499 ( -8.233 -1.673 -6.708) 10.750 12.606 ( -5.567 -4.711 -1.278) 7.404 12.710 ( 9.023 8.054 6.629) 13.793 13.273 ( -4.434 13.586 -1.098) 14.334 14.753 ( -2.312 1.793 -0.367) 2.948 14.799 ( -0.500 0.830 3.265) 3.405 15.103 ( 0.012 -5.785 0.158) 5.788 15.198 ( 1.522 8.216 -0.180) 8.357 15.330 ( -1.084 -1.280 0.103) 1.680 15.640 ( 0.587 2.582 -3.847) 4.670 15.665 ( -0.149 -1.025 -1.354) 1.705 15.835 ( 5.856 1.312 1.988) 6.322 15.907 ( 2.960 3.490 -4.663) 6.533 16.064 ( -4.245 2.022 3.303) 5.747 16.243 ( -2.282 1.058 5.706) 6.236 16.564 ( -1.483 -6.510 1.908) 6.944 17.559 ( 8.460 10.090 2.273) 13.362 17.676 ( -0.302 0.545 1.820) 1.924 17.678 ( -2.288 5.626 1.209) 6.192 18.112 ( 0.272 -0.863 -1.920) 2.123 25.749 ( 0.206 -1.559 0.751) 1.742 25.785 ( 0.752 -1.423 0.050) 1.610 25.855 ( -0.975 -1.910 -0.806) 2.291 25.896 ( -1.683 -1.165 1.047) 2.300 26.067 ( -1.220 2.973 -2.934) 4.351 26.338 ( 1.406 -2.274 -2.826) 3.890 26.576 ( -0.125 -0.242 1.972) 1.991 26.657 ( 0.160 -0.392 3.422) 3.448 27.039 ( -2.006 -1.069 -7.944) 8.263 27.617 ( -6.624 7.956 -1.708) 10.492 27.920 ( 1.931 -5.442 4.750) 7.477 28.159 ( 2.081 -6.827 7.078) 10.052 28.505 ( 0.512 -8.197 0.184) 8.215 28.561 ( -0.293 -6.545 -1.854) 6.809 29.373 ( 0.319 0.159 5.782) 5.793 30.549 ( 6.174 21.437 -8.360) 23.823 ======================= Grid point 118 (53/140) ======================= q-point: (-0.33 -0.67 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 7.23e-05 7.23e-05 7.23e-05 7.23e-05 7.23e-05 7.23e-05 7.23e-05 7.23e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 243 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.713 ( -7.436 -0.395 4.408) 8.653 2.009 ( -0.571 -13.665 0.973) 13.712 2.071 ( -2.390 -0.391 -3.258) 4.059 2.272 ( 2.422 -4.467 1.133) 5.207 2.461 ( 0.299 -10.692 -13.247) 17.026 2.556 ( 1.280 -6.908 2.105) 7.334 2.673 ( -3.783 -4.495 -5.910) 8.333 2.773 ( 0.736 -9.053 -0.456) 9.095 2.928 ( 3.445 5.051 -4.862) 7.811 3.012 ( 0.405 -6.385 5.221) 8.257 3.124 ( 0.243 -2.873 -3.513) 4.545 3.216 ( 2.957 0.693 7.854) 8.421 3.253 ( 0.983 -8.653 2.683) 9.113 3.457 ( -2.207 0.286 3.026) 3.756 3.665 ( -0.018 -1.446 5.052) 5.255 3.877 ( -0.397 1.956 5.200) 5.570 3.919 ( -3.905 -1.895 0.903) 4.434 4.295 ( -4.895 -0.319 -5.158) 7.118 4.509 ( 1.738 0.025 -9.552) 9.709 4.531 ( 2.318 -5.406 2.551) 6.411 4.642 ( 0.259 1.715 -1.953) 2.612 4.734 ( 0.374 2.488 -5.717) 6.247 4.835 ( 1.593 0.227 -1.735) 2.366 5.121 ( -0.040 -6.990 -7.845) 10.507 5.227 ( 2.588 7.612 4.920) 9.426 5.353 ( -2.063 -6.379 0.655) 6.736 5.636 ( 0.039 -3.954 -1.562) 4.251 5.906 ( 2.619 1.500 8.883) 9.381 5.976 ( 4.234 2.464 7.990) 9.372 6.069 ( -0.485 2.766 -6.085) 6.702 6.256 ( -5.219 5.351 1.537) 7.632 6.422 ( 6.026 -1.431 -2.331) 6.617 6.527 ( -4.097 1.614 2.914) 5.280 6.741 ( 3.115 -1.860 -1.914) 4.102 6.863 ( -1.599 4.146 1.878) 4.824 6.938 ( -4.580 2.007 4.080) 6.454 7.161 ( 2.672 -0.034 6.598) 7.119 7.249 ( -1.454 -4.180 -1.747) 4.758 7.626 ( -1.563 2.060 -4.786) 5.440 7.745 ( -1.575 -0.997 -4.200) 4.595 8.647 ( -0.525 -1.782 5.714) 6.008 8.998 ( -1.544 -8.779 6.654) 11.124 9.078 ( 2.164 -10.272 5.100) 11.671 9.118 ( 0.061 -6.514 -0.843) 6.569 9.372 ( 1.405 -1.082 0.414) 1.821 9.480 ( -0.182 -9.015 2.243) 9.292 9.739 ( -2.141 7.196 2.296) 7.851 10.066 ( -1.229 -2.258 -5.817) 6.360 10.196 ( 0.129 2.305 -1.702) 2.868 10.792 ( 2.194 -0.480 -9.992) 10.242 11.032 ( 1.517 -1.420 -2.818) 3.502 11.247 ( -2.632 1.995 1.192) 3.512 11.424 ( 2.523 2.767 -0.549) 3.784 11.564 ( -4.885 -0.723 2.089) 5.362 11.642 ( 5.550 -1.524 7.156) 9.183 11.700 ( 1.736 7.634 2.878) 8.341 11.851 ( 2.944 -7.889 -11.056) 13.897 12.145 ( -2.184 -1.204 -4.850) 5.454 12.173 ( -5.391 2.075 -1.327) 5.927 12.372 ( 2.585 0.393 -1.428) 2.979 12.452 ( -3.072 -0.517 -2.951) 4.290 12.638 ( 0.117 -1.290 -0.629) 1.440 12.746 ( 5.870 -1.692 4.589) 7.641 13.013 ( -3.249 9.444 -0.193) 9.989 14.733 ( -1.183 -1.194 -0.603) 1.786 14.811 ( -0.877 -0.771 1.869) 2.204 15.095 ( -0.243 3.129 -0.912) 3.269 15.174 ( 1.719 -1.136 -2.726) 3.418 15.352 ( -0.843 -1.405 3.901) 4.231 15.591 ( -0.829 -0.141 -4.499) 4.577 15.676 ( 0.760 0.210 -0.912) 1.205 15.808 ( -1.113 4.832 -0.976) 5.053 15.891 ( 4.395 -0.266 0.318) 4.414 16.008 ( 0.363 3.883 3.215) 5.055 16.250 ( -2.930 -0.417 7.257) 7.837 16.653 ( -0.579 -4.413 0.366) 4.466 17.372 ( -5.293 11.189 0.152) 12.378 17.574 ( 0.103 6.789 0.765) 6.833 17.736 ( 5.889 -1.276 3.655) 7.048 18.117 ( 0.731 -0.671 -2.694) 2.871 25.760 ( -0.916 0.164 1.071) 1.419 25.833 ( 0.659 -2.729 0.888) 2.945 25.862 ( -0.705 -0.338 -0.465) 0.910 25.911 ( -1.277 -1.564 -0.914) 2.216 25.999 ( -0.354 2.627 -1.463) 3.028 26.374 ( 2.633 -1.841 -3.984) 5.118 26.590 ( -1.059 -1.040 -0.309) 1.516 26.689 ( -0.259 -0.895 7.511) 7.569 26.994 ( -2.220 -0.735 -11.084) 11.328 27.453 ( -4.837 4.634 -1.072) 6.784 28.046 ( 2.129 -3.945 5.853) 7.372 28.348 ( 4.902 -7.450 9.149) 12.776 28.618 ( 3.610 -4.678 -2.539) 6.431 28.708 ( -0.668 -11.016 0.259) 11.040 29.375 ( -2.768 1.430 3.555) 4.727 30.147 ( 1.285 24.384 -7.620) 25.579 ======================= Grid point 119 (54/140) ======================= q-point: (-0.22 0.33 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 7.23e-05 7.23e-05 7.23e-05 7.23e-05 7.23e-05 7.23e-05 7.23e-05 7.23e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 243 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.627 ( -5.105 6.417 7.505) 11.116 2.068 ( -2.287 -2.521 -1.333) 3.656 2.161 ( -4.178 -1.102 -1.140) 4.469 2.323 ( 1.727 -3.175 2.609) 4.458 2.503 ( -0.971 -1.606 -5.466) 5.779 2.661 ( 4.116 -0.215 2.842) 5.007 2.726 ( 0.255 -5.865 -7.156) 9.255 2.837 ( 1.044 1.433 -2.401) 2.985 2.962 ( 5.048 -6.661 -1.592) 8.508 3.088 ( 2.730 -2.773 0.344) 3.906 3.178 ( 3.053 3.895 3.274) 5.934 3.261 ( 0.936 -6.688 0.795) 6.800 3.401 ( -0.728 -6.373 2.816) 7.006 3.492 ( -2.692 -1.020 9.283) 9.719 3.704 ( -4.819 -1.964 -1.201) 5.341 3.831 ( 2.615 5.095 -0.802) 5.782 3.963 ( -3.010 -4.808 4.591) 7.297 4.190 ( -3.612 3.987 -6.612) 8.524 4.377 ( -2.470 6.095 0.278) 6.582 4.582 ( -1.153 2.781 1.199) 3.240 4.676 ( 0.537 -4.552 -11.014) 11.930 4.705 ( 2.598 -0.836 -2.450) 3.668 4.825 ( 4.764 3.259 1.959) 6.095 5.102 ( -7.548 -2.044 -1.084) 7.895 5.284 ( 10.143 -1.721 -3.103) 10.746 5.452 ( 1.665 -4.685 0.818) 5.039 5.669 ( -1.303 -2.211 -3.996) 4.749 5.899 ( -1.158 4.117 4.895) 6.500 5.975 ( -3.415 3.898 7.860) 9.414 6.038 ( 3.825 -0.200 -4.197) 5.682 6.165 ( -1.257 2.861 2.843) 4.225 6.442 ( 1.312 1.281 -1.937) 2.668 6.516 ( -6.055 -4.055 1.165) 7.380 6.792 ( 5.685 4.038 4.042) 8.060 6.855 ( 2.095 -3.341 0.859) 4.036 6.898 ( -3.287 -0.124 1.329) 3.548 7.219 ( 2.142 -2.469 -0.075) 3.269 7.292 ( -2.104 -2.531 2.604) 4.197 7.537 ( -1.670 2.836 -5.565) 6.465 7.716 ( -3.659 -0.956 -5.202) 6.431 8.724 ( 2.135 -2.963 6.706) 7.636 9.124 ( -3.868 -5.765 1.964) 7.215 9.211 ( 2.046 -4.741 -3.059) 6.002 9.262 ( 2.948 -3.319 8.800) 9.857 9.399 ( -0.975 -2.621 0.219) 2.805 9.537 ( -0.769 3.303 0.743) 3.472 9.749 ( -0.920 -5.589 5.938) 8.206 9.990 ( -1.777 3.913 -5.231) 6.770 10.201 ( 0.029 -1.769 -0.053) 1.770 10.787 ( 1.623 -0.136 -1.971) 2.557 11.009 ( 0.784 2.989 -2.382) 3.902 11.140 ( -1.645 5.824 -1.967) 6.364 11.444 ( 5.505 -0.345 -0.753) 5.567 11.544 ( -3.624 -1.519 1.619) 4.249 11.588 ( -1.106 6.306 2.039) 6.719 11.720 ( 2.243 -0.295 0.776) 2.391 11.934 ( 2.762 -2.057 -0.711) 3.516 12.077 ( -4.779 1.621 -4.252) 6.599 12.090 ( -2.220 3.423 -5.938) 7.205 12.349 ( -0.490 2.705 -1.622) 3.192 12.443 ( 1.283 -0.613 -0.771) 1.618 12.589 ( 6.076 4.693 -8.222) 11.249 12.866 ( -2.895 -8.223 5.768) 10.453 13.043 ( 3.068 -9.030 4.246) 10.439 14.742 ( 0.808 1.414 1.819) 2.441 14.834 ( -1.744 -3.222 -0.990) 3.795 15.078 ( -1.808 -2.134 -1.951) 3.410 15.146 ( 2.192 2.990 -1.912) 4.171 15.398 ( -1.021 -1.488 3.561) 3.992 15.575 ( -0.381 0.431 -2.652) 2.714 15.657 ( 0.178 1.902 -0.839) 2.087 15.722 ( -3.565 0.845 -2.867) 4.652 15.906 ( -1.551 1.530 2.162) 3.070 16.022 ( 9.145 -0.763 2.582) 9.533 16.275 ( -3.979 -1.132 7.750) 8.785 16.707 ( 0.668 -2.231 -0.857) 2.481 17.143 ( -8.352 9.623 0.330) 12.746 17.471 ( 0.210 5.289 -0.030) 5.293 17.817 ( 5.276 -1.468 1.197) 5.605 18.120 ( 1.443 -0.376 -3.038) 3.384 25.749 ( -0.907 0.923 2.081) 2.451 25.850 ( -1.065 0.332 -0.066) 1.117 25.882 ( 0.065 -0.472 0.860) 0.983 25.909 ( 0.147 -0.634 -0.695) 0.952 25.977 ( -0.167 -0.463 0.025) 0.493 26.394 ( 3.227 -0.572 -5.164) 6.116 26.591 ( -1.497 -0.974 -1.292) 2.204 26.757 ( -0.631 -2.438 7.690) 8.092 26.921 ( -2.080 0.993 -8.606) 8.909 27.378 ( -3.485 0.359 -0.795) 3.593 28.129 ( -0.510 -1.929 4.858) 5.252 28.564 ( 5.452 -6.733 9.109) 12.572 28.720 ( 7.963 -4.762 -2.095) 9.512 28.891 ( 1.639 -10.087 0.112) 10.220 29.308 ( -4.487 4.309 -0.082) 6.221 29.710 ( -3.591 21.717 -6.378) 22.917 ======================= Grid point 120 (55/140) ======================= q-point: (-0.11 0.33 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 7.23e-05 7.23e-05 7.23e-05 7.23e-05 7.23e-05 7.23e-05 7.23e-05 7.23e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 243 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.518 ( 0.651 9.160 9.772) 13.409 1.982 ( -2.764 9.772 2.012) 10.353 2.147 ( -0.582 -2.033 -2.475) 3.256 2.345 ( -1.431 7.220 7.040) 10.185 2.507 ( 1.023 -2.095 -0.804) 2.466 2.646 ( 3.319 6.646 4.001) 8.437 2.772 ( 4.278 -0.433 -4.898) 6.518 2.828 ( 0.312 -1.363 -2.412) 2.788 3.036 ( 2.041 -0.840 -1.987) 2.970 3.137 ( 2.684 1.672 0.112) 3.164 3.191 ( 3.452 -0.195 2.880) 4.500 3.362 ( -4.202 -3.821 -3.504) 6.673 3.442 ( -2.922 4.409 3.670) 6.438 3.502 ( -1.030 0.326 4.584) 4.709 3.663 ( -4.474 -3.431 -2.728) 6.263 3.764 ( -0.215 3.232 -0.017) 3.239 4.010 ( -0.304 1.047 -2.234) 2.486 4.126 ( -0.136 -0.060 -1.257) 1.266 4.282 ( -1.003 4.454 7.630) 8.892 4.558 ( -4.161 0.647 3.776) 5.656 4.661 ( 3.921 -1.142 -5.860) 7.142 4.707 ( 2.538 -1.118 -8.782) 9.210 4.860 ( 6.239 0.677 2.914) 6.919 5.083 ( -8.232 -1.728 0.816) 8.450 5.332 ( 6.806 1.508 -7.874) 10.516 5.530 ( 4.348 -1.627 1.253) 4.809 5.650 ( -2.186 0.541 -3.980) 4.573 5.839 ( -0.572 4.439 2.732) 5.243 5.907 ( -4.197 0.616 2.583) 4.966 6.041 ( 3.552 1.530 -3.554) 5.253 6.173 ( 0.633 -0.742 5.652) 5.735 6.421 ( 0.088 0.230 -1.825) 1.842 6.542 ( -8.221 -4.512 0.236) 9.380 6.764 ( -0.465 3.703 0.953) 3.852 6.845 ( 4.045 4.040 4.481) 7.265 6.987 ( 2.314 -5.666 -2.109) 6.474 7.241 ( -0.705 -1.614 -5.896) 6.154 7.331 ( -0.165 -0.460 2.054) 2.111 7.502 ( -4.239 -3.883 -0.463) 5.768 7.695 ( -1.554 -2.186 -2.013) 3.354 8.831 ( 1.804 -3.617 5.477) 6.807 9.125 ( -6.974 0.724 -3.036) 7.640 9.252 ( 0.706 2.319 -1.334) 2.767 9.300 ( 1.705 2.196 4.116) 4.968 9.427 ( -4.073 -1.702 -2.113) 4.894 9.504 ( 0.229 0.941 4.278) 4.386 9.760 ( -1.746 4.399 3.211) 5.719 9.960 ( 0.148 -0.725 2.117) 2.242 10.227 ( -0.315 -1.445 -0.164) 1.488 10.787 ( -2.940 -0.569 4.392) 5.316 10.995 ( 5.623 1.563 -0.451) 5.854 11.039 ( 3.753 4.344 -2.284) 6.178 11.418 ( 0.848 5.565 -0.822) 5.689 11.549 ( 4.138 1.482 -2.054) 4.852 11.598 ( -3.639 -6.651 -2.930) 8.128 11.696 ( 2.975 1.843 0.715) 3.572 11.946 ( -0.523 3.964 2.310) 4.617 11.992 ( 0.581 3.636 -3.278) 4.930 12.044 ( -1.648 -3.884 3.030) 5.195 12.281 ( 0.085 2.666 -4.959) 5.631 12.443 ( 1.940 1.150 -4.904) 5.397 12.596 ( 5.105 -4.705 -7.919) 10.531 13.004 ( -6.020 -7.699 6.985) 12.012 13.275 ( -1.389 -13.255 4.769) 14.155 14.715 ( 0.988 3.547 3.836) 5.317 14.856 ( -0.404 -0.295 -0.671) 0.837 15.069 ( -3.054 0.668 -1.229) 3.359 15.173 ( 0.877 -6.673 -1.579) 6.913 15.390 ( 0.262 3.768 0.929) 3.889 15.538 ( -0.341 1.300 -0.920) 1.629 15.609 ( -0.157 3.369 0.290) 3.385 15.713 ( -1.274 -3.106 -4.607) 5.700 15.870 ( -2.699 1.246 2.064) 3.619 16.163 ( 7.759 -5.299 0.223) 9.398 16.303 ( -4.629 -2.350 7.894) 9.448 16.736 ( 2.980 -0.581 -1.113) 3.233 16.931 ( -8.288 8.059 0.417) 11.568 17.412 ( 1.868 2.750 0.940) 3.455 17.873 ( 3.498 -1.655 -3.297) 5.084 18.122 ( 1.996 0.006 -2.947) 3.559 25.737 ( -0.406 1.365 2.600) 2.964 25.832 ( 0.136 1.111 -0.455) 1.209 25.868 ( -0.538 1.185 2.356) 2.691 25.942 ( 0.077 -1.304 1.997) 2.386 25.990 ( -0.673 -1.433 -0.693) 1.729 26.400 ( 3.953 0.004 -4.803) 6.220 26.583 ( -1.621 -0.018 -1.465) 2.184 26.758 ( -4.174 0.623 -8.925) 9.873 26.925 ( 1.565 -1.959 11.338) 11.612 27.361 ( -3.121 -1.654 -1.770) 3.951 28.151 ( -2.909 -0.033 3.432) 4.499 28.666 ( -0.735 -1.036 0.071) 1.272 28.878 ( 3.653 -4.427 -2.237) 6.160 29.069 ( 3.003 -0.205 6.026) 6.736 29.217 ( 7.276 -1.520 -2.624) 7.883 29.341 ( -4.864 11.356 -4.409) 13.117 ======================= Grid point 125 (56/140) ======================= q-point: (-0.56 -0.56 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 7.23e-05 7.23e-05 7.23e-05 7.23e-05 7.23e-05 7.23e-05 7.23e-05 7.23e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 135 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.239 ( 6.694 0.000 -14.958) 16.388 1.464 ( 0.240 0.000 -7.308) 7.312 1.838 ( 0.091 0.000 -9.852) 9.852 1.854 ( -10.632 -0.000 11.117) 15.382 2.202 ( -0.075 -0.000 0.081) 0.110 2.244 ( 9.734 0.000 6.349) 11.621 2.476 ( -2.527 -0.000 -3.186) 4.067 2.495 ( 1.743 0.000 -3.225) 3.666 2.635 ( -9.284 -0.000 -1.066) 9.345 2.944 ( 2.420 0.000 13.603) 13.817 3.093 ( 0.283 0.000 -0.571) 0.637 3.202 ( -0.399 -0.000 -8.950) 8.959 3.232 ( 1.512 0.000 2.583) 2.993 3.696 ( 3.933 0.000 -5.193) 6.515 3.714 ( -5.174 -0.000 0.720) 5.223 3.918 ( -4.605 -0.000 -0.972) 4.706 3.926 ( 2.336 0.000 -1.428) 2.738 3.997 ( 0.898 0.000 13.924) 13.953 4.229 ( 4.192 0.000 -4.568) 6.200 4.253 ( -1.733 -0.000 0.573) 1.825 4.661 ( -2.061 -0.000 -0.671) 2.167 4.769 ( -6.798 -0.000 4.018) 7.897 4.858 ( 8.743 0.000 -12.532) 15.280 5.142 ( -4.084 -0.000 -4.910) 6.386 5.261 ( 2.463 0.000 -3.517) 4.294 5.444 ( 3.563 0.000 7.727) 8.509 5.541 ( 1.287 0.000 2.728) 3.016 5.964 ( 4.298 0.000 5.798) 7.218 6.021 ( -0.885 -0.000 2.086) 2.266 6.163 ( -2.029 -0.000 -5.735) 6.083 6.492 ( 2.476 0.000 4.210) 4.884 6.576 ( -0.810 -0.000 -1.108) 1.373 6.589 ( -1.756 -0.000 0.137) 1.761 6.780 ( 1.781 0.000 -6.910) 7.136 6.951 ( 1.194 0.000 1.855) 2.206 7.089 ( -3.403 -0.000 3.302) 4.741 7.143 ( -5.201 -0.000 3.895) 6.498 7.195 ( -3.688 -0.000 3.541) 5.113 7.439 ( -0.467 -0.000 -0.844) 0.965 7.849 ( 3.451 0.000 -3.522) 4.931 8.416 ( 2.270 0.000 -2.856) 3.648 8.693 ( -6.024 -0.000 11.126) 12.652 8.703 ( -3.331 -0.000 7.986) 8.653 8.839 ( -3.941 -0.000 -2.840) 4.857 9.165 ( 1.425 0.000 5.735) 5.909 9.551 ( 2.681 0.000 -1.629) 3.137 9.757 ( 2.962 0.000 -7.731) 8.279 10.137 ( -0.058 -0.000 -1.054) 1.055 10.259 ( -3.997 -0.000 -4.861) 6.293 10.664 ( -1.427 -0.000 -18.838) 18.892 10.960 ( -0.398 -0.000 1.038) 1.111 11.079 ( 5.779 0.000 -2.011) 6.119 11.239 ( 4.656 0.000 12.740) 13.564 11.533 ( -2.124 -0.000 0.615) 2.212 11.718 ( 4.735 0.000 -4.874) 6.795 11.751 ( -3.672 -0.000 0.904) 3.782 11.947 ( -0.568 -0.000 -1.788) 1.877 12.065 ( 0.515 0.000 3.723) 3.759 12.163 ( -2.699 -0.000 -3.208) 4.192 12.278 ( -3.876 -0.000 1.310) 4.091 12.475 ( -8.262 -0.000 -1.398) 8.380 12.553 ( -2.424 -0.000 -7.606) 7.983 12.892 ( 8.316 0.000 6.148) 10.342 13.523 ( -2.285 -0.000 -1.273) 2.616 14.840 ( -1.249 -0.000 0.137) 1.256 14.875 ( 0.548 0.000 0.729) 0.912 14.966 ( -4.175 -0.000 5.397) 6.823 15.192 ( 2.299 0.000 -0.195) 2.307 15.550 ( -3.695 -0.000 -3.119) 4.835 15.564 ( 1.647 0.000 2.022) 2.608 15.732 ( 1.758 0.000 -6.178) 6.423 15.813 ( 5.280 0.000 -3.071) 6.108 16.034 ( -4.658 -0.000 5.445) 7.165 16.044 ( 7.101 0.000 -1.218) 7.204 16.327 ( 0.228 0.000 1.474) 1.491 16.350 ( -4.488 -0.000 4.814) 6.581 17.644 ( 7.133 0.000 3.401) 7.902 17.786 ( -9.374 -0.000 4.090) 10.228 17.818 ( 8.518 0.000 -1.022) 8.579 18.090 ( 0.601 0.000 -1.021) 1.185 25.705 ( 0.850 0.000 0.367) 0.926 25.775 ( 1.549 0.000 -1.428) 2.107 25.799 ( -1.900 -0.000 1.105) 2.198 25.874 ( -1.986 -0.000 0.815) 2.147 26.121 ( -1.779 -0.000 -3.731) 4.134 26.293 ( 0.872 0.000 -1.674) 1.887 26.599 ( -0.699 -0.000 0.365) 0.788 26.618 ( 0.206 0.000 1.853) 1.865 27.036 ( -2.274 -0.000 -4.713) 5.233 27.723 ( -6.852 -0.000 -11.560) 13.439 27.787 ( -2.953 -0.000 13.600) 13.916 28.164 ( 6.440 0.000 5.961) 8.775 28.263 ( -0.551 -0.000 1.346) 1.455 28.449 ( 0.570 0.000 -1.277) 1.398 29.380 ( 1.000 0.000 8.237) 8.297 30.956 ( 8.181 0.000 -10.696) 13.466 ======================= Grid point 126 (57/140) ======================= q-point: (-0.44 -0.56 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 7.23e-05 7.23e-05 7.23e-05 7.23e-05 7.23e-05 7.23e-05 7.23e-05 7.23e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 243 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.283 ( 3.484 -11.393 -9.178) 15.039 1.679 ( -1.665 -16.452 -3.638) 16.931 1.830 ( 2.193 -10.759 -4.511) 11.871 1.965 ( -2.360 -11.516 -1.718) 11.880 2.197 ( -7.902 0.299 -0.242) 7.912 2.268 ( -5.775 -4.179 -1.623) 7.311 2.501 ( 1.027 -3.623 -2.732) 4.652 2.539 ( -2.453 -6.122 -1.854) 6.851 2.647 ( 4.155 -4.500 3.917) 7.270 3.049 ( 2.590 -2.046 4.591) 5.654 3.114 ( 1.863 -0.575 5.142) 5.499 3.147 ( 0.925 0.527 -3.380) 3.543 3.200 ( -1.776 3.346 -2.291) 4.426 3.571 ( 3.162 6.382 1.600) 7.300 3.768 ( -8.513 -2.680 -5.806) 10.647 3.864 ( 0.622 5.669 2.792) 6.350 3.914 ( -2.547 -1.450 5.306) 6.061 4.110 ( 2.529 -6.203 4.264) 7.940 4.234 ( -1.245 -4.151 -0.681) 4.387 4.384 ( 4.152 -9.752 -6.553) 12.461 4.643 ( -1.026 -0.188 -1.365) 1.719 4.741 ( -5.487 -0.512 0.800) 5.569 4.874 ( 8.711 -0.041 -8.091) 11.888 5.081 ( -5.144 0.820 -4.085) 6.620 5.237 ( 2.069 2.363 -0.684) 3.214 5.502 ( 1.390 2.949 2.917) 4.375 5.539 ( 2.491 0.381 4.662) 5.299 5.987 ( 2.631 3.665 6.464) 7.883 6.033 ( 3.414 0.561 3.957) 5.256 6.142 ( -1.927 -1.055 -4.542) 5.045 6.460 ( -8.136 5.771 -2.401) 10.260 6.470 ( 4.869 4.833 1.261) 6.975 6.594 ( -1.998 0.270 1.812) 2.711 6.736 ( 0.931 1.654 -7.461) 7.698 6.977 ( -1.967 -0.143 2.493) 3.179 7.065 ( -1.402 5.000 4.489) 6.864 7.120 ( 2.436 0.483 6.121) 6.606 7.191 ( -1.536 -0.917 2.434) 3.020 7.523 ( 0.822 -7.235 -1.612) 7.458 7.805 ( 0.617 4.174 -3.947) 5.778 8.513 ( 4.202 -6.926 -0.408) 8.112 8.720 ( -4.820 -5.409 5.593) 9.153 8.771 ( -1.962 -4.403 9.492) 10.646 8.868 ( -1.426 -5.993 2.881) 6.800 9.215 ( -0.416 -2.811 6.203) 6.823 9.463 ( 1.021 5.738 -2.335) 6.279 9.879 ( 3.978 -8.576 -6.600) 11.529 10.035 ( -2.060 8.086 -2.611) 8.743 10.234 ( -1.457 -1.626 -5.887) 6.279 10.645 ( 0.870 -8.465 -20.627) 22.313 10.957 ( -1.148 -0.781 -0.092) 1.391 11.150 ( 2.578 -4.385 -0.291) 5.095 11.353 ( 4.312 -2.724 13.722) 14.640 11.546 ( -1.301 -1.347 -0.593) 1.965 11.664 ( -2.221 3.490 -4.247) 5.929 11.710 ( -3.224 -0.314 -1.878) 3.744 11.921 ( 2.743 3.668 0.150) 4.582 12.090 ( -3.027 -0.991 1.542) 3.539 12.194 ( 2.371 -2.974 -0.067) 3.804 12.268 ( -2.992 -3.413 -4.589) 6.454 12.395 ( -5.148 -0.611 -6.130) 8.028 12.524 ( -0.961 -0.650 -2.074) 2.376 12.939 ( 8.000 5.983 7.991) 12.793 13.425 ( -2.693 8.007 -3.216) 9.039 14.785 ( -2.874 3.951 0.089) 4.887 14.850 ( 0.989 2.836 3.055) 4.284 15.027 ( 0.644 -4.509 3.766) 5.910 15.243 ( -0.360 -4.521 -0.856) 4.615 15.394 ( 0.297 11.094 -1.411) 11.187 15.625 ( 1.029 -2.610 -0.822) 2.923 15.682 ( 0.278 3.310 -5.184) 6.157 15.867 ( 5.197 -2.202 -1.666) 5.885 15.975 ( -2.254 4.591 1.837) 5.434 16.093 ( 2.468 0.454 2.046) 3.238 16.280 ( -2.395 2.215 4.964) 5.940 16.442 ( -2.050 -7.180 2.244) 7.797 17.675 ( -10.340 5.269 1.663) 11.724 17.715 ( 4.800 0.096 3.691) 6.056 17.834 ( 8.066 5.713 3.442) 10.466 18.093 ( 0.617 -0.233 -1.460) 1.602 25.728 ( 0.648 -1.456 0.905) 1.833 25.773 ( -0.266 -0.252 -0.130) 0.389 25.810 ( -0.796 -1.973 -1.067) 2.380 25.869 ( -1.685 -0.762 0.494) 1.914 26.074 ( -1.633 1.368 -4.267) 4.770 26.308 ( 2.026 -1.486 -1.982) 3.200 26.579 ( -1.472 0.448 0.078) 1.541 26.646 ( -0.771 -1.724 2.142) 2.856 26.990 ( -1.627 0.664 -5.601) 5.870 27.589 ( -7.865 1.545 -12.393) 14.759 27.888 ( -0.514 -5.319 12.355) 13.462 28.189 ( 5.880 1.863 8.127) 10.203 28.388 ( 2.974 -7.494 2.913) 8.573 28.475 ( 0.905 -3.238 -2.007) 3.916 29.414 ( -1.818 0.913 9.332) 9.551 30.847 ( 6.152 13.337 -10.609) 18.118 ======================= Grid point 127 (58/140) ======================= q-point: (-0.33 -0.56 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 7.23e-05 7.23e-05 7.23e-05 7.23e-05 7.23e-05 7.23e-05 7.23e-05 7.23e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 243 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.528 ( -2.771 -16.064 -2.087) 16.435 1.793 ( -3.911 -7.862 -0.832) 8.821 2.064 ( -5.803 1.560 0.502) 6.030 2.122 ( -3.969 -15.375 -12.318) 20.097 2.187 ( 3.322 -13.972 2.280) 14.541 2.364 ( -5.480 -12.077 -2.717) 13.537 2.536 ( -2.451 -4.315 -5.821) 7.649 2.657 ( 3.757 -8.951 -0.842) 9.744 2.842 ( 2.548 -10.833 5.612) 12.463 3.043 ( -0.266 -1.969 -7.890) 8.136 3.077 ( 0.820 7.235 -3.706) 8.171 3.202 ( 5.208 -1.726 3.978) 6.777 3.259 ( 3.414 -5.673 11.347) 13.137 3.504 ( 3.174 5.762 -0.377) 6.589 3.740 ( -2.125 -0.262 4.286) 4.791 3.803 ( -5.893 0.368 2.719) 6.501 3.922 ( -3.209 0.045 3.481) 4.734 4.251 ( 1.611 -3.317 -0.601) 3.736 4.288 ( -6.321 -10.128 -5.327) 13.073 4.516 ( 3.423 -3.000 -7.333) 8.631 4.630 ( -0.837 -0.197 -1.360) 1.609 4.709 ( -1.170 -1.232 -7.066) 7.268 4.896 ( 4.981 3.337 2.308) 6.425 5.013 ( -1.674 -1.760 -7.456) 7.841 5.265 ( 0.900 -3.465 4.798) 5.987 5.423 ( 3.683 8.088 4.744) 10.073 5.584 ( 0.829 -1.636 -1.863) 2.614 6.000 ( 3.687 1.025 3.269) 5.033 6.027 ( 0.005 2.344 -3.484) 4.199 6.133 ( 1.721 2.967 7.965) 8.672 6.299 ( -6.584 3.584 -1.018) 7.565 6.436 ( -2.028 2.509 2.285) 3.953 6.565 ( -0.668 3.226 1.283) 3.536 6.721 ( 5.000 -1.936 -4.912) 7.272 6.934 ( -5.133 2.420 3.996) 6.941 6.981 ( 0.149 5.561 4.485) 7.145 7.174 ( 0.398 -2.641 -2.072) 3.380 7.238 ( 4.214 0.403 8.614) 9.598 7.601 ( 0.559 -1.594 -4.308) 4.628 7.712 ( -2.594 2.293 -5.098) 6.163 8.630 ( 2.367 -3.713 3.300) 5.503 8.865 ( 0.163 -10.075 -2.797) 10.457 8.925 ( -1.235 -9.486 13.479) 16.529 9.025 ( 2.216 -8.493 7.473) 11.528 9.335 ( -0.695 -8.172 6.357) 10.377 9.395 ( 0.244 2.072 -1.734) 2.713 9.853 ( -3.000 7.974 -2.584) 8.903 9.965 ( -0.960 -3.599 -7.297) 8.193 10.211 ( 0.499 0.575 -5.190) 5.246 10.712 ( 5.686 -5.905 -15.099) 17.181 10.979 ( -1.898 -3.131 -0.533) 3.700 11.221 ( -2.104 -2.667 -0.932) 3.523 11.493 ( -0.754 3.362 -1.767) 3.873 11.512 ( -3.597 -2.645 7.198) 8.470 11.645 ( 3.728 -8.682 -4.515) 10.472 11.714 ( 0.973 -0.719 1.081) 1.622 11.866 ( 4.189 6.930 2.262) 8.408 12.053 ( -6.822 -0.663 -4.220) 8.049 12.187 ( -3.082 1.878 -2.361) 4.312 12.328 ( -0.315 -6.369 -3.143) 7.109 12.395 ( 2.610 -0.898 -1.794) 3.292 12.558 ( 0.927 -4.983 -0.360) 5.082 12.906 ( 6.142 8.288 6.373) 12.125 13.201 ( -1.198 13.296 -4.486) 14.083 14.706 ( -3.093 1.597 -0.366) 3.500 14.839 ( 1.368 1.698 3.440) 4.073 15.128 ( 1.506 -4.009 1.989) 4.722 15.204 ( 0.830 9.721 -1.952) 9.950 15.311 ( -1.146 -4.439 -0.347) 4.597 15.590 ( -1.058 3.813 -4.180) 5.756 15.668 ( 1.247 -1.459 -0.992) 2.160 15.860 ( -3.445 4.589 -2.083) 6.105 15.935 ( 4.425 0.435 0.991) 4.555 16.102 ( 4.160 2.408 3.345) 5.856 16.266 ( -3.105 0.602 7.067) 7.743 16.555 ( -1.319 -6.601 0.821) 6.781 17.474 ( -11.085 8.904 0.792) 14.240 17.690 ( -3.379 5.913 3.999) 7.898 17.851 ( 12.417 3.849 4.518) 13.762 18.094 ( 0.582 -0.759 -2.746) 2.908 25.752 ( -1.185 -0.669 1.621) 2.117 25.793 ( -0.295 -2.266 -0.028) 2.285 25.835 ( -0.170 -2.208 -1.450) 2.647 25.875 ( -1.018 -1.032 -0.001) 1.450 26.020 ( -0.834 1.612 -2.752) 3.296 26.348 ( 3.651 -1.971 -3.554) 5.463 26.565 ( -1.981 -0.417 -0.351) 2.055 26.686 ( -0.977 -2.162 3.561) 4.279 26.937 ( -1.458 0.764 -5.666) 5.900 27.450 ( -5.538 2.314 -8.279) 10.226 28.032 ( 0.877 -4.212 9.036) 10.008 28.319 ( 6.464 -6.344 9.517) 13.138 28.543 ( 0.116 -7.831 0.095) 7.833 28.555 ( 4.992 -5.586 -1.071) 7.567 29.407 ( -4.137 2.395 8.052) 9.364 30.513 ( 1.211 22.944 -10.545) 25.280 ======================= Grid point 128 (59/140) ======================= q-point: (-0.22 -0.56 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 7.23e-05 7.23e-05 7.23e-05 7.23e-05 7.23e-05 7.23e-05 7.23e-05 7.23e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 243 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.659 ( -4.541 -2.109 5.532) 7.461 1.871 ( -10.774 -9.874 -1.939) 14.742 2.097 ( 0.374 -6.253 -2.860) 6.886 2.215 ( -6.301 -8.145 -7.628) 12.815 2.396 ( 1.433 -8.883 2.454) 9.327 2.544 ( 2.270 -10.593 -5.074) 11.963 2.619 ( -1.004 -7.982 1.462) 8.177 2.848 ( 6.211 -7.639 -0.695) 9.870 2.933 ( 4.877 4.250 -7.956) 10.254 3.062 ( 1.519 -3.707 2.658) 4.808 3.090 ( -0.540 -9.486 -1.809) 9.672 3.267 ( 1.153 0.240 1.993) 2.315 3.403 ( 6.023 -0.003 8.072) 10.071 3.481 ( 0.194 -2.350 3.697) 4.385 3.690 ( -3.345 4.998 5.717) 8.298 3.847 ( -4.804 -6.341 -0.327) 7.962 3.916 ( 1.458 0.439 2.555) 2.974 4.213 ( -0.116 4.224 -5.091) 6.617 4.417 ( -6.337 -10.971 -7.954) 14.959 4.442 ( -5.990 2.530 -0.266) 6.508 4.613 ( -1.534 1.082 -2.281) 2.954 4.713 ( 5.380 0.026 -7.488) 9.220 4.901 ( 1.856 -1.079 1.558) 2.652 5.009 ( -0.311 0.360 -4.574) 4.599 5.384 ( 5.808 -2.280 3.261) 7.040 5.401 ( 5.437 -0.145 8.040) 9.707 5.599 ( 0.581 -2.134 -5.102) 5.561 5.921 ( -3.003 2.258 -9.251) 9.985 6.040 ( -5.384 4.163 6.919) 9.705 6.090 ( 3.657 1.931 3.115) 5.177 6.253 ( 1.545 3.042 5.172) 6.196 6.392 ( -7.348 -1.436 0.582) 7.510 6.498 ( -1.882 3.578 0.761) 4.113 6.801 ( 3.925 -3.760 -1.752) 5.710 6.889 ( -2.980 1.648 4.154) 5.372 6.950 ( 5.483 3.478 7.094) 9.617 7.207 ( 3.836 -1.533 -4.846) 6.368 7.294 ( 1.084 0.453 8.992) 9.068 7.536 ( -4.195 2.851 -5.746) 7.665 7.657 ( -0.910 0.107 -6.207) 6.275 8.731 ( 3.908 -2.803 5.113) 7.020 9.012 ( 0.165 -7.452 0.227) 7.457 9.116 ( 0.459 -7.118 4.076) 8.215 9.219 ( -0.195 -7.036 8.922) 11.364 9.375 ( -0.247 -1.053 0.084) 1.085 9.512 ( 0.811 -6.888 3.661) 7.843 9.724 ( -2.865 2.414 2.503) 4.505 9.947 ( -3.812 -1.975 -8.858) 9.843 10.189 ( 1.667 0.241 -2.779) 3.250 10.770 ( 5.048 -2.090 -6.178) 8.248 11.004 ( -2.724 -1.746 -1.905) 3.755 11.177 ( -3.370 2.629 -2.926) 5.180 11.415 ( -5.703 -0.511 -2.201) 6.134 11.550 ( 2.719 -0.909 4.034) 4.949 11.701 ( 0.041 4.505 -3.116) 5.478 11.785 ( 3.418 6.222 3.811) 8.057 11.844 ( 2.292 -8.110 -3.386) 9.083 12.031 ( 1.179 -2.661 -2.962) 4.153 12.098 ( -5.910 2.457 -3.239) 7.174 12.371 ( -1.286 0.179 -0.060) 1.300 12.442 ( 1.860 -2.193 2.212) 3.629 12.664 ( 6.018 -2.578 -3.699) 7.520 12.817 ( -0.866 6.230 2.649) 6.825 13.027 ( 5.268 3.538 -2.350) 6.767 14.698 ( -1.997 -3.475 -0.674) 4.064 14.838 ( 1.201 1.744 2.889) 3.582 15.062 ( -2.406 3.819 -1.281) 4.692 15.205 ( 5.046 0.337 -2.075) 5.466 15.369 ( -1.376 -2.961 3.242) 4.601 15.528 ( -2.011 -0.952 -3.333) 4.007 15.663 ( -1.639 1.522 -1.716) 2.819 15.746 ( -2.781 4.389 -1.097) 5.311 15.943 ( 2.145 1.827 -0.343) 2.838 16.125 ( 7.275 2.124 3.373) 8.295 16.278 ( -2.807 -0.162 8.178) 8.648 16.645 ( -0.010 -4.831 -0.653) 4.875 17.231 ( -11.644 9.682 1.709) 15.239 17.564 ( -3.929 6.448 2.577) 7.979 17.894 ( 8.647 3.273 2.133) 9.488 18.104 ( 1.490 -1.109 -3.171) 3.675 25.757 ( -1.752 -0.221 2.359) 2.947 25.824 ( -1.155 -1.844 0.120) 2.179 25.865 ( -0.749 -1.967 -0.354) 2.134 25.887 ( 0.497 -1.031 -0.788) 1.389 25.987 ( 0.249 1.093 -0.680) 1.311 26.385 ( 4.899 -1.009 -5.774) 7.639 26.563 ( -1.426 -0.929 0.806) 1.883 26.724 ( -1.772 -1.959 -1.194) 2.899 26.904 ( -0.519 0.114 1.883) 1.957 27.356 ( -2.944 1.049 -5.134) 6.010 28.119 ( -0.887 -1.954 5.991) 6.363 28.537 ( 5.758 -6.314 7.850) 11.604 28.662 ( 4.816 -6.479 -4.582) 9.282 28.740 ( 5.015 -11.435 2.344) 12.705 29.346 ( -5.737 4.301 5.159) 8.833 30.035 ( -4.838 25.032 -9.338) 27.152 ======================= Grid point 129 (60/140) ======================= q-point: (-0.11 -0.56 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 7.23e-05 7.23e-05 7.23e-05 7.23e-05 7.23e-05 7.23e-05 7.23e-05 7.23e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 243 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.644 ( -3.880 1.958 8.666) 9.695 1.997 ( -3.405 -10.630 -0.641) 11.180 2.063 ( -3.815 1.877 -6.378) 7.665 2.342 ( -1.075 -7.714 0.655) 7.816 2.514 ( 0.728 -0.801 6.823) 6.908 2.664 ( -0.387 -6.796 -4.573) 8.200 2.741 ( 3.597 -2.935 1.537) 4.890 2.855 ( 3.807 2.191 -4.007) 5.946 3.004 ( 3.171 -3.415 -3.653) 5.921 3.153 ( 3.126 -3.856 0.650) 5.006 3.193 ( -1.716 -3.134 -0.007) 3.573 3.268 ( 0.555 -1.297 -3.958) 4.202 3.464 ( 4.642 1.976 2.343) 5.562 3.507 ( -6.066 -0.073 6.281) 8.733 3.631 ( -3.170 2.277 3.258) 5.084 3.824 ( -3.508 1.848 0.566) 4.006 4.013 ( 7.307 -3.464 0.544) 8.105 4.128 ( 1.762 2.372 -1.906) 3.517 4.364 ( -4.249 3.186 4.933) 7.248 4.477 ( -11.794 -6.859 -0.824) 13.668 4.615 ( 4.658 -3.523 -5.394) 7.950 4.692 ( 4.563 2.060 -7.645) 9.139 4.935 ( 3.876 2.191 1.380) 4.662 4.975 ( -4.493 -2.593 -4.616) 6.944 5.435 ( 7.751 3.758 1.778) 8.795 5.532 ( 4.993 -3.649 5.052) 7.986 5.610 ( -0.085 -1.278 -4.705) 4.876 5.833 ( -4.043 -0.131 -5.319) 6.682 5.918 ( -7.075 3.793 1.159) 8.112 6.130 ( 5.070 2.120 3.479) 6.504 6.228 ( 2.402 3.413 3.871) 5.692 6.379 ( -11.030 -4.635 0.553) 11.977 6.442 ( 0.468 2.317 -0.013) 2.364 6.828 ( -0.563 2.876 2.144) 3.631 6.874 ( 0.515 -0.975 -0.905) 1.427 7.010 ( 3.858 0.323 7.449) 8.395 7.214 ( 3.299 2.191 -6.370) 7.501 7.352 ( 2.784 -1.481 7.992) 8.591 7.441 ( -3.690 0.645 -3.564) 5.170 7.634 ( -0.326 -1.626 -4.232) 4.545 8.821 ( 2.179 -1.922 4.485) 5.344 9.074 ( -3.128 -0.563 0.676) 3.250 9.216 ( 2.050 -4.978 -4.025) 6.722 9.339 ( -4.195 -4.158 7.237) 9.341 9.369 ( -1.371 2.408 -1.853) 3.333 9.554 ( 0.326 0.992 3.888) 4.026 9.782 ( -1.854 -3.874 3.487) 5.533 9.929 ( 0.290 -2.122 -1.866) 2.841 10.197 ( 0.827 -1.140 -2.211) 2.621 10.775 ( -3.444 0.680 0.140) 3.513 11.006 ( 4.460 -2.297 -4.086) 6.470 11.114 ( -0.497 2.448 -0.183) 2.505 11.420 ( -5.819 -6.692 -1.910) 9.071 11.543 ( 0.750 8.751 -4.241) 9.753 11.618 ( 4.516 2.710 1.901) 5.599 11.743 ( 1.065 1.124 1.173) 1.943 11.935 ( -2.808 -6.473 -0.633) 7.085 12.001 ( -3.271 2.260 0.180) 3.980 12.062 ( 4.561 2.875 -1.312) 5.548 12.336 ( 0.142 3.610 1.141) 3.789 12.465 ( 2.192 1.577 -2.179) 3.470 12.622 ( 8.039 5.449 -5.519) 11.171 12.856 ( -3.308 -7.396 1.396) 8.222 13.104 ( 0.718 -7.394 0.997) 7.495 14.770 ( 0.133 -4.204 1.643) 4.515 14.825 ( 0.679 1.615 1.012) 2.023 15.021 ( -2.020 -1.985 -2.062) 3.503 15.176 ( 3.042 4.764 -0.469) 5.671 15.427 ( -0.063 -1.754 3.653) 4.053 15.540 ( -0.467 -0.791 -2.680) 2.833 15.604 ( -4.759 -1.826 -2.551) 5.700 15.665 ( 0.011 3.620 -1.042) 3.767 15.913 ( 0.563 2.763 0.270) 2.833 16.168 ( 4.444 -0.201 1.056) 4.572 16.300 ( -1.875 0.304 7.999) 8.221 16.713 ( 1.720 -3.201 -1.435) 3.907 17.008 ( -9.319 7.856 2.569) 12.456 17.467 ( -1.675 3.119 1.256) 3.757 17.895 ( 4.123 2.509 -1.622) 5.092 18.119 ( 2.128 -0.618 -2.667) 3.467 25.759 ( -1.474 0.062 3.011) 3.353 25.835 ( -0.619 -0.029 0.206) 0.653 25.879 ( -1.048 -0.975 0.726) 1.605 25.916 ( 0.283 -2.077 -0.018) 2.096 25.976 ( 0.366 0.501 -0.099) 0.628 26.405 ( 5.599 -0.357 -6.175) 8.343 26.573 ( -0.929 -0.120 1.215) 1.533 26.694 ( -3.207 0.099 -6.991) 7.692 26.964 ( 1.984 -1.931 12.015) 12.330 27.312 ( -1.606 -0.488 -4.561) 4.861 28.148 ( -2.572 -0.247 4.023) 4.782 28.640 ( -0.211 -1.305 0.277) 1.351 28.790 ( 3.773 -6.322 -5.949) 9.465 29.045 ( 12.450 -14.588 4.466) 19.692 29.224 ( -6.340 6.543 1.736) 9.275 29.566 ( -6.744 19.742 -4.344) 21.309 ======================= Grid point 135 (61/140) ======================= q-point: (-0.44 -0.44 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 7.23e-05 7.23e-05 7.23e-05 7.23e-05 7.23e-05 7.23e-05 7.23e-05 7.23e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 135 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.243 ( 8.981 0.000 -10.574) 13.873 1.374 ( -2.258 -0.000 -9.897) 10.151 1.790 ( -6.763 -0.000 5.253) 8.563 1.819 ( 5.880 0.000 -2.160) 6.264 2.095 ( -22.789 -0.000 -3.867) 23.114 2.136 ( -3.015 -0.000 -4.740) 5.618 2.446 ( -0.111 -0.000 -0.768) 0.776 2.503 ( -0.398 -0.000 -0.260) 0.476 2.682 ( 6.731 0.000 2.774) 7.280 3.075 ( -4.433 -0.000 -11.063) 11.918 3.109 ( 2.642 0.000 7.546) 7.995 3.171 ( 2.847 0.000 0.696) 2.931 3.210 ( 0.928 0.000 6.249) 6.317 3.560 ( -11.348 -0.000 -0.628) 11.365 3.744 ( 3.716 0.000 -4.184) 5.597 3.896 ( 2.817 0.000 3.115) 4.200 3.910 ( 1.648 0.000 -5.278) 5.529 4.132 ( -5.006 -0.000 1.639) 5.268 4.186 ( 0.885 0.000 5.745) 5.813 4.281 ( 3.854 0.000 -0.486) 3.884 4.618 ( 0.269 0.000 -3.539) 3.549 4.737 ( -3.706 -0.000 5.048) 6.262 4.892 ( 9.476 0.000 -9.307) 13.282 5.034 ( -5.023 -0.000 -0.671) 5.068 5.282 ( 2.679 0.000 -2.366) 3.574 5.524 ( 0.798 0.000 1.735) 1.910 5.605 ( 2.059 0.000 4.645) 5.081 6.007 ( -2.414 -0.000 -8.131) 8.482 6.103 ( 5.959 0.000 4.477) 7.454 6.138 ( 0.336 0.000 10.796) 10.801 6.415 ( -10.225 -0.000 -5.611) 11.663 6.524 ( -2.920 -0.000 2.137) 3.618 6.613 ( 3.895 0.000 1.670) 4.237 6.722 ( 0.790 0.000 -9.327) 9.360 6.957 ( -4.497 -0.000 2.548) 5.168 7.130 ( -6.623 -0.000 0.848) 6.678 7.180 ( 9.902 0.000 4.214) 10.761 7.225 ( 4.133 0.000 9.013) 9.915 7.455 ( 3.056 0.000 -0.422) 3.085 7.827 ( -0.743 -0.000 -5.222) 5.274 8.501 ( 9.116 0.000 1.460) 9.232 8.637 ( -5.888 -0.000 -2.445) 6.375 8.762 ( -0.759 -0.000 10.449) 10.477 8.847 ( -0.801 -0.000 10.810) 10.839 9.204 ( -2.762 -0.000 5.691) 6.325 9.556 ( -0.166 -0.000 -1.330) 1.341 9.775 ( 8.229 0.000 -7.764) 11.314 10.112 ( -1.037 -0.000 -2.191) 2.424 10.133 ( -3.165 -0.000 -8.135) 8.729 10.455 ( 0.255 0.000 -20.910) 20.912 10.933 ( -3.913 -0.000 -0.112) 3.915 11.126 ( 1.244 0.000 -0.664) 1.410 11.427 ( 2.461 0.000 9.710) 10.017 11.535 ( 1.640 0.000 0.911) 1.876 11.564 ( -12.875 -0.000 -3.232) 13.274 11.726 ( 1.612 0.000 -2.790) 3.222 11.980 ( 2.866 0.000 1.153) 3.089 12.073 ( -5.565 -0.000 -8.859) 10.462 12.136 ( 4.271 0.000 1.271) 4.457 12.239 ( -1.524 -0.000 2.688) 3.090 12.332 ( 1.528 0.000 -7.196) 7.357 12.522 ( 1.262 0.000 -0.467) 1.345 13.083 ( 5.238 0.000 7.819) 9.411 13.453 ( -2.616 -0.000 -4.652) 5.337 14.810 ( -1.664 -0.000 -0.291) 1.689 14.910 ( 1.660 0.000 2.606) 3.089 15.016 ( 2.104 0.000 6.568) 6.897 15.173 ( -4.066 -0.000 -0.934) 4.172 15.528 ( 5.601 0.000 -4.370) 7.105 15.585 ( -0.926 -0.000 -1.572) 1.824 15.701 ( 0.743 0.000 -1.777) 1.926 15.861 ( 4.634 0.000 -2.674) 5.350 16.014 ( -4.721 -0.000 5.295) 7.094 16.127 ( 4.704 0.000 -0.638) 4.747 16.306 ( -7.054 -0.000 4.366) 8.296 16.362 ( 1.558 0.000 2.736) 3.148 17.643 ( -13.440 -0.000 3.751) 13.954 17.773 ( 5.185 0.000 2.700) 5.846 17.940 ( 4.950 0.000 1.563) 5.191 18.118 ( 4.141 0.000 2.544) 4.860 25.727 ( 0.932 0.000 1.345) 1.637 25.767 ( -2.745 -0.000 -0.178) 2.750 25.773 ( -0.161 -0.000 -1.418) 1.427 25.854 ( -0.633 -0.000 -0.144) 0.650 26.050 ( -1.685 -0.000 -4.479) 4.785 26.300 ( 2.182 0.000 -2.637) 3.422 26.563 ( -3.115 -0.000 -0.270) 3.127 26.633 ( -0.282 -0.000 1.215) 1.247 26.964 ( -1.458 -0.000 -4.061) 4.315 27.481 ( -5.591 -0.000 -13.581) 14.687 27.885 ( -2.443 -0.000 13.681) 13.898 28.287 ( 1.175 0.000 2.796) 3.033 28.377 ( 8.958 0.000 6.724) 11.201 28.445 ( 1.300 0.000 -1.758) 2.186 29.456 ( -3.837 -0.000 12.331) 12.914 30.962 ( 6.911 0.000 -11.577) 13.483 ======================= Grid point 136 (62/140) ======================= q-point: (-0.33 -0.44 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 7.23e-05 7.23e-05 7.23e-05 7.23e-05 7.23e-05 7.23e-05 7.23e-05 7.23e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 243 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.246 ( 0.290 -9.875 -6.109) 11.616 1.573 ( -2.937 -17.024 -11.212) 20.595 1.830 ( -1.879 -6.596 2.198) 7.202 1.896 ( -22.470 -5.110 -5.502) 23.692 2.002 ( 3.228 -12.936 4.466) 14.060 2.178 ( 2.512 -6.942 -2.874) 7.922 2.467 ( -5.338 -0.697 -4.638) 7.106 2.490 ( 0.355 -4.956 -1.687) 5.247 2.753 ( -2.455 -6.069 2.486) 7.003 2.984 ( -0.221 -0.310 -5.852) 5.864 3.114 ( -4.157 -0.950 -2.593) 4.990 3.260 ( 3.135 -1.197 11.281) 11.770 3.287 ( 11.658 -0.286 2.483) 11.922 3.534 ( -8.796 -6.280 -3.004) 11.217 3.669 ( 4.513 8.199 -0.954) 9.408 3.857 ( -0.181 -0.400 -2.055) 2.101 3.983 ( 0.541 1.961 6.811) 7.108 4.066 ( -6.569 -0.555 0.216) 6.596 4.245 ( 1.863 -3.695 0.504) 4.169 4.407 ( 4.676 -7.789 -4.413) 10.100 4.620 ( 1.830 -1.238 -4.615) 5.117 4.692 ( -2.655 3.799 2.028) 5.059 4.946 ( -0.401 -1.688 -3.414) 3.830 4.988 ( 4.197 1.821 -0.279) 4.584 5.278 ( 2.171 0.193 1.702) 2.765 5.526 ( -0.265 0.849 -0.385) 0.969 5.615 ( 3.001 3.057 3.639) 5.620 5.944 ( -3.859 -0.850 -11.441) 12.105 6.133 ( 5.512 2.878 6.189) 8.773 6.216 ( 0.788 -0.072 9.417) 9.450 6.279 ( -8.618 3.224 -3.567) 9.868 6.473 ( -4.866 3.015 2.774) 6.361 6.625 ( 0.118 4.028 -3.884) 5.597 6.703 ( 5.437 -2.810 -1.963) 6.427 6.934 ( -5.522 0.595 3.549) 6.591 7.077 ( -2.368 0.400 0.167) 2.407 7.201 ( 7.523 5.853 3.479) 10.147 7.312 ( 3.902 -0.272 8.597) 9.445 7.551 ( 5.160 -4.784 -2.418) 7.440 7.734 ( -3.154 5.214 -5.605) 8.280 8.598 ( 1.857 -3.480 -0.605) 3.990 8.685 ( 4.718 -9.113 -1.540) 10.377 8.864 ( -0.092 -5.397 11.979) 13.139 8.957 ( 0.841 -6.201 13.014) 14.441 9.244 ( -2.494 -3.958 5.271) 7.047 9.460 ( 0.449 5.660 -0.362) 5.690 9.856 ( 1.851 -2.779 -8.746) 9.361 9.957 ( -3.041 7.662 -4.985) 9.633 10.164 ( -0.199 -3.191 -5.566) 6.419 10.509 ( 7.425 -14.267 -18.200) 24.288 10.905 ( -5.579 -1.685 -0.522) 5.851 11.148 ( -1.809 -2.718 -1.026) 3.423 11.418 ( -9.185 -1.657 -8.451) 12.591 11.521 ( 0.111 -1.531 11.089) 11.195 11.577 ( 1.200 0.094 -1.036) 1.588 11.726 ( 1.097 -0.939 1.946) 2.423 11.971 ( -3.000 0.307 -2.398) 3.853 11.992 ( -1.272 0.969 -3.879) 4.196 12.144 ( -0.617 1.898 -6.313) 6.621 12.284 ( 3.427 -1.842 6.910) 7.930 12.372 ( 6.575 -3.707 -5.468) 9.321 12.531 ( 1.909 -0.218 0.288) 1.943 13.099 ( 2.651 5.534 6.592) 9.006 13.345 ( -1.265 7.611 -5.868) 9.694 14.743 ( -2.402 4.923 0.332) 5.488 14.912 ( 2.450 2.546 3.565) 5.020 15.102 ( 3.335 -2.898 4.654) 6.417 15.188 ( -4.122 -5.729 -0.719) 7.095 15.402 ( 1.590 11.848 -3.569) 12.475 15.622 ( 2.502 -0.832 -5.800) 6.371 15.656 ( -0.292 2.497 1.019) 2.713 15.890 ( -0.723 1.998 -2.494) 3.276 15.979 ( 2.042 1.179 1.896) 3.026 16.166 ( 3.699 -0.367 2.149) 4.294 16.272 ( -6.006 -0.349 5.887) 8.417 16.444 ( 0.529 -5.590 1.759) 5.884 17.510 ( -13.236 5.076 2.547) 14.403 17.772 ( -1.361 4.684 3.679) 6.110 17.993 ( 5.978 -1.556 0.293) 6.184 18.133 ( 5.507 5.336 4.693) 8.990 25.742 ( -2.553 -0.127 2.297) 3.437 25.755 ( 0.331 -1.548 -1.099) 1.928 25.783 ( -1.181 -2.155 -0.989) 2.649 25.858 ( 0.327 -0.708 -0.402) 0.878 26.015 ( -1.117 0.424 -2.972) 3.203 26.322 ( 3.273 -2.287 -4.448) 5.977 26.542 ( -2.601 -0.217 1.268) 2.901 26.651 ( -0.403 -1.808 0.239) 1.868 26.926 ( -1.466 0.890 -2.315) 2.881 27.381 ( -4.236 0.146 -10.526) 11.347 27.986 ( -1.727 -5.833 10.251) 11.920 28.329 ( 3.951 -2.464 5.731) 7.384 28.460 ( 1.022 -2.982 -0.340) 3.170 28.515 ( 6.683 -3.696 0.575) 7.658 29.466 ( -5.071 2.337 12.970) 14.121 30.812 ( 3.893 16.304 -12.608) 20.975 ======================= Grid point 137 (63/140) ======================= q-point: (-0.22 -0.44 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 7.23e-05 7.23e-05 7.23e-05 7.23e-05 7.23e-05 7.23e-05 7.23e-05 7.23e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 243 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.472 ( -4.053 -17.814 -0.883) 18.291 1.664 ( -13.740 -3.832 -0.827) 14.288 1.864 ( -8.425 -13.632 -5.927) 17.087 1.929 ( -10.729 -10.684 -6.170) 16.350 2.293 ( 6.832 -8.731 2.271) 11.317 2.374 ( 6.053 -14.958 0.183) 16.138 2.454 ( -4.901 -5.800 0.685) 7.624 2.666 ( 2.619 -15.136 -6.083) 16.522 2.886 ( -2.333 -10.237 1.082) 10.555 2.989 ( 2.746 -0.022 -5.743) 6.366 3.082 ( 0.039 1.627 1.025) 1.924 3.335 ( 4.414 1.819 6.826) 8.330 3.387 ( 2.063 -4.951 2.275) 5.826 3.538 ( 0.235 2.053 -1.252) 2.416 3.648 ( -1.226 -5.489 -1.849) 5.921 3.871 ( 3.316 6.032 7.737) 10.356 3.924 ( -1.102 0.567 5.385) 5.526 4.098 ( -9.488 -8.696 -2.434) 13.098 4.279 ( 2.395 2.100 -2.501) 4.050 4.483 ( 1.622 0.223 -5.630) 5.863 4.599 ( -3.203 1.921 0.116) 3.737 4.672 ( 4.318 -4.233 -7.314) 9.490 4.868 ( -3.228 2.119 -3.662) 5.322 5.056 ( 5.967 0.212 1.288) 6.108 5.368 ( 3.892 -4.690 8.004) 10.060 5.501 ( 0.890 1.463 0.357) 1.749 5.605 ( 5.619 2.452 0.261) 6.136 5.861 ( -4.072 0.127 -12.070) 12.739 6.092 ( -8.354 6.322 0.130) 10.477 6.168 ( 4.445 1.890 2.732) 5.549 6.264 ( -4.837 -0.775 5.480) 7.350 6.405 ( -1.805 3.663 2.832) 4.969 6.533 ( -2.587 2.656 -1.850) 4.144 6.781 ( 3.266 -1.831 0.666) 3.803 6.895 ( -5.490 0.546 5.440) 7.749 7.118 ( 10.307 3.067 5.450) 12.055 7.180 ( 3.599 -0.754 -2.831) 4.641 7.367 ( 1.388 0.877 8.302) 8.463 7.540 ( -3.616 5.143 -3.980) 7.441 7.648 ( 3.334 0.753 -5.757) 6.695 8.709 ( 3.119 -6.880 1.052) 7.627 8.878 ( 5.467 -8.720 -0.437) 10.301 9.039 ( 0.779 -7.338 11.057) 13.293 9.141 ( -0.555 -6.103 6.807) 9.159 9.315 ( -2.961 -4.955 3.347) 6.672 9.457 ( 2.339 -2.767 5.312) 6.430 9.774 ( -3.458 6.341 -2.873) 7.773 9.826 ( -4.269 -1.519 -10.571) 11.501 10.180 ( 1.876 -1.373 -4.576) 5.133 10.729 ( 10.661 -6.884 -9.114) 15.624 10.903 ( -6.888 -4.314 -1.187) 8.213 11.153 ( -3.408 -0.709 -2.089) 4.060 11.338 ( -6.194 -0.676 -7.778) 9.966 11.556 ( -0.869 -1.585 3.295) 3.759 11.688 ( 5.056 -8.187 -0.730) 9.650 11.750 ( -1.482 0.088 0.613) 1.606 11.945 ( 1.242 4.599 1.680) 5.051 11.974 ( -0.817 -3.145 0.002) 3.249 12.046 ( -3.648 1.996 -6.830) 7.996 12.366 ( 1.290 -0.947 5.422) 5.653 12.438 ( 3.218 -1.339 0.755) 3.566 12.604 ( 7.119 -5.319 -4.580) 9.997 13.018 ( 2.354 10.052 4.690) 11.340 13.158 ( 2.573 9.310 -6.475) 11.628 14.662 ( -2.156 1.699 0.671) 2.825 14.903 ( 1.943 2.831 3.579) 4.959 15.142 ( -1.458 6.055 -0.660) 6.263 15.230 ( 3.888 1.751 -0.436) 4.286 15.279 ( -2.191 -6.806 0.485) 7.166 15.540 ( -1.417 4.729 -2.081) 5.357 15.668 ( 0.370 0.487 -2.027) 2.117 15.789 ( -3.076 4.254 -1.211) 5.387 15.990 ( 3.913 1.646 -2.448) 4.900 16.203 ( 0.731 0.852 4.115) 4.266 16.296 ( 0.187 -1.779 6.717) 6.951 16.554 ( 1.436 -5.803 0.132) 5.979 17.303 ( -12.982 8.646 2.520) 15.800 17.648 ( -7.971 7.184 5.296) 11.966 18.065 ( 7.910 0.634 0.235) 7.938 18.082 ( 3.072 5.095 0.082) 5.950 25.739 ( -3.077 -0.985 2.085) 3.845 25.783 ( -0.512 -1.993 -0.017) 2.057 25.814 ( -1.170 -2.580 -0.243) 2.844 25.874 ( 0.798 -0.832 -0.761) 1.381 25.997 ( 0.299 0.148 -1.011) 1.064 26.376 ( 6.037 -2.239 -5.776) 8.650 26.546 ( -1.219 -0.820 2.914) 3.263 26.670 ( -0.661 -1.367 -4.067) 4.341 26.917 ( -0.783 -0.849 5.381) 5.504 27.312 ( -1.941 -0.088 -7.311) 7.565 28.097 ( -1.578 -3.427 5.574) 6.730 28.512 ( 6.966 -8.532 6.287) 12.683 28.542 ( 1.745 -6.486 -2.147) 7.051 28.628 ( 4.437 -6.328 -1.451) 7.863 29.422 ( -5.548 5.037 11.271) 13.535 30.373 ( -4.990 26.241 -12.984) 29.700 ======================= Grid point 138 (64/140) ======================= q-point: (-0.11 -0.44 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 7.23e-05 7.23e-05 7.23e-05 7.23e-05 7.23e-05 7.23e-05 7.23e-05 7.23e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 243 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.607 ( -15.549 -3.235 7.467) 17.550 1.728 ( -5.722 -16.940 -0.430) 17.885 1.918 ( -4.310 -8.288 -8.393) 12.558 2.156 ( 0.540 -15.613 0.190) 15.623 2.475 ( 1.467 -9.234 -2.462) 9.668 2.535 ( 0.053 -3.682 4.558) 5.860 2.640 ( 1.634 -11.406 -0.273) 11.526 2.880 ( 5.395 -5.264 -7.249) 10.458 2.944 ( 3.994 -0.271 -3.964) 5.634 3.057 ( -2.175 -8.691 -1.407) 9.069 3.099 ( -0.425 -4.193 1.529) 4.483 3.332 ( 3.419 5.078 2.673) 6.680 3.501 ( -0.221 -3.177 -1.266) 3.427 3.513 ( -1.559 0.532 6.439) 6.646 3.683 ( -3.413 -1.910 1.233) 4.101 3.806 ( 1.603 6.225 2.691) 6.968 4.024 ( 7.050 -4.436 5.210) 9.824 4.161 ( -6.904 -7.542 -1.960) 10.411 4.220 ( -0.602 0.526 -3.504) 3.594 4.431 ( -4.140 5.344 5.594) 8.774 4.567 ( 1.382 -2.711 -4.058) 5.072 4.743 ( 7.228 0.088 -7.379) 10.329 4.822 ( -4.114 -4.019 -7.354) 9.336 5.052 ( 2.435 4.480 2.005) 5.479 5.497 ( 2.064 -1.531 -0.375) 2.597 5.538 ( 3.070 -3.816 6.756) 8.345 5.634 ( 9.058 1.953 0.494) 9.279 5.765 ( -4.806 0.171 -8.529) 9.791 5.923 ( -8.729 4.550 -0.993) 9.893 6.179 ( 0.348 0.558 1.128) 1.305 6.258 ( -7.569 -1.678 5.384) 9.439 6.336 ( 2.019 4.694 -1.390) 5.296 6.488 ( 0.802 1.743 0.421) 1.965 6.838 ( 1.353 -1.999 1.398) 2.790 6.881 ( -5.214 -0.132 5.534) 7.604 7.084 ( 2.920 5.949 1.208) 6.736 7.292 ( 8.827 -0.584 0.569) 8.865 7.403 ( 1.139 0.269 5.061) 5.195 7.413 ( -2.053 2.915 0.681) 3.630 7.625 ( 4.224 1.641 -5.269) 6.950 8.832 ( 2.023 -2.253 2.732) 4.078 9.047 ( 4.837 -5.949 0.638) 7.694 9.129 ( -1.919 -1.411 -1.950) 3.078 9.244 ( -1.996 -6.887 6.030) 9.369 9.389 ( -1.247 0.538 1.554) 2.064 9.558 ( 0.917 -3.311 2.570) 4.290 9.686 ( -4.763 -3.173 1.819) 6.006 9.838 ( -1.322 -6.485 -3.362) 7.423 10.200 ( 3.638 -0.059 -2.330) 4.321 10.758 ( -3.343 1.509 -3.449) 5.035 10.948 ( 1.116 -5.176 -2.639) 5.916 11.123 ( -2.412 0.318 0.239) 2.445 11.285 ( -3.539 -2.262 -5.816) 7.174 11.613 ( 0.294 -0.827 -4.308) 4.396 11.703 ( 1.665 2.572 5.432) 6.237 11.803 ( -0.021 -2.985 -3.311) 4.458 11.834 ( -0.200 7.061 -1.705) 7.266 11.958 ( -7.660 -2.524 -0.758) 8.101 12.099 ( 4.520 -3.055 1.719) 5.720 12.386 ( 1.367 0.796 4.150) 4.442 12.499 ( 1.957 -0.270 2.350) 3.070 12.721 ( 4.665 -5.510 -5.742) 9.224 12.846 ( 6.459 13.366 -0.683) 14.860 13.077 ( 4.083 1.722 -2.985) 5.343 14.685 ( 0.042 -4.520 2.102) 4.985 14.863 ( -2.171 2.848 0.197) 3.587 15.032 ( 0.531 3.508 1.710) 3.939 15.266 ( 4.784 1.132 -2.841) 5.678 15.382 ( -0.616 -4.902 3.737) 6.194 15.471 ( -2.210 -0.910 -1.605) 2.879 15.597 ( -3.466 3.928 -2.060) 5.629 15.716 ( 0.124 2.968 -1.733) 3.439 15.966 ( 2.497 2.631 -2.167) 4.225 16.196 ( -2.660 0.766 3.269) 4.283 16.360 ( 3.291 0.998 6.292) 7.170 16.656 ( 3.360 -4.471 -1.486) 5.787 17.069 ( -12.835 7.844 4.432) 15.682 17.506 ( -7.123 4.308 3.443) 9.009 18.000 ( 3.824 6.609 -1.795) 7.844 18.110 ( 3.249 -0.913 -2.451) 4.171 25.744 ( -3.000 -1.068 2.543) 4.075 25.817 ( -0.779 -2.446 1.191) 2.830 25.839 ( -1.532 -1.669 -0.037) 2.266 25.889 ( 0.616 -1.022 -1.275) 1.746 25.997 ( 1.314 0.607 0.103) 1.451 26.421 ( 7.354 -0.304 -5.712) 9.316 26.567 ( -0.966 -0.571 1.267) 1.693 26.650 ( -0.970 -0.187 -3.667) 3.797 27.000 ( 1.719 -2.999 11.894) 12.386 27.277 ( 0.633 0.220 -5.549) 5.590 28.137 ( -2.259 -0.973 3.229) 4.059 28.623 ( 1.326 -1.155 -1.522) 2.326 28.671 ( 3.225 -7.650 -5.172) 9.781 28.882 ( 8.277 -15.128 0.865) 17.266 29.324 ( -5.450 7.212 8.867) 12.662 29.824 ( -10.703 22.609 -8.400) 26.387 ======================= Grid point 145 (65/140) ======================= q-point: (-0.33 -0.33 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 7.23e-05 7.23e-05 7.23e-05 7.23e-05 7.23e-05 7.23e-05 7.23e-05 7.23e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 135 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.156 ( -12.405 -0.000 -12.381) 17.526 1.272 ( 5.559 0.000 -7.432) 9.281 1.608 ( -26.857 -0.000 -10.204) 28.730 1.814 ( -0.627 -0.000 6.358) 6.389 1.936 ( 3.611 0.000 6.755) 7.660 2.108 ( 7.180 0.000 -4.620) 8.538 2.386 ( -20.657 -0.000 -7.713) 22.050 2.450 ( 2.398 0.000 -0.982) 2.592 2.614 ( -9.779 -0.000 3.541) 10.400 2.968 ( 1.286 0.000 -1.468) 1.952 3.038 ( -6.107 -0.000 -2.725) 6.687 3.302 ( 5.593 0.000 5.193) 7.632 3.400 ( 10.978 0.000 4.330) 11.802 3.500 ( 2.338 0.000 2.183) 3.199 3.741 ( 0.275 0.000 0.222) 0.353 3.822 ( -4.454 -0.000 -6.462) 7.849 4.017 ( 6.798 0.000 3.441) 7.619 4.065 ( 1.250 0.000 -4.268) 4.447 4.259 ( -2.786 -0.000 7.171) 7.693 4.324 ( 4.237 0.000 -4.445) 6.141 4.608 ( 3.811 0.000 -5.496) 6.688 4.734 ( -4.685 -0.000 7.582) 8.913 4.922 ( -2.407 -0.000 1.687) 2.939 5.034 ( 7.658 0.000 -1.798) 7.867 5.288 ( 0.037 0.000 -0.375) 0.376 5.523 ( -0.198 -0.000 -1.625) 1.637 5.683 ( 2.394 0.000 4.131) 4.774 5.839 ( -5.718 -0.000 -12.146) 13.425 6.229 ( -4.788 -0.000 0.646) 4.831 6.237 ( 7.085 0.000 -0.376) 7.095 6.242 ( -4.848 -0.000 6.098) 7.790 6.487 ( -4.005 -0.000 4.099) 5.731 6.616 ( -2.085 -0.000 -10.067) 10.281 6.728 ( 6.837 0.000 2.619) 7.321 6.908 ( -5.226 -0.000 3.881) 6.509 7.040 ( -4.338 -0.000 -0.422) 4.359 7.338 ( 1.805 0.000 8.320) 8.513 7.431 ( 13.354 0.000 2.691) 13.623 7.519 ( 5.518 0.000 -0.897) 5.590 7.732 ( -3.398 -0.000 -6.378) 7.226 8.520 ( -2.436 -0.000 -6.770) 7.195 8.696 ( 11.136 0.000 4.056) 11.852 8.878 ( 2.190 0.000 10.430) 10.657 8.974 ( -0.051 -0.000 15.449) 15.449 9.225 ( -0.579 -0.000 4.795) 4.830 9.526 ( -2.248 -0.000 -0.404) 2.284 9.828 ( 7.213 0.000 -6.916) 9.993 10.018 ( -1.903 -0.000 -6.955) 7.211 10.067 ( -1.099 -0.000 -3.526) 3.693 10.283 ( 3.507 0.000 -18.755) 19.080 10.834 ( -7.205 -0.000 -2.217) 7.539 11.104 ( -2.552 -0.000 -0.910) 2.710 11.293 ( -8.795 -0.000 -6.009) 10.652 11.543 ( -6.886 -0.000 7.040) 9.848 11.596 ( 4.377 0.000 1.219) 4.543 11.723 ( 0.186 0.000 -1.659) 1.669 11.906 ( -1.146 -0.000 -5.622) 5.737 11.951 ( -5.744 -0.000 -2.119) 6.123 12.192 ( 4.125 0.000 -3.470) 5.391 12.350 ( 6.897 0.000 -6.037) 9.166 12.356 ( 7.405 0.000 9.148) 11.769 12.546 ( 1.383 0.000 -0.088) 1.386 13.177 ( -2.266 -0.000 6.259) 6.657 13.377 ( 0.586 0.000 -6.002) 6.031 14.795 ( 0.092 0.000 -0.026) 0.095 14.968 ( 1.215 0.000 4.335) 4.502 15.084 ( -4.704 -0.000 -1.784) 5.030 15.140 ( 5.187 0.000 6.321) 8.177 15.496 ( -4.517 -0.000 -6.006) 7.515 15.596 ( 7.563 0.000 -4.753) 8.932 15.720 ( 0.358 0.000 1.638) 1.677 15.897 ( 2.183 0.000 -1.444) 2.617 16.017 ( 2.076 0.000 1.287) 2.442 16.174 ( 1.767 0.000 -1.010) 2.035 16.223 ( -9.476 -0.000 6.048) 11.242 16.428 ( 3.198 0.000 3.332) 4.618 17.455 ( -14.563 -0.000 2.752) 14.821 17.845 ( 0.665 0.000 2.401) 2.492 17.974 ( 1.936 0.000 -3.090) 3.646 18.301 ( 8.717 0.000 12.299) 15.074 25.714 ( -2.953 -0.000 -1.268) 3.214 25.745 ( -1.525 -0.000 -1.139) 1.904 25.761 ( 0.349 0.000 3.898) 3.914 25.854 ( 0.956 0.000 -0.587) 1.122 25.996 ( -1.158 -0.000 -1.683) 2.043 26.285 ( 1.104 0.000 -6.235) 6.332 26.536 ( -1.449 -0.000 3.441) 3.733 26.634 ( -0.064 -0.000 -0.379) 0.384 26.909 ( -1.933 -0.000 -1.908) 2.716 27.300 ( -3.256 -0.000 -9.726) 10.257 27.959 ( -3.122 -0.000 9.736) 10.224 28.351 ( 2.304 0.000 3.988) 4.606 28.437 ( 0.942 0.000 -1.306) 1.610 28.544 ( 6.632 0.000 -0.493) 6.650 29.518 ( -5.415 -0.000 15.521) 16.439 30.944 ( 7.219 0.000 -14.946) 16.598 ======================= Grid point 146 (66/140) ======================= q-point: (-0.22 -0.33 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 7.23e-05 7.23e-05 7.23e-05 7.23e-05 7.23e-05 7.23e-05 7.23e-05 7.23e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 243 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.105 ( -12.499 -14.981 -5.876) 20.376 1.371 ( -18.879 -8.232 -12.080) 23.877 1.480 ( -7.869 -17.390 -6.121) 20.045 1.812 ( -10.618 1.989 3.876) 11.477 2.112 ( -0.248 -12.989 3.251) 13.392 2.222 ( -7.622 -8.144 -2.680) 11.472 2.285 ( 7.169 -13.199 0.294) 15.023 2.495 ( 2.524 -3.145 -0.650) 4.084 2.675 ( -5.478 -9.635 3.283) 11.560 2.977 ( 0.922 -0.762 -1.985) 2.318 3.020 ( -5.161 -4.431 -1.166) 6.901 3.393 ( 1.919 -2.847 3.649) 5.010 3.431 ( 0.361 8.167 0.045) 8.175 3.500 ( 10.218 -0.434 0.258) 10.230 3.717 ( 0.256 3.278 -3.093) 4.514 3.850 ( 1.223 -6.313 5.273) 8.316 3.986 ( 0.630 1.496 -0.556) 1.716 4.105 ( 2.501 7.258 7.532) 10.755 4.265 ( 3.296 -5.038 -3.171) 6.805 4.398 ( 1.643 -4.777 -7.338) 8.908 4.600 ( 1.833 0.901 -6.191) 6.520 4.693 ( -4.148 4.485 8.009) 10.073 4.884 ( -1.847 2.466 -0.442) 3.112 5.098 ( 6.171 -0.519 0.115) 6.194 5.339 ( 1.027 -5.394 5.150) 7.528 5.512 ( 0.572 0.198 -1.690) 1.795 5.688 ( 0.485 2.299 -0.876) 2.508 5.756 ( -2.588 -1.646 -9.741) 10.212 6.126 ( -6.221 5.013 -2.672) 8.424 6.245 ( 2.403 1.646 3.557) 4.598 6.260 ( -1.843 1.634 1.292) 2.781 6.456 ( -2.292 2.488 3.332) 4.749 6.529 ( -2.729 1.545 -5.983) 6.755 6.783 ( 0.146 -0.583 2.910) 2.971 6.895 ( -4.771 1.352 5.140) 7.142 7.068 ( 3.245 -7.222 -2.405) 8.275 7.389 ( 9.656 7.149 5.089) 13.047 7.409 ( 0.706 1.476 4.213) 4.519 7.591 ( 0.506 3.218 -3.868) 5.057 7.667 ( 4.420 0.059 -2.444) 5.051 8.556 ( 0.033 -8.845 -4.126) 9.760 8.839 ( 9.059 -4.871 3.056) 10.729 8.992 ( 2.294 -5.104 9.999) 11.458 9.091 ( 0.208 -3.604 8.406) 9.149 9.258 ( -0.259 -1.779 4.956) 5.272 9.481 ( 0.062 1.140 3.249) 3.444 9.761 ( -2.546 4.062 -8.599) 9.845 9.859 ( -2.785 8.237 -3.770) 9.477 10.123 ( 1.507 -4.378 -4.062) 6.159 10.540 ( 15.553 -23.226 -12.017) 30.426 10.776 ( -8.357 -1.849 -2.567) 8.936 11.092 ( -3.263 -1.660 -1.669) 4.024 11.226 ( -6.178 -1.969 -4.820) 8.079 11.504 ( -8.683 -1.475 1.361) 8.912 11.646 ( 4.867 -1.893 3.334) 6.196 11.721 ( -1.890 -2.217 -3.195) 4.324 11.886 ( -7.219 0.599 -2.768) 7.754 11.941 ( 3.574 -3.778 -0.749) 5.255 12.136 ( 2.068 6.438 -2.861) 7.342 12.401 ( 5.135 -1.608 1.383) 5.556 12.461 ( 5.135 0.280 3.362) 6.144 12.570 ( 4.822 -2.655 -2.413) 6.010 13.149 ( -3.949 2.943 6.180) 7.902 13.302 ( 4.515 7.430 -5.873) 10.492 14.726 ( -0.535 6.015 1.418) 6.203 14.984 ( 1.960 2.079 3.743) 4.709 15.120 ( -1.653 -7.132 -2.786) 7.833 15.211 ( 2.869 0.371 3.984) 4.924 15.348 ( -2.742 8.421 -2.030) 9.086 15.619 ( 1.632 5.779 -3.153) 6.783 15.662 ( 0.653 0.265 -0.438) 0.830 15.841 ( -2.026 5.345 -1.839) 6.005 16.035 ( 5.112 1.556 -3.319) 6.291 16.199 ( -8.848 -1.503 6.632) 11.159 16.253 ( 3.744 -6.313 0.714) 7.374 16.506 ( 4.558 -3.490 3.002) 6.478 17.322 ( -13.500 4.147 1.752) 14.231 17.751 ( -6.736 9.074 4.851) 12.298 18.022 ( 2.330 -3.544 -3.840) 5.721 18.331 ( 7.712 10.667 9.311) 16.123 25.697 ( -2.867 -1.292 -0.525) 3.188 25.747 ( -1.490 -1.914 -0.030) 2.426 25.786 ( -0.335 -0.166 4.371) 4.387 25.866 ( 1.062 -0.575 -0.484) 1.301 25.988 ( -0.268 -0.525 -0.446) 0.739 26.326 ( 4.863 -5.938 -5.416) 9.393 26.550 ( -0.225 -0.061 3.866) 3.873 26.636 ( 0.057 -0.522 -2.254) 2.314 26.902 ( -2.148 -1.937 3.279) 4.373 27.254 ( -0.619 -1.774 -6.889) 7.141 28.029 ( -2.674 -5.298 5.614) 8.169 28.424 ( 2.165 -4.879 2.195) 5.771 28.480 ( 2.889 -4.853 0.389) 5.662 28.588 ( 3.900 -1.357 -3.365) 5.327 29.522 ( -5.376 3.642 14.796) 16.158 30.698 ( -0.646 23.357 -18.650) 29.896 ======================= Grid point 147 (67/140) ======================= q-point: (-0.11 -0.33 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 7.23e-05 7.23e-05 7.23e-05 7.23e-05 7.23e-05 7.23e-05 7.23e-05 7.23e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 243 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.308 ( -13.374 -21.420 -6.400) 26.051 1.354 ( -22.606 -11.818 5.354) 26.064 1.717 ( -9.525 -11.427 2.021) 15.013 1.832 ( 0.996 -20.461 -4.842) 21.049 2.280 ( -2.997 -9.716 1.866) 10.338 2.455 ( 5.573 -13.291 -2.538) 14.634 2.526 ( 3.681 -3.137 5.592) 7.393 2.668 ( 6.033 -17.668 -5.581) 19.486 2.839 ( -3.146 -12.188 -0.491) 12.597 2.990 ( 2.240 -0.139 -2.112) 3.082 3.066 ( -3.516 -2.541 1.928) 4.747 3.327 ( -7.074 -3.565 -0.402) 7.932 3.437 ( 0.926 1.455 3.901) 4.265 3.562 ( 4.160 0.737 -0.597) 4.266 3.663 ( 1.987 2.298 -3.127) 4.360 3.958 ( -1.191 0.639 0.714) 1.529 4.027 ( 4.864 3.827 7.971) 10.092 4.033 ( 1.284 -3.626 7.042) 8.025 4.294 ( 5.418 3.567 -4.082) 7.664 4.485 ( 4.654 -6.978 -4.411) 9.477 4.525 ( -5.686 4.389 -0.309) 7.190 4.638 ( -3.893 -0.415 -1.362) 4.146 4.834 ( 4.309 2.905 -5.939) 7.891 5.129 ( 1.807 1.602 2.389) 3.397 5.467 ( -0.126 -3.346 1.526) 3.679 5.536 ( 4.036 -2.287 2.295) 5.176 5.637 ( -5.846 -3.208 -7.174) 9.795 5.755 ( 7.027 1.499 -1.421) 7.324 5.954 ( -6.394 7.461 -2.234) 10.077 6.193 ( -2.712 3.007 -1.147) 4.209 6.252 ( -1.040 0.956 5.108) 5.300 6.385 ( -1.324 2.454 -4.339) 5.157 6.511 ( 0.697 -0.093 1.369) 1.539 6.802 ( -5.255 -2.575 2.001) 6.184 6.847 ( -5.401 0.898 4.475) 7.071 7.218 ( 4.158 -2.612 -2.743) 5.624 7.320 ( 8.361 5.546 3.078) 10.495 7.444 ( -1.523 1.562 2.843) 3.584 7.524 ( 6.786 4.106 3.782) 8.787 7.681 ( 6.142 1.851 -2.802) 7.000 8.734 ( 0.614 -11.051 -0.346) 11.074 9.008 ( 7.520 -3.617 0.539) 8.362 9.086 ( -3.749 -1.586 -2.324) 4.687 9.158 ( 1.323 -6.739 7.773) 10.373 9.384 ( 1.693 -3.611 6.423) 7.561 9.499 ( 0.057 -3.003 -0.705) 3.086 9.662 ( -4.823 1.928 -1.655) 5.451 9.733 ( -2.123 0.626 0.581) 2.288 10.196 ( 4.586 -3.370 -1.262) 5.830 10.718 ( -6.953 -0.319 -4.025) 8.040 10.865 ( 6.629 -5.694 -1.684) 8.899 11.093 ( -1.509 -1.650 -1.469) 2.675 11.209 ( -0.673 -2.418 -7.742) 8.139 11.508 ( -5.468 -5.530 -1.764) 7.975 11.729 ( -0.038 -3.718 -8.772) 9.527 11.783 ( 2.374 -0.375 3.894) 4.576 11.796 ( -8.657 -2.386 3.072) 9.491 11.984 ( 2.007 5.806 -2.909) 6.797 12.071 ( 1.460 -2.558 3.608) 4.657 12.444 ( 3.052 1.612 2.805) 4.448 12.511 ( 4.318 -2.154 3.167) 5.772 12.658 ( 6.295 -3.073 -7.561) 10.307 13.116 ( 1.949 3.624 6.420) 7.626 13.164 ( 9.404 11.064 -5.735) 15.612 14.672 ( 1.119 1.023 3.658) 3.959 14.930 ( -3.141 7.500 0.834) 8.174 15.114 ( -0.846 4.492 2.091) 5.027 15.220 ( 1.854 -6.373 -5.128) 8.387 15.342 ( 3.069 -2.034 5.715) 6.798 15.489 ( -4.227 5.052 -0.680) 6.622 15.638 ( -0.895 3.979 -3.218) 5.195 15.749 ( -0.170 2.350 -1.993) 3.086 16.014 ( 4.135 2.148 -5.055) 6.875 16.184 ( -7.701 -0.342 6.225) 9.908 16.388 ( 4.680 -4.217 0.554) 6.324 16.628 ( 6.865 -3.559 2.089) 8.010 17.119 ( -14.373 8.281 2.977) 16.853 17.544 ( -13.238 7.379 6.907) 16.655 18.055 ( 0.486 -0.735 -3.578) 3.685 18.209 ( 5.125 9.862 -0.918) 11.152 25.705 ( -2.718 -1.929 0.863) 3.443 25.771 ( -2.415 -1.992 1.796) 3.609 25.805 ( -0.594 -1.143 1.493) 1.972 25.880 ( 0.943 -0.491 -0.356) 1.121 26.005 ( 1.037 -0.929 -0.012) 1.393 26.442 ( 9.317 -2.220 -5.551) 11.071 26.557 ( -1.037 0.228 0.862) 1.368 26.636 ( 0.408 -0.521 0.529) 0.848 26.985 ( -0.967 -4.829 7.101) 8.642 27.292 ( 7.801 -1.052 0.418) 7.883 28.104 ( -1.736 -3.015 1.644) 3.848 28.540 ( 2.467 -7.160 -4.049) 8.588 28.606 ( 1.999 -1.346 -3.057) 3.892 28.692 ( 5.171 -13.509 0.334) 14.468 29.456 ( -5.358 6.928 11.924) 14.795 30.074 ( -16.268 26.984 -16.447) 35.543 ======================= Grid point 155 (68/140) ======================= q-point: (-0.22 -0.22 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 7.23e-05 7.23e-05 7.23e-05 7.23e-05 7.23e-05 7.23e-05 7.23e-05 7.23e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 135 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.774 ( -21.148 -0.000 -9.765) 23.294 1.015 ( -31.084 -0.000 -16.562) 35.221 1.290 ( 2.343 0.000 -2.765) 3.625 1.662 ( -38.430 -0.000 4.020) 38.639 2.014 ( 2.711 0.000 0.613) 2.780 2.071 ( 1.664 0.000 6.288) 6.504 2.249 ( 9.809 0.000 1.290) 9.894 2.517 ( 6.070 0.000 1.220) 6.191 2.588 ( -3.531 -0.000 4.761) 5.927 2.917 ( -6.108 -0.000 -2.896) 6.760 2.972 ( -0.475 -0.000 -0.139) 0.495 3.393 ( 3.937 0.000 -1.831) 4.342 3.574 ( 2.025 0.000 1.729) 2.662 3.576 ( 7.726 0.000 0.404) 7.736 3.696 ( -4.833 -0.000 -3.146) 5.767 3.772 ( -0.960 -0.000 6.744) 6.812 4.097 ( 7.511 0.000 -2.970) 8.077 4.171 ( 11.057 0.000 -0.947) 11.098 4.239 ( -3.148 -0.000 -0.377) 3.170 4.339 ( 2.947 0.000 -1.672) 3.389 4.608 ( 2.775 0.000 -5.553) 6.207 4.747 ( -4.846 -0.000 10.683) 11.731 4.890 ( -3.920 -0.000 2.229) 4.509 5.156 ( 6.997 0.000 0.588) 7.022 5.286 ( -2.621 -0.000 4.786) 5.456 5.492 ( -4.334 -0.000 -0.859) 4.418 5.618 ( -2.954 -0.000 -13.928) 14.237 5.757 ( 3.681 0.000 0.713) 3.750 6.120 ( -3.733 -0.000 -2.731) 4.625 6.266 ( -3.549 -0.000 6.198) 7.142 6.305 ( 4.752 0.000 -2.923) 5.579 6.469 ( -3.191 -0.000 -10.226) 10.712 6.491 ( -3.076 -0.000 7.402) 8.016 6.817 ( 1.779 0.000 -1.349) 2.232 6.873 ( -4.650 -0.000 4.346) 6.365 6.992 ( -1.740 -0.000 -2.125) 2.746 7.402 ( -2.448 -0.000 5.559) 6.074 7.546 ( 1.733 0.000 -6.938) 7.151 7.650 ( 11.930 0.000 1.446) 12.017 7.682 ( 3.108 0.000 0.477) 3.145 8.455 ( 1.308 0.000 -3.414) 3.656 8.866 ( 4.777 0.000 2.707) 5.491 9.022 ( 4.369 0.000 7.512) 8.690 9.108 ( 0.745 0.000 4.895) 4.951 9.285 ( 2.925 0.000 4.923) 5.726 9.492 ( -1.329 -0.000 -0.379) 1.382 9.871 ( 1.603 0.000 4.423) 4.704 9.953 ( 1.188 0.000 -2.784) 3.027 10.014 ( 2.031 0.000 -7.287) 7.565 10.230 ( 6.791 0.000 -7.881) 10.403 10.686 ( -7.484 -0.000 -3.193) 8.137 11.048 ( -2.758 -0.000 -1.278) 3.039 11.151 ( -5.420 -0.000 -1.033) 5.517 11.418 ( -10.044 -0.000 0.764) 10.073 11.604 ( -9.059 -0.000 -7.229) 11.589 11.708 ( 5.973 0.000 -0.169) 5.975 11.858 ( -3.822 -0.000 2.201) 4.411 11.930 ( 3.947 0.000 0.407) 3.968 12.195 ( 0.690 0.000 -2.493) 2.586 12.414 ( 8.328 0.000 -5.903) 10.208 12.545 ( -0.082 -0.000 -1.737) 1.739 12.554 ( 5.265 0.000 7.455) 9.126 13.148 ( -9.498 -0.000 8.065) 12.460 13.392 ( 8.428 0.000 -2.949) 8.929 14.819 ( 2.570 0.000 1.124) 2.805 15.000 ( -3.485 -0.000 -0.066) 3.486 15.029 ( 0.904 0.000 2.312) 2.482 15.266 ( 2.516 0.000 -0.141) 2.520 15.379 ( -2.237 -0.000 0.812) 2.379 15.650 ( 4.804 0.000 -3.991) 6.245 15.707 ( -1.902 -0.000 -4.008) 4.437 15.910 ( 0.654 0.000 0.462) 0.801 16.099 ( 9.576 0.000 -4.494) 10.578 16.104 ( -10.706 -0.000 6.614) 12.584 16.201 ( -0.605 -0.000 1.282) 1.417 16.527 ( 5.269 0.000 3.242) 6.186 17.255 ( -13.208 -0.000 1.121) 13.255 17.840 ( -4.319 -0.000 2.601) 5.042 17.972 ( 2.860 0.000 -4.405) 5.252 18.585 ( 10.934 0.000 11.264) 15.698 25.661 ( -2.432 -0.000 -0.657) 2.519 25.713 ( -1.192 -0.000 -0.752) 1.410 25.838 ( 1.244 0.000 12.053) 12.117 25.868 ( 1.166 0.000 -0.141) 1.174 25.985 ( -0.803 -0.000 2.978) 3.084 26.231 ( 0.370 0.000 -5.616) 5.628 26.574 ( 0.472 0.000 4.309) 4.335 26.627 ( 0.478 0.000 -1.127) 1.224 26.873 ( -3.038 -0.000 4.255) 5.228 27.183 ( -1.869 -0.000 -6.138) 6.417 27.979 ( -3.520 -0.000 5.138) 6.228 28.419 ( 1.772 0.000 2.554) 3.108 28.443 ( 1.585 0.000 -1.537) 2.208 28.587 ( 3.028 0.000 -4.622) 5.525 29.585 ( -5.639 -0.000 14.647) 15.695 30.850 ( 5.707 0.000 -30.943) 31.465 ======================= Grid point 156 (69/140) ======================= q-point: (-0.11 -0.22 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 7.23e-05 7.23e-05 7.23e-05 7.23e-05 7.23e-05 7.23e-05 7.23e-05 7.23e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 243 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.786 ( -18.306 -21.094 -4.294) 28.258 0.929 ( -20.924 -21.817 0.752) 30.239 1.355 ( -33.275 -11.961 7.932) 36.238 1.499 ( -3.080 -12.459 -2.505) 13.076 2.172 ( 5.115 -10.827 3.660) 12.522 2.246 ( 3.979 -11.859 3.590) 13.014 2.417 ( 8.622 -12.033 -3.883) 15.303 2.551 ( -0.075 0.618 2.771) 2.840 2.652 ( -0.223 -7.173 2.210) 7.509 2.915 ( -5.944 -6.914 -0.693) 9.144 2.977 ( -0.887 -1.209 0.668) 1.642 3.371 ( 0.173 6.198 -4.989) 7.958 3.477 ( 0.569 4.645 1.947) 5.068 3.619 ( 4.791 0.883 -0.647) 4.914 3.653 ( -3.499 -0.553 -0.279) 3.553 3.934 ( -0.249 -9.687 5.028) 10.917 4.069 ( 7.634 5.964 3.050) 10.157 4.170 ( 0.474 4.177 -0.430) 4.226 4.339 ( 6.748 -8.334 -6.603) 12.593 4.363 ( 5.263 1.108 -0.004) 5.378 4.557 ( 0.097 4.797 -3.994) 6.243 4.704 ( -5.955 5.537 9.531) 12.529 4.869 ( 2.127 0.945 -4.670) 5.218 5.180 ( 2.766 1.301 3.697) 4.797 5.392 ( -1.070 -7.150 5.008) 8.795 5.446 ( -10.083 -3.979 -3.540) 11.403 5.576 ( 6.040 0.619 -9.998) 11.697 5.795 ( 5.370 -1.639 -1.548) 5.824 6.033 ( -2.601 6.277 -1.942) 7.067 6.228 ( -3.682 3.412 2.514) 5.614 6.307 ( 2.747 2.516 1.691) 4.090 6.370 ( -3.625 1.749 -5.820) 7.076 6.511 ( -1.404 -0.500 2.586) 2.985 6.721 ( -9.909 0.028 2.245) 10.160 6.880 ( -2.872 4.024 2.531) 5.554 7.107 ( 5.296 -11.769 -4.081) 13.536 7.421 ( -3.204 -1.124 1.266) 3.624 7.528 ( 8.767 2.966 0.763) 9.286 7.668 ( 8.395 4.130 4.419) 10.347 7.731 ( 4.676 0.641 -3.418) 5.827 8.555 ( 1.870 -9.423 0.644) 9.629 8.954 ( 3.444 -6.856 -0.328) 7.679 9.059 ( -3.191 2.616 -6.801) 7.956 9.114 ( 2.433 -3.599 5.323) 6.870 9.373 ( 2.925 -3.644 7.002) 8.418 9.469 ( -1.343 1.319 -4.167) 4.572 9.681 ( -5.634 8.273 9.492) 13.794 9.834 ( 1.329 6.983 2.894) 7.675 10.158 ( 5.275 -5.001 1.119) 7.354 10.627 ( -6.701 -1.158 -2.160) 7.135 10.757 ( 24.407 -25.566 -6.884) 36.010 11.026 ( -1.397 -2.146 -3.601) 4.418 11.123 ( -4.640 -0.986 -0.964) 4.841 11.372 ( -7.370 -3.033 -0.562) 7.990 11.524 ( -12.019 -6.001 -8.772) 16.044 11.775 ( 4.669 -1.737 6.107) 7.881 11.837 ( -1.472 1.286 3.807) 4.279 11.992 ( 3.140 -2.741 -0.910) 4.267 12.134 ( -0.016 5.427 0.652) 5.466 12.477 ( 6.996 -2.322 -7.918) 10.818 12.539 ( 5.046 -0.441 2.958) 5.865 12.630 ( 2.392 -1.784 -1.071) 3.170 13.126 ( -5.830 -1.677 7.629) 9.747 13.420 ( 14.027 6.563 3.186) 15.811 14.766 ( 2.552 5.771 4.060) 7.503 15.027 ( -0.935 3.379 1.656) 3.877 15.078 ( -0.202 -7.753 -2.191) 8.059 15.187 ( -2.965 4.784 -2.312) 6.085 15.403 ( 4.453 1.379 6.053) 7.640 15.556 ( -7.055 8.647 -3.892) 11.820 15.668 ( 1.601 1.059 -2.631) 3.256 15.798 ( -1.019 6.763 -1.745) 7.058 16.061 ( 3.993 3.411 -5.741) 7.781 16.119 ( -9.208 -3.230 7.738) 12.453 16.327 ( 6.329 -6.912 -2.172) 9.620 16.634 ( 6.726 -4.597 3.986) 9.069 17.134 ( -11.460 4.239 0.046) 12.219 17.646 ( -15.768 14.454 7.444) 22.649 18.014 ( 1.826 -2.511 -4.120) 5.159 18.450 ( -0.720 18.065 -4.571) 18.648 25.656 ( -1.920 -1.610 0.132) 2.509 25.725 ( -1.050 -2.139 -0.356) 2.409 25.845 ( -1.719 4.799 10.423) 11.603 25.880 ( 0.944 -0.343 0.280) 1.043 25.988 ( 0.044 -1.128 0.199) 1.146 26.405 ( 10.497 -8.949 -6.819) 15.387 26.583 ( 0.774 0.907 5.290) 5.423 26.637 ( 0.659 -0.581 1.345) 1.606 26.925 ( -2.212 -2.841 7.535) 8.351 27.314 ( 16.112 -12.663 8.441) 22.163 28.018 ( -2.655 -5.194 0.697) 5.875 28.447 ( 1.616 -3.497 -1.672) 4.200 28.536 ( 2.507 -8.362 0.140) 8.731 28.588 ( 2.180 -0.413 -4.736) 5.230 29.568 ( -6.275 4.335 11.801) 14.051 30.302 ( -22.256 31.955 -37.394) 53.988 ======================= Grid point 165 (70/140) ======================= q-point: (-0.11 -0.11 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 7.23e-05 7.23e-05 7.23e-05 7.23e-05 7.23e-05 7.23e-05 7.23e-05 7.23e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 135 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.403 ( -19.284 -0.000 8.179) 20.947 0.464 ( -20.774 -0.000 14.348) 25.247 0.999 ( -46.374 -0.000 21.717) 51.207 1.406 ( 1.987 0.000 0.006) 1.987 2.052 ( 1.733 0.000 0.095) 1.736 2.221 ( 4.448 0.000 6.828) 8.149 2.386 ( 11.532 0.000 -6.461) 13.218 2.550 ( -4.685 -0.000 0.087) 4.685 2.633 ( 2.498 0.000 6.169) 6.655 2.788 ( -6.951 -0.000 -2.584) 7.416 2.965 ( -1.254 -0.000 2.182) 2.517 3.393 ( 1.731 0.000 -6.812) 7.028 3.575 ( 0.165 0.000 -4.681) 4.684 3.632 ( -2.907 -0.000 3.579) 4.611 3.642 ( 2.646 0.000 -2.896) 3.922 3.831 ( -2.173 -0.000 9.874) 10.111 4.181 ( -0.650 -0.000 -4.670) 4.715 4.209 ( 6.772 0.000 0.808) 6.820 4.285 ( 6.817 0.000 -3.557) 7.689 4.437 ( 9.414 0.000 -0.489) 9.427 4.601 ( 2.806 0.000 -3.319) 4.347 4.784 ( -3.410 -0.000 5.810) 6.737 4.830 ( -5.349 -0.000 -1.384) 5.526 5.224 ( 0.650 0.000 -1.060) 1.243 5.320 ( -1.382 -0.000 8.173) 8.289 5.336 ( -7.216 -0.000 -0.406) 7.228 5.561 ( 5.489 0.000 -9.490) 10.963 5.798 ( 2.898 0.000 -3.346) 4.427 6.070 ( -0.080 -0.000 -1.204) 1.207 6.253 ( -4.886 -0.000 5.317) 7.221 6.330 ( -3.268 -0.000 -7.566) 8.242 6.372 ( 2.104 0.000 4.845) 5.282 6.527 ( -2.669 -0.000 7.944) 8.380 6.748 ( -0.032 -0.000 2.133) 2.133 6.841 ( -4.486 -0.000 3.526) 5.706 6.931 ( -2.234 -0.000 -1.565) 2.728 7.377 ( -3.797 -0.000 0.138) 3.799 7.600 ( 9.377 0.000 4.922) 10.590 7.722 ( 2.083 0.000 -4.782) 5.216 7.816 ( 6.791 0.000 2.095) 7.106 8.503 ( 4.834 0.000 0.468) 4.857 8.899 ( -0.349 -0.000 -1.138) 1.190 8.981 ( -8.911 -0.000 -12.238) 15.138 9.115 ( 0.878 0.000 1.338) 1.600 9.371 ( -0.278 -0.000 2.552) 2.567 9.472 ( -0.660 -0.000 -1.430) 1.575 9.930 ( 2.053 0.000 2.012) 2.874 10.026 ( 7.614 0.000 -4.939) 9.075 10.271 ( 23.768 0.000 29.701) 38.040 10.303 ( 5.198 0.000 0.419) 5.215 10.575 ( -3.186 -0.000 -0.035) 3.187 11.008 ( -0.536 -0.000 0.172) 0.562 11.095 ( -3.023 -0.000 2.800) 4.121 11.311 ( -6.014 -0.000 3.698) 7.060 11.328 ( -8.465 -0.000 -0.558) 8.483 11.817 ( 0.303 0.000 4.663) 4.673 11.859 ( 0.712 0.000 7.071) 7.107 11.986 ( 2.813 0.000 -0.133) 2.816 12.229 ( 5.939 0.000 5.975) 8.425 12.408 ( 2.512 0.000 -13.451) 13.684 12.592 ( 6.696 0.000 2.394) 7.111 12.622 ( -1.211 -0.000 -0.170) 1.223 13.077 ( -12.671 -0.000 14.100) 18.957 13.650 ( 24.454 0.000 11.637) 27.082 14.908 ( 6.245 0.000 4.145) 7.495 14.954 ( -1.066 -0.000 -1.072) 1.511 15.059 ( -0.635 -0.000 2.076) 2.171 15.178 ( -4.077 -0.000 -3.707) 5.510 15.468 ( -2.470 -0.000 -3.125) 3.984 15.549 ( -5.982 -0.000 -3.828) 7.102 15.668 ( 2.948 0.000 -4.513) 5.390 15.922 ( -0.229 -0.000 0.502) 0.552 16.065 ( -1.985 -0.000 11.818) 11.983 16.199 ( -0.387 -0.000 0.476) 0.613 16.205 ( 10.928 0.000 -7.154) 13.062 16.631 ( 1.891 0.000 3.891) 4.326 17.097 ( -5.571 -0.000 -0.912) 5.645 17.775 ( -6.905 -0.000 2.875) 7.479 17.981 ( 3.592 0.000 -3.985) 5.365 18.549 ( -22.040 -0.000 -46.911) 51.830 25.632 ( -1.048 -0.000 0.658) 1.237 25.696 ( -0.407 -0.000 -0.294) 0.502 25.886 ( 0.757 0.000 0.670) 1.011 25.967 ( 1.295 0.000 0.796) 1.520 26.137 ( 6.478 0.000 12.257) 13.863 26.206 ( 1.711 0.000 -2.278) 2.849 26.607 ( -0.771 -0.000 1.710) 1.876 26.639 ( 0.596 0.000 0.297) 0.666 27.130 ( 0.588 0.000 -2.018) 2.102 27.208 ( 38.104 0.000 66.704) 76.820 27.952 ( -3.436 -0.000 0.641) 3.495 28.446 ( 0.282 0.000 -0.306) 0.416 28.450 ( 1.551 0.000 -2.364) 2.827 28.584 ( 2.974 0.000 -3.750) 4.786 29.604 ( -7.823 -0.000 9.206) 12.081 30.146 ( -46.624 -0.000 -85.065) 97.004 ======================= Grid point 166 (71/140) ======================= q-point: ( 0.00 0.00 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 7.23e-05 7.23e-05 7.23e-05 7.23e-05 7.23e-05 7.23e-05 7.23e-05 7.23e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 140 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.035 ( 8.361 0.000 24.612) 25.993 1.191 ( -18.957 -0.000 27.664) 33.536 1.562 ( -1.834 -0.000 5.526) 5.823 1.863 ( 16.351 0.000 31.285) 35.300 1.977 ( 1.326 0.000 -7.829) 7.940 2.202 ( 1.947 0.000 -2.825) 3.431 2.243 ( 8.637 0.000 -14.965) 17.278 2.518 ( -7.100 -0.000 10.745) 12.879 2.654 ( 2.475 0.000 -0.375) 2.503 2.854 ( -6.151 -0.000 10.431) 12.109 3.084 ( -10.483 -0.000 -13.261) 16.904 3.121 ( 0.335 0.000 8.883) 8.890 3.328 ( 3.542 0.000 -11.508) 12.041 3.467 ( 0.192 0.000 -8.479) 8.481 3.866 ( -0.258 -0.000 9.953) 9.956 3.956 ( -1.961 -0.000 -6.666) 6.949 3.967 ( -1.434 -0.000 -2.950) 3.280 4.319 ( 7.232 0.000 -11.242) 13.367 4.363 ( 0.262 0.000 1.808) 1.827 4.383 ( 1.567 0.000 -1.147) 1.942 4.657 ( -1.177 -0.000 4.459) 4.612 4.684 ( 0.618 0.000 5.460) 5.494 4.794 ( -3.284 -0.000 4.903) 5.901 5.243 ( 0.617 0.000 -16.075) 16.087 5.303 ( -0.038 -0.000 1.049) 1.050 5.319 ( -2.387 -0.000 0.438) 2.427 5.336 ( 3.230 0.000 3.873) 5.043 5.613 ( -1.100 -0.000 -9.558) 9.621 6.124 ( -0.159 -0.000 3.310) 3.314 6.272 ( 7.896 0.000 -3.152) 8.502 6.356 ( -3.692 -0.000 5.532) 6.651 6.446 ( 3.137 0.000 0.838) 3.247 6.659 ( -5.012 -0.000 4.840) 6.968 6.786 ( -1.815 -0.000 -3.799) 4.210 6.879 ( -7.387 -0.000 5.337) 9.113 7.088 ( 14.772 0.000 -2.970) 15.068 7.264 ( -1.495 -0.000 -0.906) 1.748 7.414 ( -5.677 -0.000 -7.873) 9.707 7.943 ( -1.535 -0.000 2.755) 3.153 7.954 ( 3.940 0.000 3.085) 5.004 8.530 ( -0.146 -0.000 5.087) 5.090 8.756 ( -1.663 -0.000 -6.184) 6.404 8.813 ( 0.747 0.000 -2.883) 2.978 8.951 ( -4.266 -0.000 -7.461) 8.595 9.414 ( -1.816 -0.000 0.071) 1.817 9.439 ( 4.584 0.000 0.631) 4.627 10.023 ( -5.323 -0.000 2.952) 6.086 10.097 ( 6.407 0.000 -0.935) 6.475 10.427 ( -10.295 -0.000 3.925) 11.018 10.441 ( 6.761 0.000 3.792) 7.752 10.722 ( 3.502 0.000 5.706) 6.695 10.920 ( -1.558 -0.000 -4.021) 4.312 11.228 ( -2.421 -0.000 4.732) 5.315 11.450 ( 15.797 0.000 -10.249) 18.831 11.474 ( -2.060 -0.000 10.445) 10.646 11.773 ( -1.984 -0.000 -2.912) 3.524 11.999 ( -2.087 -0.000 0.777) 2.227 12.044 ( 2.545 0.000 -0.074) 2.546 12.128 ( 7.139 0.000 -4.758) 8.579 12.340 ( -6.215 -0.000 -10.717) 12.389 12.652 ( -1.919 -0.000 5.562) 5.884 12.759 ( 7.582 0.000 0.340) 7.589 13.410 ( -11.964 -0.000 18.398) 21.946 13.990 ( 4.534 0.000 -10.850) 11.759 14.947 ( -7.713 -0.000 -1.105) 7.791 14.947 ( 1.584 0.000 -0.679) 1.723 15.054 ( -3.736 -0.000 0.584) 3.782 15.075 ( 6.371 0.000 -0.671) 6.406 15.325 ( 6.382 0.000 3.935) 7.497 15.522 ( 0.757 0.000 -6.774) 6.817 15.706 ( -9.682 -0.000 7.652) 12.341 15.896 ( 0.964 0.000 -1.247) 1.576 16.005 ( -1.652 -0.000 -4.724) 5.004 16.102 ( 6.059 0.000 -9.035) 10.878 16.604 ( 21.713 0.000 2.085) 21.813 16.646 ( -10.780 -0.000 0.738) 10.806 17.031 ( -35.738 -0.000 4.793) 36.058 17.128 ( 14.055 0.000 -0.059) 14.056 17.763 ( -7.123 -0.000 3.764) 8.056 17.935 ( 6.528 0.000 -4.318) 7.828 25.679 ( 0.207 0.000 1.751) 1.763 25.698 ( 0.648 0.000 0.197) 0.677 25.905 ( -3.466 -0.000 -0.849) 3.568 25.915 ( 0.494 0.000 0.094) 0.503 26.193 ( -1.712 -0.000 4.169) 4.506 26.271 ( 4.702 0.000 1.153) 4.841 26.536 ( -3.917 -0.000 -1.542) 4.210 26.584 ( -0.436 -0.000 -2.636) 2.672 27.257 ( 6.888 0.000 6.448) 9.435 27.626 ( -10.737 -0.000 -11.053) 15.409 28.322 ( -20.692 -0.000 0.971) 20.714 28.383 ( 3.131 0.000 -3.088) 4.397 28.419 ( -15.435 -0.000 4.168) 15.988 28.591 ( 9.313 0.000 -2.703) 9.697 29.487 ( 57.623 0.000 3.534) 57.732 29.534 ( -22.427 -0.000 0.907) 22.445 ======================= Grid point 167 (72/140) ======================= q-point: ( 0.11 0.00 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 7.23e-05 7.23e-05 7.23e-05 7.23e-05 7.23e-05 7.23e-05 7.23e-05 7.23e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 244 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.212 ( -6.790 -5.789 23.528) 25.163 1.393 ( 5.278 -13.354 20.091) 24.695 1.692 ( -3.763 -13.692 -3.475) 14.619 2.000 ( -2.916 -6.644 -4.968) 8.794 2.122 ( 10.247 -7.296 2.040) 12.743 2.290 ( 11.117 -6.588 -11.309) 17.173 2.333 ( 3.694 -6.956 15.667) 17.535 2.672 ( 3.191 -13.380 13.519) 19.287 2.767 ( 3.249 -9.138 1.729) 9.851 2.867 ( -7.381 -1.878 9.953) 12.533 2.960 ( -9.625 -3.639 -14.691) 17.936 3.167 ( 1.001 0.187 8.653) 8.713 3.304 ( 2.864 -0.614 -10.486) 10.887 3.411 ( -0.984 1.106 -8.551) 8.678 3.839 ( -5.608 4.102 -3.517) 7.788 3.913 ( 1.082 0.726 5.016) 5.182 3.972 ( -1.660 -1.246 1.539) 2.584 4.220 ( 2.132 7.381 -6.218) 9.884 4.339 ( -6.851 0.657 -3.954) 7.937 4.434 ( 2.582 -4.475 -5.141) 7.289 4.665 ( -1.991 2.352 2.496) 3.966 4.705 ( 6.415 0.941 7.864) 10.192 4.864 ( 3.415 -3.308 8.199) 9.478 5.137 ( -7.291 0.117 -14.282) 16.036 5.250 ( 0.036 4.265 -0.032) 4.266 5.351 ( 0.403 -3.537 -1.388) 3.821 5.444 ( 8.980 -2.567 3.743) 10.062 5.596 ( -2.738 -5.103 -9.637) 11.243 6.079 ( 0.335 6.160 2.758) 6.758 6.236 ( 1.986 7.105 -3.114) 8.008 6.364 ( 1.092 0.525 3.404) 3.613 6.470 ( 3.961 1.942 -1.337) 4.610 6.653 ( -4.124 -1.041 4.252) 6.014 6.733 ( 0.564 2.237 -0.129) 2.310 6.815 ( -4.150 3.510 6.473) 8.453 7.148 ( 9.400 3.348 -7.549) 12.512 7.264 ( -0.986 -0.631 1.135) 1.631 7.352 ( -4.682 -1.173 -5.644) 7.427 7.855 ( -6.751 6.291 3.402) 9.835 7.936 ( -2.718 3.493 0.771) 4.493 8.636 ( 2.731 -6.970 5.101) 9.059 8.768 ( -0.532 -6.313 -5.869) 8.636 8.861 ( -2.221 -6.649 -0.456) 7.025 8.961 ( -3.328 -8.326 -6.689) 11.187 9.394 ( -2.149 0.701 2.405) 3.301 9.509 ( 1.550 -3.307 -1.119) 3.820 9.985 ( -6.739 -0.864 2.937) 7.402 10.061 ( 0.245 5.979 2.610) 6.528 10.351 ( -5.466 2.059 6.669) 8.866 10.642 ( 11.640 -9.145 -2.546) 15.020 10.787 ( 3.536 -1.660 5.486) 6.735 10.897 ( -0.910 -0.718 -4.384) 4.534 11.210 ( -4.017 0.511 -0.574) 4.089 11.462 ( 8.955 3.048 -6.780) 11.638 11.541 ( 0.276 -1.893 7.561) 7.799 11.767 ( 0.294 -2.154 -3.420) 4.053 11.954 ( 0.061 3.847 3.485) 5.191 12.076 ( 2.971 0.143 -0.209) 2.982 12.161 ( 7.890 1.320 -2.916) 8.514 12.213 ( -5.187 3.057 -10.592) 12.184 12.584 ( -5.906 5.150 6.304) 10.057 12.795 ( 4.691 2.306 -3.816) 6.472 13.398 ( -13.581 -0.215 15.206) 20.389 13.882 ( -6.295 4.835 -6.551) 10.291 14.874 ( -5.186 1.043 3.524) 6.357 14.999 ( -2.943 -1.596 -0.864) 3.458 15.050 ( 5.522 4.634 -0.749) 7.248 15.110 ( 4.048 -2.891 1.945) 5.341 15.374 ( 3.070 0.286 -0.800) 3.186 15.447 ( 2.780 4.039 -4.687) 6.783 15.646 ( -6.628 1.318 0.944) 6.823 15.761 ( 0.614 11.509 -0.160) 11.526 15.971 ( -4.856 -2.448 1.896) 5.759 16.198 ( 4.645 -5.404 -7.897) 10.637 16.575 ( -13.562 -1.223 -1.178) 13.668 16.672 ( -1.436 0.112 6.175) 6.341 16.908 ( 2.670 3.706 3.343) 5.660 17.269 ( 14.119 -1.482 1.574) 14.284 17.763 ( -2.778 -2.889 0.142) 4.010 17.982 ( 5.888 -1.673 -4.320) 7.492 25.692 ( -0.207 -0.646 1.241) 1.414 25.719 ( 1.055 -1.560 -0.042) 1.884 25.895 ( -3.095 -1.730 0.707) 3.615 25.930 ( 0.144 -1.323 0.318) 1.369 26.171 ( -0.733 3.189 6.031) 6.861 26.308 ( 3.972 -0.053 -1.496) 4.244 26.515 ( -2.658 -1.155 -1.174) 3.127 26.575 ( -0.421 -0.455 -3.712) 3.764 27.311 ( 6.993 3.947 11.148) 13.739 27.476 ( -10.756 1.614 -8.689) 13.921 28.220 ( -15.920 -2.957 5.124) 16.983 28.371 ( -1.936 -5.005 -2.995) 6.146 28.510 ( -4.135 -10.174 0.267) 10.985 28.683 ( 7.590 -3.585 0.617) 8.417 29.315 ( -20.536 3.904 -4.455) 21.374 29.784 ( 43.999 11.395 -3.100) 45.557 ======================= Grid point 168 (73/140) ======================= q-point: ( 0.22 0.00 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 7.23e-05 7.23e-05 7.23e-05 7.23e-05 7.23e-05 7.23e-05 7.23e-05 7.23e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 244 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.422 ( 0.817 -9.306 17.241) 19.609 1.738 ( 5.116 -11.761 11.959) 17.536 1.832 ( -5.750 -12.355 -7.488) 15.549 2.151 ( 0.584 -12.135 0.231) 12.151 2.324 ( 6.066 -7.512 -4.310) 10.574 2.439 ( 11.077 -9.309 -9.224) 17.160 2.592 ( -0.357 -10.011 13.925) 17.154 2.871 ( -2.511 -4.161 -4.354) 6.526 2.895 ( -7.417 -6.316 -3.659) 10.406 2.962 ( -5.274 -9.259 2.832) 11.026 3.078 ( 2.311 -13.658 9.997) 17.083 3.223 ( 3.799 0.263 4.952) 6.247 3.259 ( -1.108 0.558 -10.749) 10.821 3.406 ( 7.298 -5.057 -0.834) 8.918 3.738 ( -6.894 1.189 0.641) 7.025 3.860 ( -3.937 4.413 2.801) 6.544 4.018 ( -0.116 1.347 1.178) 1.793 4.088 ( 0.380 3.804 5.187) 6.443 4.284 ( -4.470 -3.659 -7.619) 9.561 4.499 ( 4.725 -2.545 -3.836) 6.596 4.617 ( 1.408 2.508 -2.276) 3.668 4.769 ( 6.268 1.740 3.583) 7.427 4.965 ( 3.076 0.499 4.570) 5.532 5.000 ( -8.608 0.806 -11.475) 14.367 5.198 ( 0.344 1.343 3.944) 4.180 5.417 ( 3.672 -3.134 -4.029) 6.288 5.563 ( 2.811 -4.561 2.094) 5.752 5.650 ( -2.187 -7.645 -4.490) 9.132 5.991 ( 1.848 5.489 1.766) 6.055 6.085 ( 0.690 9.240 -4.026) 10.103 6.354 ( -0.687 2.735 3.862) 4.782 6.424 ( 2.253 3.404 -2.806) 4.953 6.637 ( -7.304 -1.876 -1.210) 7.638 6.735 ( -1.212 2.162 4.250) 4.920 6.817 ( 6.322 0.244 6.947) 9.396 7.066 ( 3.015 4.769 -8.241) 9.987 7.261 ( -2.995 1.836 0.887) 3.623 7.324 ( 1.745 0.035 -0.361) 1.782 7.700 ( -9.064 5.526 2.266) 10.855 7.854 ( -1.610 4.095 0.351) 4.414 8.786 ( -2.175 -7.824 -0.237) 8.125 8.897 ( 3.610 -9.064 -0.372) 9.763 8.982 ( -5.223 -9.228 0.565) 10.618 9.082 ( -2.387 -11.928 -3.940) 12.786 9.373 ( -2.635 1.524 4.626) 5.537 9.518 ( -3.893 -0.006 -3.017) 4.925 9.966 ( -5.113 4.288 4.659) 8.138 10.002 ( -1.504 -2.145 3.440) 4.324 10.318 ( -2.900 1.695 4.797) 5.856 10.842 ( 11.059 -4.287 -4.124) 12.557 10.875 ( -0.114 -0.985 -0.474) 1.099 10.914 ( 7.490 -4.750 1.787) 9.048 11.156 ( -5.528 -1.717 -7.510) 9.482 11.449 ( 6.589 1.783 -4.963) 8.439 11.605 ( -0.262 -1.820 5.187) 5.504 11.809 ( 3.709 -2.648 -4.213) 6.206 11.916 ( 0.238 4.041 5.561) 6.878 12.023 ( -2.571 5.315 -1.262) 6.038 12.131 ( 3.443 1.032 -2.313) 4.274 12.185 ( 7.081 0.262 -4.092) 8.182 12.486 ( -5.810 4.919 6.205) 9.821 12.709 ( 2.336 7.106 -6.984) 10.234 13.334 ( -14.628 2.362 9.144) 17.412 13.694 ( -7.305 8.212 -4.119) 11.737 14.836 ( -4.674 2.450 5.119) 7.352 14.940 ( -0.090 5.923 4.133) 7.223 15.003 ( 0.674 0.335 -2.174) 2.300 15.229 ( -0.295 -5.433 2.755) 6.099 15.359 ( 2.031 0.830 -2.953) 3.679 15.449 ( 6.196 -0.419 -4.136) 7.461 15.593 ( 0.047 1.035 -3.640) 3.784 15.629 ( 1.282 4.896 2.386) 5.596 15.945 ( -8.941 0.322 1.278) 9.038 16.248 ( 2.189 -0.880 -3.904) 4.562 16.487 ( -9.773 -0.873 0.255) 9.815 16.734 ( -6.110 -5.773 6.633) 10.708 16.866 ( 10.270 8.436 1.875) 13.422 17.393 ( 12.122 0.307 2.084) 12.304 17.788 ( -0.887 -1.910 -2.260) 3.089 18.028 ( 5.246 -1.102 -4.336) 6.894 25.713 ( -0.216 -1.543 1.229) 1.984 25.758 ( 1.290 -2.015 -0.774) 2.514 25.913 ( -2.476 -1.911 1.965) 3.693 25.955 ( -0.690 -1.306 0.635) 1.607 26.136 ( -1.236 3.599 4.799) 6.125 26.320 ( 4.200 0.643 -4.643) 6.294 26.521 ( -1.000 -1.218 0.381) 1.621 26.562 ( -0.041 -1.018 -2.534) 2.731 27.296 ( -5.498 3.576 1.359) 6.698 27.393 ( 4.642 3.330 5.301) 7.793 28.189 ( -9.327 -2.121 4.814) 10.708 28.432 ( -3.290 -5.930 -7.570) 10.163 28.669 ( -6.074 -13.388 -0.766) 14.722 28.806 ( -4.069 -5.185 2.930) 7.213 29.116 ( -4.979 1.052 -5.349) 7.383 29.805 ( 30.818 17.655 -2.527) 35.607 ======================= Grid point 169 (74/140) ======================= q-point: ( 0.33 0.00 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 7.23e-05 7.23e-05 7.23e-05 7.23e-05 7.23e-05 7.23e-05 7.23e-05 7.23e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 244 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.669 ( 5.374 -7.651 11.492) 14.814 1.941 ( -4.232 -7.318 8.224) 11.794 1.999 ( 2.448 -10.168 -2.607) 10.779 2.328 ( -2.924 -8.341 -2.504) 9.187 2.440 ( 11.624 -4.646 -9.132) 15.495 2.642 ( 4.231 -7.994 -2.153) 9.297 2.729 ( -0.566 -2.803 4.106) 5.004 2.866 ( -3.942 -0.382 1.912) 4.397 2.938 ( -5.023 -4.311 -6.969) 9.612 3.058 ( -2.763 -3.338 -0.024) 4.333 3.109 ( -4.587 -0.730 -6.093) 7.662 3.269 ( 0.972 -1.025 -0.894) 1.672 3.333 ( -3.093 -11.178 4.500) 12.440 3.553 ( 1.574 2.627 4.409) 5.368 3.723 ( -4.466 2.749 -1.073) 5.353 3.804 ( 2.594 -4.971 7.952) 9.730 3.957 ( -1.100 -0.426 2.384) 2.660 4.176 ( 2.595 -2.920 7.789) 8.714 4.314 ( 3.265 -4.488 -6.203) 8.323 4.533 ( 3.703 0.927 -2.695) 4.673 4.586 ( 2.790 2.886 -1.604) 4.323 4.790 ( 0.913 -2.137 -5.991) 6.426 4.880 ( -4.044 2.672 -3.841) 6.184 4.928 ( 1.388 5.158 0.669) 5.383 5.265 ( 0.600 -4.949 5.374) 7.330 5.439 ( 2.862 0.054 -8.144) 8.632 5.677 ( -0.232 -4.828 4.920) 6.897 5.744 ( -2.320 -6.371 -0.615) 6.808 5.900 ( -1.849 5.416 -4.670) 7.386 6.008 ( 7.241 0.126 2.231) 7.578 6.306 ( -4.018 2.201 0.866) 4.662 6.391 ( 3.787 2.148 -2.049) 4.812 6.579 ( -10.959 0.517 2.037) 11.158 6.741 ( 1.737 -0.823 3.649) 4.124 6.843 ( 3.655 2.020 -3.075) 5.186 7.043 ( 1.878 -0.555 0.864) 2.140 7.177 ( -5.285 2.958 2.506) 6.554 7.373 ( 7.591 0.086 1.639) 7.766 7.578 ( -5.313 2.840 1.712) 6.264 7.768 ( -0.622 5.548 -0.521) 5.607 8.864 ( -6.398 -5.874 -0.692) 8.714 9.024 ( -0.199 -1.258 3.389) 3.620 9.106 ( -1.927 -10.404 -0.705) 10.604 9.221 ( -4.219 -6.742 -4.428) 9.103 9.374 ( -1.139 0.794 2.908) 3.223 9.481 ( -0.987 -4.464 -0.358) 4.585 9.877 ( -7.861 2.790 3.935) 9.223 10.053 ( 0.684 -2.215 2.424) 3.353 10.279 ( -2.811 3.517 3.544) 5.730 10.824 ( -2.010 1.518 -2.476) 3.532 10.987 ( 12.644 -0.089 -4.557) 13.440 11.065 ( 6.285 -3.966 4.056) 8.467 11.135 ( -2.174 -5.725 -10.913) 12.514 11.464 ( 1.780 -1.621 -1.531) 2.853 11.628 ( 0.743 2.128 -0.352) 2.281 11.836 ( 3.141 0.729 -2.166) 3.885 11.877 ( -5.200 -1.347 1.169) 5.497 11.985 ( 6.304 1.603 6.379) 9.111 12.158 ( 6.067 -0.504 -0.022) 6.088 12.224 ( 5.292 -1.367 -4.608) 7.149 12.366 ( -4.306 7.381 2.568) 8.923 12.584 ( 2.450 5.380 -4.031) 7.156 13.178 ( -14.348 6.336 3.313) 16.031 13.461 ( -7.481 10.063 -2.944) 12.880 14.787 ( -1.459 1.266 1.032) 2.190 14.895 ( -0.832 1.707 4.513) 4.897 15.025 ( 0.525 -2.411 1.005) 2.664 15.255 ( -0.445 6.005 -3.417) 6.923 15.345 ( -2.472 -4.436 3.783) 6.333 15.503 ( 6.161 -0.604 -1.327) 6.331 15.574 ( 2.282 0.319 -3.794) 4.440 15.634 ( 2.169 -0.968 -0.435) 2.415 15.866 ( -6.902 0.622 0.477) 6.946 16.235 ( -0.858 1.344 -0.883) 1.823 16.442 ( -6.477 0.009 3.152) 7.203 16.762 ( -6.703 -0.679 0.066) 6.737 16.884 ( 11.055 0.700 6.037) 12.615 17.456 ( 8.747 2.498 0.209) 9.099 17.792 ( -2.246 -1.485 -1.353) 3.013 18.058 ( 4.285 -0.473 -3.739) 5.706 25.753 ( 0.301 -2.364 1.429) 2.779 25.794 ( 0.655 -1.672 -0.942) 2.027 25.934 ( -1.626 -1.246 2.177) 2.989 25.961 ( -1.494 0.003 0.350) 1.534 26.069 ( -2.288 4.374 0.910) 5.019 26.312 ( 5.088 1.169 -5.430) 7.532 26.544 ( -0.277 -1.419 2.570) 2.949 26.594 ( 0.777 -2.244 1.106) 2.620 27.205 ( -4.305 0.916 -5.656) 7.167 27.389 ( 5.184 6.911 10.719) 13.767 28.184 ( -8.509 -2.364 3.694) 9.573 28.441 ( -4.851 -4.670 -8.354) 10.730 28.760 ( -9.086 -1.183 -4.219) 10.087 28.856 ( -6.139 -13.441 -1.761) 14.881 29.197 ( 6.666 -5.658 3.560) 9.441 29.684 ( 20.979 18.753 -1.009) 28.157 ======================= Grid point 170 (75/140) ======================= q-point: (-0.56 0.00 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 7.23e-05 7.23e-05 7.23e-05 7.23e-05 7.23e-05 7.23e-05 7.23e-05 7.23e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 244 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.825 ( 0.965 -1.304 7.285) 7.463 2.007 ( -4.084 -0.002 6.024) 7.278 2.150 ( 1.846 -4.764 4.544) 6.837 2.372 ( 1.019 -1.274 -2.088) 2.650 2.523 ( 5.304 1.323 -9.167) 10.674 2.659 ( -0.623 1.875 -4.003) 4.464 2.824 ( -2.276 3.214 -8.057) 8.968 2.856 ( -3.526 -7.967 -5.251) 10.173 2.874 ( -0.030 -2.463 4.343) 4.993 3.031 ( -0.055 2.839 -0.334) 2.859 3.141 ( -1.052 -2.631 -2.109) 3.532 3.314 ( -1.090 -2.606 5.783) 6.436 3.461 ( -3.338 -2.079 -0.146) 3.935 3.498 ( -0.085 0.380 2.878) 2.905 3.645 ( -2.187 -1.504 0.189) 2.661 3.885 ( -6.251 0.898 5.106) 8.122 4.066 ( 6.617 -5.565 3.159) 9.205 4.271 ( 5.762 -0.261 7.897) 9.779 4.402 ( 5.113 -3.414 -4.922) 7.876 4.489 ( 2.304 6.509 -4.381) 8.177 4.528 ( -2.204 2.102 1.322) 3.320 4.751 ( -5.545 0.923 -5.507) 7.870 4.823 ( -0.235 4.278 2.289) 4.857 4.910 ( 6.847 -1.697 -3.206) 7.749 5.387 ( -1.198 -6.013 1.299) 6.267 5.405 ( 1.241 -0.515 -8.933) 9.034 5.719 ( 2.624 1.736 2.508) 4.024 5.800 ( -3.476 -2.459 -1.383) 4.477 5.855 ( -0.282 -1.103 4.202) 4.354 6.120 ( 6.545 -3.981 0.059) 7.661 6.225 ( -7.086 1.612 -1.844) 7.498 6.398 ( 5.478 -0.000 -0.878) 5.548 6.486 ( -9.257 2.475 3.846) 10.326 6.809 ( 1.767 -3.778 1.309) 4.371 6.845 ( 3.628 -0.645 -0.800) 3.771 7.005 ( -6.013 1.491 -3.654) 7.193 7.192 ( -1.512 -3.795 9.180) 10.048 7.402 ( 2.469 1.735 -1.533) 3.385 7.573 ( 5.961 0.044 1.299) 6.101 7.658 ( -0.430 5.955 0.988) 6.052 8.876 ( -9.243 -2.562 2.406) 9.889 9.055 ( 2.088 -1.781 1.887) 3.330 9.187 ( 3.070 3.672 -6.169) 7.808 9.226 ( -4.281 -4.624 -0.507) 6.322 9.352 ( -3.647 -1.876 0.128) 4.104 9.649 ( 1.488 -9.358 3.680) 10.165 9.787 ( -7.618 2.352 1.636) 8.139 10.110 ( 2.578 -1.919 -0.515) 3.255 10.179 ( -3.988 7.149 5.838) 10.054 10.772 ( -1.868 1.782 -1.136) 2.821 11.004 ( 11.642 4.692 -7.237) 14.489 11.089 ( -2.490 -1.265 -7.095) 7.625 11.259 ( 4.459 -5.324 0.889) 7.001 11.503 ( -2.398 -0.945 2.172) 3.371 11.561 ( -0.149 1.692 1.406) 2.205 11.834 ( -4.254 0.199 1.046) 4.385 11.894 ( 1.984 -2.798 -5.628) 6.591 12.063 ( 5.882 3.171 5.089) 8.400 12.197 ( 4.563 2.254 2.452) 5.650 12.274 ( 4.120 -5.264 -4.254) 7.924 12.293 ( 1.833 -1.330 1.533) 2.735 12.536 ( 3.933 0.871 -3.605) 5.406 12.954 ( -11.762 7.905 -0.412) 14.178 13.245 ( -5.640 7.524 -0.378) 9.411 14.780 ( -0.580 -0.740 -1.617) 1.871 14.914 ( -0.872 -1.349 5.834) 6.051 15.064 ( 2.761 4.044 0.498) 4.922 15.132 ( -0.406 0.467 -1.649) 1.762 15.428 ( -2.298 -4.670 1.484) 5.412 15.536 ( 3.604 0.783 0.332) 3.703 15.554 ( -0.390 1.722 -3.674) 4.076 15.634 ( 1.154 1.245 -0.270) 1.719 15.856 ( -1.076 -2.207 -1.000) 2.651 16.195 ( -2.617 0.789 0.565) 2.791 16.434 ( -5.133 -2.059 6.204) 8.311 16.712 ( -0.910 2.005 -2.335) 3.209 16.994 ( 4.234 -2.094 5.357) 7.142 17.460 ( 3.800 1.796 -1.490) 4.459 17.801 ( -2.342 -2.357 -0.381) 3.344 18.073 ( 3.234 0.174 -3.360) 4.667 25.801 ( -0.695 -1.212 1.696) 2.197 25.813 ( 0.260 -1.550 -0.244) 1.591 25.937 ( -1.714 1.474 0.934) 2.446 25.954 ( -0.116 -0.798 -0.484) 0.941 25.976 ( -2.086 3.626 -0.591) 4.225 26.314 ( 5.096 0.618 -4.017) 6.518 26.585 ( 1.073 -0.887 4.571) 4.778 26.644 ( 0.180 -1.969 2.619) 3.282 27.130 ( -2.308 0.990 -10.353) 10.653 27.377 ( 4.389 4.617 12.910) 14.396 28.155 ( -8.255 -1.486 -1.591) 8.537 28.459 ( -2.916 -4.431 -3.597) 6.409 28.696 ( -3.020 0.106 -5.817) 6.555 29.022 ( -4.571 -11.101 -0.205) 12.007 29.321 ( 3.513 -0.240 1.297) 3.753 29.539 ( 11.432 11.297 2.183) 16.220 ======================= Grid point 171 (76/140) ======================= q-point: (-0.44 0.00 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 7.23e-05 7.23e-05 7.23e-05 7.23e-05 7.23e-05 7.23e-05 7.23e-05 7.23e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 244 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.797 ( -8.012 4.692 7.343) 11.838 1.932 ( -4.994 9.424 8.963) 13.931 2.215 ( 3.896 4.081 11.787) 13.068 2.359 ( 1.414 7.985 -1.169) 8.193 2.405 ( 1.588 4.313 -10.984) 11.907 2.570 ( -5.322 2.066 -7.690) 9.577 2.710 ( 1.205 5.556 -3.221) 6.534 2.880 ( 3.690 1.960 -1.839) 4.565 2.948 ( -1.598 1.600 -3.246) 3.956 3.021 ( 0.174 -6.584 -0.065) 6.587 3.156 ( -0.684 -1.513 -0.444) 1.719 3.323 ( 3.686 5.567 4.192) 7.883 3.471 ( -2.827 -5.365 1.216) 6.185 3.557 ( -0.280 -0.854 1.462) 1.716 3.705 ( 2.367 -5.065 -2.129) 5.983 3.818 ( -6.143 2.942 5.655) 8.853 4.195 ( 5.730 -2.653 0.891) 6.377 4.290 ( -3.607 7.522 -2.082) 8.598 4.357 ( 7.470 4.127 8.042) 11.727 4.439 ( -5.004 -0.236 4.868) 6.985 4.539 ( 2.990 -3.348 -6.001) 7.494 4.662 ( -4.626 2.910 0.640) 5.503 4.715 ( 0.614 7.910 -4.609) 9.176 5.009 ( 7.157 -3.720 -2.016) 8.314 5.388 ( 1.625 -1.943 -7.075) 7.514 5.444 ( -4.223 -2.774 -3.350) 6.062 5.749 ( 3.893 -0.088 2.470) 4.612 5.780 ( -3.117 -0.056 -1.127) 3.315 5.880 ( 1.285 2.500 5.204) 5.915 6.137 ( -4.732 0.584 -1.522) 5.004 6.220 ( 4.319 -2.461 -2.235) 5.450 6.375 ( -8.021 2.584 3.014) 8.950 6.474 ( 5.072 -1.554 -0.341) 5.316 6.863 ( -2.497 -0.459 -2.611) 3.642 6.890 ( -2.054 0.142 0.942) 2.264 6.968 ( 0.971 -6.973 0.045) 7.040 7.320 ( -2.031 -6.906 5.709) 9.188 7.387 ( 1.549 -0.468 0.666) 1.750 7.512 ( 0.705 5.609 -4.339) 7.127 7.689 ( 7.773 -0.252 3.412) 8.493 8.860 ( -8.489 -2.435 4.333) 9.836 9.107 ( 5.608 2.589 -6.004) 8.613 9.153 ( 5.349 -1.455 1.203) 5.672 9.220 ( -2.868 0.745 -0.762) 3.059 9.360 ( -1.225 -0.739 -0.492) 1.512 9.692 ( -2.843 4.735 2.649) 6.126 9.775 ( -1.337 -2.023 1.638) 2.927 10.005 ( -4.744 7.086 1.295) 8.626 10.215 ( 3.623 -3.052 6.555) 8.088 10.719 ( -1.255 3.130 0.511) 3.411 10.967 ( 12.329 5.920 -7.420) 15.560 11.053 ( -7.003 -2.950 -6.253) 9.841 11.253 ( -4.817 5.554 1.855) 7.582 11.527 ( 1.981 -0.702 4.500) 4.967 11.616 ( -0.818 -5.350 -1.013) 5.506 11.819 ( -3.251 -2.337 0.447) 4.029 11.843 ( -0.877 4.858 -5.308) 7.248 12.012 ( 2.106 7.073 3.461) 8.152 12.236 ( 6.077 0.453 2.486) 6.582 12.319 ( -0.849 -2.623 -3.344) 4.334 12.448 ( 0.716 -9.190 -2.429) 9.532 12.558 ( -1.392 -1.674 -7.700) 8.002 12.832 ( 5.763 -1.531 4.178) 7.281 13.150 ( -0.837 1.380 4.112) 4.417 14.770 ( -2.549 -0.532 -1.192) 2.864 14.899 ( 0.968 6.441 4.553) 7.946 15.057 ( 1.579 -3.990 1.592) 4.576 15.191 ( 3.290 -3.618 -2.364) 5.432 15.449 ( -1.174 0.652 -2.090) 2.484 15.490 ( -0.214 3.426 -1.157) 3.623 15.549 ( -0.881 -0.024 4.600) 4.684 15.630 ( 1.349 -0.511 -2.203) 2.633 15.873 ( 0.741 -1.047 -3.080) 3.337 16.197 ( -3.327 -2.824 1.608) 4.651 16.479 ( -2.797 -2.357 5.666) 6.744 16.670 ( 1.395 1.050 -2.073) 2.710 17.048 ( -1.943 -0.436 3.595) 4.110 17.459 ( -2.130 -1.823 -0.946) 2.959 17.834 ( -0.591 -3.462 -1.787) 3.940 18.069 ( 2.379 0.783 -3.501) 4.305 25.790 ( -2.352 1.023 1.509) 2.976 25.841 ( -0.228 0.060 -0.167) 0.289 25.892 ( -1.279 2.765 -0.359) 3.067 25.907 ( -0.679 0.640 1.565) 1.822 25.990 ( 1.044 -1.503 -0.174) 1.838 26.324 ( 4.015 0.336 -4.030) 5.699 26.631 ( 2.772 0.016 4.401) 5.201 26.689 ( -0.353 -1.606 4.706) 4.985 27.032 ( -2.292 2.045 -11.069) 11.487 27.447 ( 5.910 -0.778 12.263) 13.635 28.106 ( -4.787 -0.775 -4.015) 6.296 28.494 ( -0.514 -2.197 -0.156) 2.262 28.641 ( 0.444 2.122 -6.307) 6.669 29.077 ( 2.458 6.438 -2.437) 7.310 29.314 ( -4.321 -5.037 1.811) 6.879 29.533 ( -0.263 -0.857 2.271) 2.441 ======================= Grid point 172 (77/140) ======================= q-point: (-0.33 0.00 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 7.23e-05 7.23e-05 7.23e-05 7.23e-05 7.23e-05 7.23e-05 7.23e-05 7.23e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 244 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.639 ( -9.739 10.865 11.078) 18.320 1.735 ( -7.358 14.656 17.145) 23.725 2.075 ( -5.988 17.819 2.777) 19.002 2.179 ( 2.948 14.178 6.672) 15.945 2.323 ( 5.410 4.102 -7.498) 10.115 2.446 ( -1.805 4.478 -8.836) 10.069 2.649 ( 0.317 2.512 2.903) 3.853 2.794 ( 2.535 7.669 -5.933) 10.022 2.936 ( 2.711 0.651 0.889) 2.927 3.075 ( 1.010 2.423 1.021) 2.817 3.148 ( 0.192 3.847 2.593) 4.643 3.298 ( 0.109 -1.112 -4.573) 4.707 3.492 ( 2.037 4.643 -1.270) 5.227 3.569 ( -2.883 -1.182 2.846) 4.221 3.704 ( -4.830 2.469 6.209) 8.245 3.844 ( 2.868 -4.844 -3.047) 6.401 4.095 ( -4.698 5.353 1.608) 7.302 4.308 ( 4.235 -1.187 1.653) 4.699 4.397 ( 5.058 0.461 -2.321) 5.584 4.436 ( -3.985 1.339 7.876) 8.928 4.506 ( -1.264 5.767 -3.250) 6.739 4.600 ( 5.622 -1.559 -7.089) 9.181 4.649 ( -2.319 -1.228 4.604) 5.299 5.102 ( 5.565 -2.882 -3.283) 7.074 5.400 ( -1.909 1.822 -4.235) 4.990 5.413 ( -1.004 -2.967 -4.701) 5.649 5.745 ( -3.426 0.787 -0.586) 3.564 5.778 ( -0.475 0.378 0.561) 0.827 5.852 ( 4.910 4.029 1.374) 6.498 6.111 ( -2.596 -1.804 -1.055) 3.332 6.248 ( 0.071 0.201 -1.759) 1.772 6.332 ( -1.415 -1.579 2.231) 3.078 6.535 ( 3.578 -1.634 0.876) 4.030 6.754 ( -11.297 1.780 -1.604) 11.549 6.901 ( 1.925 1.507 1.086) 2.675 7.126 ( -0.224 -8.294 -2.329) 8.618 7.362 ( -2.601 -1.849 -2.094) 3.817 7.442 ( 4.104 1.009 -2.126) 4.730 7.517 ( 2.873 -7.080 5.638) 9.496 7.743 ( 5.415 0.526 -1.170) 5.565 8.849 ( -5.051 1.147 2.753) 5.866 9.079 ( 4.054 6.912 1.273) 8.113 9.128 ( 2.623 0.603 -3.445) 4.371 9.228 ( 1.657 2.428 -4.111) 5.054 9.363 ( 2.610 0.237 0.267) 2.635 9.608 ( 1.794 6.021 -1.500) 6.459 9.753 ( -3.376 -0.809 4.988) 6.077 9.915 ( -1.626 4.293 9.254) 10.330 10.323 ( 2.449 -2.346 5.461) 6.429 10.662 ( -0.308 3.137 2.117) 3.797 10.929 ( 11.349 5.812 -7.679) 14.885 11.017 ( -9.263 -3.584 -3.518) 10.537 11.123 ( -4.791 5.068 2.216) 7.317 11.484 ( -1.768 6.040 -1.726) 6.525 11.662 ( -3.706 0.943 -3.176) 4.971 11.763 ( 1.002 -0.562 -0.047) 1.150 11.871 ( 1.283 -3.447 0.746) 3.753 11.948 ( -0.241 2.482 6.128) 6.616 12.259 ( -6.662 1.834 3.709) 7.843 12.313 ( 5.169 -1.217 -8.364) 9.907 12.464 ( -5.405 -3.559 -10.285) 12.152 12.596 ( 3.300 -4.012 -0.776) 5.252 13.093 ( 14.550 -9.817 6.488) 18.713 13.232 ( 4.906 -6.552 7.364) 11.010 14.770 ( -2.944 -3.585 -0.396) 4.656 14.850 ( 1.386 2.880 5.625) 6.470 15.127 ( 0.608 -1.524 -1.255) 2.066 15.267 ( 7.521 -1.437 -1.440) 7.791 15.396 ( -5.287 2.515 -0.254) 5.861 15.430 ( -0.523 1.015 -0.608) 1.294 15.568 ( -1.797 -0.968 2.615) 3.318 15.652 ( 1.366 -1.879 -2.308) 3.275 15.884 ( 3.812 -0.741 -4.085) 5.636 16.227 ( -4.573 -2.549 2.348) 5.738 16.475 ( 0.953 3.790 0.288) 3.919 16.718 ( 2.257 -4.749 2.279) 5.731 17.020 ( -7.430 0.593 1.661) 7.636 17.476 ( -9.640 -5.275 1.063) 11.040 17.876 ( 0.419 -2.970 -5.172) 5.979 18.052 ( 1.966 0.895 -4.563) 5.048 25.750 ( -1.877 2.386 1.135) 3.241 25.803 ( -1.154 2.572 -0.741) 2.915 25.872 ( -1.165 -0.738 3.752) 3.997 25.922 ( 0.717 -0.410 2.393) 2.532 26.013 ( 1.034 -0.346 -0.777) 1.339 26.321 ( 2.711 0.732 -4.546) 5.343 26.654 ( 0.514 0.412 0.056) 0.661 26.750 ( 2.895 -0.565 7.520) 8.078 26.931 ( -2.626 1.333 -8.032) 8.554 27.608 ( 5.288 -6.651 8.851) 12.270 28.081 ( 2.818 0.702 -1.409) 3.228 28.526 ( 3.288 0.049 2.129) 3.918 28.567 ( 3.338 4.381 -6.772) 8.729 28.893 ( 3.061 13.435 -3.111) 14.126 29.392 ( -10.925 -6.313 -3.409) 13.071 29.547 ( -8.693 -5.066 3.613) 10.690 ======================= Grid point 173 (78/140) ======================= q-point: (-0.22 0.00 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 7.23e-05 7.23e-05 7.23e-05 7.23e-05 7.23e-05 7.23e-05 7.23e-05 7.23e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 244 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.425 ( -8.181 15.166 19.054) 25.690 1.467 ( -6.775 20.420 12.455) 24.859 1.755 ( -9.907 15.202 20.117) 27.091 1.932 ( 3.862 21.189 10.062) 23.772 2.255 ( 9.567 6.864 -11.815) 16.680 2.318 ( -0.263 3.075 -10.594) 11.034 2.539 ( -5.008 11.000 -1.438) 12.171 2.698 ( 3.490 7.389 6.780) 10.618 2.883 ( 0.901 7.384 3.393) 8.176 3.024 ( 0.759 8.758 -4.469) 9.862 3.058 ( -0.994 2.858 4.023) 5.034 3.262 ( -1.668 0.949 -0.975) 2.153 3.440 ( -5.623 4.099 0.649) 6.989 3.489 ( 2.026 -0.647 -6.345) 6.692 3.762 ( 0.191 -2.896 7.023) 7.599 3.928 ( 1.377 -5.369 -4.110) 6.900 4.039 ( -3.336 0.565 0.604) 3.437 4.227 ( -5.091 2.667 -9.109) 10.770 4.383 ( 6.284 3.652 3.239) 7.957 4.446 ( 4.189 1.756 0.447) 4.565 4.500 ( 6.738 0.625 -0.114) 6.768 4.663 ( 2.054 -3.822 -0.312) 4.350 4.718 ( -5.486 -6.363 4.760) 9.657 5.165 ( 4.976 -3.095 -6.470) 8.729 5.320 ( 0.713 4.141 -2.185) 4.736 5.421 ( -3.981 -2.091 -3.413) 5.645 5.598 ( -5.395 9.096 -1.125) 10.636 5.797 ( 4.109 3.841 -5.105) 7.596 5.885 ( 0.315 -7.787 2.256) 8.113 6.147 ( -1.163 -5.168 -2.728) 5.959 6.254 ( 0.449 -1.047 2.224) 2.498 6.392 ( 1.370 -3.297 3.287) 4.853 6.567 ( -0.810 1.252 2.571) 2.972 6.689 ( -6.652 -4.736 1.354) 8.277 6.874 ( -1.453 2.439 1.882) 3.406 7.150 ( -1.073 1.292 -5.364) 5.620 7.352 ( -3.188 -1.419 -3.570) 4.992 7.515 ( 1.146 -5.025 -5.731) 7.708 7.675 ( 8.619 -4.598 3.426) 10.352 7.776 ( 3.950 -1.147 1.795) 4.488 8.746 ( -3.372 7.805 1.906) 8.714 8.966 ( 1.626 7.425 -3.365) 8.312 9.050 ( 2.431 9.339 -4.568) 10.677 9.199 ( 1.710 3.077 -3.444) 4.925 9.357 ( 0.758 0.255 3.106) 3.207 9.526 ( -0.592 2.485 -3.403) 4.256 9.815 ( 2.470 -0.199 9.614) 9.928 9.949 ( 2.057 -3.779 7.713) 8.832 10.370 ( -0.867 0.670 6.647) 6.736 10.640 ( 0.968 1.395 2.954) 3.408 10.829 ( 1.920 7.580 -9.586) 12.370 11.003 ( -5.184 0.906 2.952) 6.034 11.081 ( 6.090 -2.089 -1.791) 6.683 11.360 ( -0.189 4.894 -1.431) 5.102 11.555 ( -4.682 5.119 2.677) 7.436 11.803 ( -0.192 -2.398 -2.370) 3.377 11.947 ( 2.967 -3.443 0.065) 4.545 11.963 ( -2.264 -0.169 5.302) 5.768 12.172 ( -5.217 0.433 -3.194) 6.132 12.378 ( 5.761 -2.999 1.353) 6.635 12.448 ( -5.803 -4.587 -9.441) 11.994 12.670 ( 6.311 -0.818 -0.357) 6.374 13.303 ( 0.599 -4.508 11.451) 12.321 13.533 ( 19.584 -11.471 2.332) 22.816 14.861 ( -2.649 -9.105 0.670) 9.506 14.873 ( 1.023 -1.212 4.876) 5.127 15.105 ( 3.345 4.005 -2.950) 5.995 15.279 ( 0.724 4.817 2.568) 5.506 15.334 ( -6.675 -0.216 -2.518) 7.138 15.433 ( -1.157 -3.050 -1.649) 3.655 15.598 ( 0.193 -4.950 -1.669) 5.227 15.687 ( 0.366 -2.050 0.286) 2.102 15.927 ( 7.692 -0.823 -2.541) 8.142 16.223 ( -4.199 0.089 1.704) 4.532 16.409 ( 3.810 5.123 -0.056) 6.385 16.836 ( 8.311 -1.055 2.922) 8.873 16.946 ( -14.610 -2.677 -0.047) 14.853 17.476 ( -20.193 -6.747 1.465) 21.341 17.873 ( 0.076 -0.110 -7.102) 7.104 18.020 ( 1.303 1.540 -6.953) 7.240 25.703 ( -1.063 2.274 1.434) 2.891 25.748 ( -0.524 2.541 -0.504) 2.643 25.912 ( -0.001 -0.912 2.722) 2.870 25.957 ( -1.132 -2.330 5.597) 6.167 26.009 ( 1.156 0.695 0.011) 1.349 26.300 ( 1.985 1.253 -4.298) 4.897 26.631 ( -1.347 0.955 -2.219) 2.766 26.744 ( -0.329 3.835 -5.294) 6.546 26.949 ( 2.450 -4.343 7.625) 9.110 27.775 ( -7.118 -9.195 -3.305) 12.088 28.161 ( 16.181 -1.027 7.610) 17.910 28.480 ( 8.145 5.783 -7.833) 12.694 28.594 ( 11.839 1.917 6.447) 13.616 28.694 ( 5.475 10.647 -0.624) 11.988 29.236 ( -21.435 4.320 -12.481) 25.178 29.619 ( -14.432 -8.798 6.884) 18.250 ======================= Grid point 174 (79/140) ======================= q-point: (-0.11 0.00 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 7.23e-05 7.23e-05 7.23e-05 7.23e-05 7.23e-05 7.23e-05 7.23e-05 7.23e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 244 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.081 ( -0.077 22.089 17.127) 27.951 1.275 ( -16.613 7.469 25.166) 31.066 1.638 ( -3.016 8.603 21.148) 23.030 1.711 ( 10.377 16.935 25.111) 32.016 2.109 ( 6.045 10.676 -11.623) 16.901 2.229 ( -0.697 0.718 -12.755) 12.794 2.322 ( 3.034 8.149 -5.109) 10.085 2.582 ( -3.752 7.864 9.157) 12.640 2.776 ( -1.015 11.771 -3.554) 12.338 2.855 ( -3.193 1.793 9.139) 9.845 3.075 ( 0.431 -0.164 6.026) 6.044 3.216 ( -8.369 0.327 -4.206) 9.372 3.362 ( 1.923 0.687 -9.686) 9.898 3.492 ( 1.631 -1.189 -8.736) 8.966 3.824 ( -0.559 -0.100 9.746) 9.763 3.958 ( -3.185 -2.271 -4.881) 6.255 4.004 ( -1.126 0.193 -2.023) 2.323 4.228 ( 3.987 -5.806 -5.574) 8.982 4.377 ( 5.094 2.905 0.337) 5.874 4.419 ( 5.151 4.756 -3.460) 7.818 4.574 ( 3.774 -3.545 2.895) 5.932 4.701 ( -1.949 0.184 1.258) 2.327 4.788 ( -5.924 -3.956 4.328) 8.335 5.232 ( 5.542 -4.070 -8.832) 11.193 5.277 ( 4.784 3.060 1.983) 6.015 5.384 ( -7.826 -0.400 -2.547) 8.240 5.406 ( -4.981 6.474 -1.922) 8.391 5.702 ( 1.312 4.735 -8.492) 9.811 6.042 ( 0.149 -7.043 3.514) 7.873 6.217 ( 3.358 -3.341 -3.744) 6.038 6.311 ( -1.551 -3.397 5.714) 6.826 6.437 ( 0.195 0.341 0.842) 0.929 6.620 ( 0.164 -5.175 6.035) 7.951 6.772 ( -3.644 -7.052 1.696) 8.117 6.831 ( -3.575 0.304 3.451) 4.978 7.081 ( 5.383 4.757 -4.683) 8.575 7.309 ( -3.726 1.262 -2.469) 4.645 7.500 ( -2.951 0.026 -9.916) 10.346 7.849 ( 2.726 -6.370 3.474) 7.751 7.864 ( 9.743 -1.784 4.100) 10.719 8.595 ( -2.895 7.515 3.009) 8.597 8.834 ( -0.427 5.060 -5.782) 7.695 8.899 ( 1.359 7.604 -3.992) 8.694 9.070 ( -1.724 6.108 -6.841) 9.331 9.404 ( -1.786 -1.670 2.857) 3.760 9.459 ( 1.866 4.118 -0.051) 4.521 9.935 ( 5.431 -5.814 5.602) 9.731 10.047 ( 1.544 -1.498 2.585) 3.363 10.376 ( -3.537 -0.143 7.441) 8.241 10.608 ( -1.070 8.008 -6.582) 10.421 10.681 ( 2.085 2.878 5.560) 6.598 10.957 ( -2.569 0.591 -2.185) 3.424 11.195 ( 2.647 -2.468 4.757) 5.977 11.346 ( 12.254 -0.658 -5.666) 13.517 11.477 ( -3.250 3.265 8.252) 9.451 11.806 ( -1.969 -0.320 -2.588) 3.267 11.971 ( -2.905 -2.280 1.905) 4.155 12.021 ( 3.567 -1.524 0.731) 3.947 12.130 ( 1.075 0.459 -6.632) 6.735 12.412 ( -6.433 -3.072 -9.960) 12.248 12.528 ( 3.645 -6.284 8.133) 10.905 12.721 ( 7.781 1.205 -0.169) 7.876 13.394 ( -6.874 -1.269 15.976) 17.438 13.858 ( 20.700 -8.042 -5.992) 23.002 14.925 ( -0.328 -1.939 1.043) 2.226 14.984 ( -1.292 -4.829 -1.110) 5.121 15.052 ( 4.007 3.378 -0.193) 5.244 15.168 ( -16.207 3.218 -1.630) 16.604 15.264 ( 5.669 2.570 3.323) 7.056 15.493 ( -0.294 -5.291 -4.672) 7.064 15.713 ( -1.743 -1.878 2.115) 3.322 15.761 ( 0.978 -12.358 -1.359) 12.471 15.975 ( 3.821 0.244 -1.493) 4.110 16.186 ( 3.203 3.571 -3.827) 6.137 16.413 ( 11.266 0.519 4.675) 12.209 16.786 ( -4.329 6.924 0.334) 8.172 16.992 ( -1.143 -6.999 1.013) 7.164 17.350 ( -33.265 -1.812 -3.071) 33.456 17.823 ( -3.330 1.704 -2.089) 4.285 17.950 ( 3.441 3.854 -5.685) 7.682 25.678 ( -0.200 1.127 1.918) 2.234 25.709 ( 0.200 1.699 -0.058) 1.712 25.918 ( 0.531 0.761 0.509) 1.058 25.950 ( -2.666 1.343 -1.009) 3.151 26.101 ( 0.584 -6.013 7.567) 9.682 26.271 ( 2.238 2.014 -2.181) 3.717 26.587 ( -2.383 0.903 -3.337) 4.199 26.637 ( -1.936 3.641 -4.194) 5.881 27.116 ( 5.347 -5.879 8.061) 11.320 27.751 ( -11.002 -2.101 -10.311) 15.225 28.325 ( 0.169 -4.741 0.684) 4.793 28.430 ( 4.433 3.987 -5.343) 8.006 28.539 ( 5.416 4.713 -1.481) 7.331 28.809 ( -18.584 12.967 -8.325) 24.142 28.952 ( 39.084 -3.498 15.272) 42.107 29.639 ( -19.045 -5.076 4.946) 20.321 ======================= Grid point 176 (80/140) ======================= q-point: ( 0.11 0.11 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 7.23e-05 7.23e-05 7.23e-05 7.23e-05 7.23e-05 7.23e-05 7.23e-05 7.23e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 140 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.283 ( -2.654 -0.000 21.610) 21.773 1.404 ( 9.776 0.000 18.019) 20.500 1.488 ( -2.772 -0.000 -8.828) 9.253 1.875 ( -5.855 -0.000 -4.155) 7.180 2.137 ( 7.910 0.000 1.577) 8.065 2.246 ( 12.285 0.000 -19.378) 22.944 2.336 ( -6.021 -0.000 13.326) 14.623 2.728 ( 3.978 0.000 -7.526) 8.513 2.735 ( 12.659 0.000 25.227) 28.225 2.753 ( -5.611 -0.000 -10.659) 12.046 2.860 ( -6.872 -0.000 11.211) 13.150 3.223 ( 2.939 0.000 3.098) 4.270 3.281 ( 2.826 0.000 -2.826) 3.997 3.361 ( -3.119 -0.000 -8.500) 9.054 3.852 ( -2.751 -0.000 -5.581) 6.223 3.888 ( -2.852 -0.000 -5.824) 6.485 3.971 ( 0.323 0.000 10.403) 10.408 4.264 ( -4.546 -0.000 -7.795) 9.024 4.309 ( -7.503 -0.000 -0.262) 7.507 4.352 ( 3.293 0.000 -2.896) 4.385 4.679 ( -0.687 -0.000 1.815) 1.940 4.818 ( 5.415 0.000 7.740) 9.447 4.879 ( 0.435 0.000 7.946) 7.958 5.018 ( -3.972 -0.000 -12.323) 12.947 5.285 ( 0.943 0.000 -2.775) 2.931 5.329 ( 1.245 0.000 -0.582) 1.375 5.494 ( -1.706 -0.000 -6.379) 6.604 5.516 ( 10.610 0.000 1.978) 10.793 6.147 ( 0.587 0.000 1.634) 1.736 6.313 ( 1.047 0.000 -6.706) 6.787 6.358 ( -2.053 -0.000 4.727) 5.154 6.530 ( 6.644 0.000 -2.186) 6.994 6.629 ( -5.803 -0.000 6.281) 8.552 6.761 ( 1.911 0.000 0.432) 1.959 6.828 ( -3.630 -0.000 3.002) 4.710 7.224 ( 2.393 0.000 -8.052) 8.400 7.264 ( -0.931 -0.000 3.136) 3.271 7.302 ( 5.714 0.000 -0.897) 5.783 7.855 ( -12.084 -0.000 0.328) 12.089 7.919 ( -8.336 -0.000 1.019) 8.398 8.640 ( 5.044 0.000 5.260) 7.288 8.659 ( -3.729 -0.000 -6.000) 7.064 8.809 ( 0.956 0.000 3.463) 3.592 8.826 ( -3.385 -0.000 -4.679) 5.775 9.402 ( 0.795 0.000 0.230) 0.827 9.456 ( -5.597 -0.000 -1.145) 5.713 9.913 ( -7.300 -0.000 0.495) 7.317 10.128 ( 0.170 0.000 -0.881) 0.898 10.386 ( -2.045 -0.000 4.142) 4.620 10.635 ( 11.260 0.000 3.709) 11.855 10.824 ( 2.933 0.000 4.862) 5.678 10.865 ( 0.968 0.000 -5.846) 5.926 11.169 ( -5.881 -0.000 -3.578) 6.884 11.517 ( 6.970 0.000 -9.441) 11.735 11.571 ( 0.674 0.000 11.467) 11.486 11.719 ( -1.486 -0.000 -3.967) 4.236 12.026 ( 3.078 0.000 3.722) 4.830 12.078 ( 3.573 0.000 -3.368) 4.910 12.154 ( -4.415 -0.000 -9.698) 10.656 12.246 ( 9.677 0.000 1.115) 9.741 12.582 ( -10.509 -0.000 3.887) 11.205 12.832 ( 2.837 0.000 -3.145) 4.236 13.336 ( -19.544 -0.000 14.594) 24.392 13.813 ( -11.797 -0.000 -2.349) 12.029 14.872 ( -2.092 -0.000 1.139) 2.382 14.978 ( -2.303 -0.000 -0.295) 2.322 15.044 ( 3.477 0.000 1.942) 3.982 15.215 ( 12.432 0.000 -3.668) 12.962 15.401 ( -2.163 -0.000 1.956) 2.916 15.475 ( 3.478 0.000 -7.016) 7.831 15.621 ( -6.154 -0.000 4.263) 7.486 15.878 ( -4.111 -0.000 1.678) 4.441 15.938 ( -4.307 -0.000 1.746) 4.647 16.088 ( 4.619 0.000 -9.767) 10.804 16.472 ( -8.722 -0.000 -1.730) 8.892 16.579 ( -15.572 -0.000 7.300) 17.198 17.107 ( 24.429 0.000 -4.408) 24.823 17.388 ( 10.887 0.000 7.549) 13.248 17.725 ( 0.501 0.000 1.620) 1.696 17.995 ( 5.544 0.000 -3.061) 6.333 25.690 ( -0.180 -0.000 0.486) 0.518 25.712 ( 1.010 0.000 -0.200) 1.030 25.862 ( -2.396 -0.000 1.524) 2.840 25.922 ( 0.090 0.000 0.473) 0.482 26.208 ( -1.607 -0.000 3.160) 3.545 26.322 ( 2.123 0.000 -3.497) 4.091 26.501 ( -0.498 -0.000 3.292) 3.329 26.566 ( 0.932 0.000 -1.302) 1.601 27.364 ( -9.905 -0.000 -7.961) 12.707 27.458 ( 8.483 0.000 9.776) 12.944 28.054 ( -17.710 -0.000 11.795) 21.278 28.355 ( -3.365 -0.000 1.253) 3.590 28.406 ( 2.347 0.000 -1.460) 2.764 28.701 ( 1.374 0.000 0.291) 1.405 29.163 ( -14.799 -0.000 -8.495) 17.064 30.173 ( 37.439 0.000 -10.958) 39.010 ======================= Grid point 177 (81/140) ======================= q-point: ( 0.22 0.11 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 7.23e-05 7.23e-05 7.23e-05 7.23e-05 7.23e-05 7.23e-05 7.23e-05 7.23e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 244 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.428 ( 4.541 -7.923 15.324) 17.839 1.498 ( -3.565 -9.490 -10.900) 14.886 1.679 ( 7.543 -10.450 12.642) 18.053 1.916 ( -3.627 -10.583 -2.666) 11.501 2.266 ( 1.331 -7.999 -7.989) 11.383 2.271 ( 9.056 -4.613 -5.827) 11.715 2.441 ( -5.052 -11.914 6.081) 14.299 2.674 ( 1.636 -6.394 -18.913) 20.031 2.794 ( 1.384 -0.909 6.095) 6.316 2.893 ( -2.846 -2.138 10.986) 11.548 2.989 ( 1.887 -6.129 12.320) 13.889 3.221 ( 0.681 0.468 -7.521) 7.566 3.278 ( -0.588 1.317 -4.615) 4.835 3.392 ( 11.120 -4.707 7.778) 14.364 3.737 ( -5.553 4.028 1.639) 7.053 3.894 ( -1.828 -1.137 -2.758) 3.499 4.036 ( 1.258 -0.938 6.035) 6.236 4.157 ( -4.211 3.444 -2.039) 5.810 4.183 ( -8.064 2.356 -0.487) 8.416 4.439 ( 3.951 -5.739 -5.194) 8.690 4.653 ( 0.410 3.085 -2.272) 3.853 4.807 ( -6.180 -0.015 -6.063) 8.658 4.925 ( -1.308 -0.568 2.735) 3.084 5.018 ( 8.465 0.493 2.504) 8.842 5.260 ( 1.086 2.124 0.630) 2.468 5.368 ( 0.062 -5.186 -1.356) 5.361 5.475 ( -0.494 -0.671 -2.866) 2.984 5.617 ( 9.263 -1.487 0.618) 9.402 6.107 ( 0.397 5.883 1.134) 6.004 6.203 ( -1.079 6.210 -4.935) 8.005 6.389 ( -1.252 -0.406 3.636) 3.867 6.493 ( 1.343 5.193 -3.301) 6.298 6.597 ( -3.464 2.008 2.017) 4.483 6.773 ( 1.213 1.139 1.168) 2.033 6.880 ( 3.240 -3.951 6.918) 8.600 7.128 ( -0.724 6.590 -7.971) 10.367 7.269 ( -3.057 0.776 2.971) 4.333 7.352 ( 6.354 0.206 1.628) 6.563 7.730 ( -10.031 4.209 0.622) 10.896 7.835 ( -9.208 -0.365 -1.076) 9.278 8.675 ( -2.784 -6.665 -3.136) 7.874 8.725 ( -0.696 -6.039 1.232) 6.202 8.860 ( -3.038 -7.439 -2.522) 8.422 8.894 ( 3.915 -4.499 7.480) 9.566 9.402 ( -6.087 0.337 2.031) 6.425 9.411 ( -5.462 -2.279 -0.424) 5.933 9.912 ( -2.725 -4.611 -1.963) 5.704 10.070 ( -0.804 5.758 0.291) 5.821 10.356 ( -1.588 2.507 2.839) 4.107 10.818 ( 9.488 -7.530 -2.726) 12.416 10.850 ( 2.304 -1.220 -3.813) 4.619 10.899 ( 4.644 -3.408 3.031) 6.509 11.081 ( -5.323 2.187 -4.830) 7.513 11.503 ( 5.636 2.069 -7.504) 9.610 11.632 ( 1.476 0.298 8.750) 8.878 11.722 ( -1.980 -4.034 -3.008) 5.408 12.028 ( 2.353 4.239 -2.013) 5.250 12.049 ( -1.862 2.338 -2.858) 4.136 12.129 ( 3.594 -2.781 -2.171) 5.036 12.303 ( 10.299 3.843 3.652) 11.583 12.508 ( -8.988 1.351 4.703) 10.233 12.785 ( 0.297 4.213 -7.249) 8.389 13.240 ( -22.274 -0.855 9.364) 24.177 13.698 ( -9.851 3.182 -1.249) 10.427 14.852 ( -3.361 0.946 4.428) 5.639 14.955 ( -2.616 0.807 0.246) 2.748 15.092 ( 0.929 0.124 -2.083) 2.284 15.235 ( 7.706 4.727 1.000) 9.095 15.348 ( -3.676 0.346 1.299) 3.914 15.496 ( 7.253 0.639 -3.441) 8.053 15.585 ( 1.044 0.831 -3.195) 3.462 15.783 ( 0.128 8.565 3.758) 9.354 15.879 ( -6.632 -0.546 -1.150) 6.753 16.180 ( 1.376 -6.427 -4.339) 7.876 16.395 ( -7.651 -0.106 0.186) 7.654 16.583 ( -8.989 -6.277 5.272) 12.165 17.165 ( 18.571 9.662 -1.730) 21.006 17.505 ( 7.117 -0.952 8.828) 11.379 17.762 ( 4.270 -0.142 -1.345) 4.479 18.031 ( 4.792 -0.999 -3.152) 5.822 25.697 ( -0.052 -0.863 0.510) 1.004 25.733 ( 1.104 -1.532 -0.889) 2.087 25.870 ( -1.962 -1.689 1.858) 3.187 25.935 ( -0.500 -1.073 1.033) 1.571 26.187 ( -1.989 2.141 1.318) 3.205 26.315 ( 0.913 -0.536 -4.863) 4.977 26.530 ( 1.934 -0.498 4.269) 4.713 26.561 ( 1.206 1.055 0.129) 1.607 27.248 ( -7.832 1.132 -6.830) 10.453 27.560 ( 8.668 2.033 12.670) 15.485 28.058 ( -12.632 -5.871 8.760) 16.455 28.311 ( -4.487 0.196 -1.915) 4.882 28.481 ( -0.572 -6.311 -0.632) 6.368 28.662 ( -15.451 -3.612 -4.730) 16.558 29.096 ( 6.101 -0.755 -2.137) 6.508 30.265 ( 28.243 11.947 -10.850) 32.529 ======================= Grid point 178 (82/140) ======================= q-point: ( 0.33 0.11 -0.67) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 7.23e-05 7.23e-05 7.23e-05 7.23e-05 7.23e-05 7.23e-05 7.23e-05 7.23e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 244 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.661 ( 1.733 -14.524 -1.339) 14.688 1.698 ( 5.031 -9.767 10.098) 14.922 1.919 ( 3.724 -6.202 6.911) 10.005 2.094 ( -1.256 -14.278 -5.719) 15.432 2.309 ( -2.567 -9.543 -18.302) 20.800 2.486 ( 6.866 -10.200 -0.777) 12.321 2.652 ( -4.213 -11.669 0.907) 12.440 2.770 ( 5.071 -7.972 -7.000) 11.759 2.818 ( -5.011 -0.281 7.906) 9.364 2.997 ( 1.135 -5.259 3.687) 6.522 3.033 ( -4.451 -0.216 -2.612) 5.165 3.196 ( -2.716 -3.027 2.732) 4.899 3.245 ( -0.708 -0.393 -6.680) 6.729 3.644 ( -0.030 -5.977 1.868) 6.262 3.671 ( 5.034 2.822 8.419) 10.207 3.843 ( -4.407 3.597 10.369) 11.827 3.990 ( -0.320 3.461 -2.421) 4.236 4.175 ( -0.881 -5.313 0.489) 5.407 4.199 ( 3.461 -6.031 2.333) 7.334 4.543 ( 5.580 -4.561 -5.301) 8.946 4.585 ( -1.154 0.070 -7.476) 7.565 4.712 ( -5.922 2.369 -4.241) 7.659 4.909 ( -1.245 2.079 -0.145) 2.427 5.031 ( 5.813 4.852 -3.149) 8.200 5.270 ( 2.390 -0.459 4.613) 5.216 5.448 ( 1.233 1.791 -0.213) 2.185 5.519 ( -2.613 -11.192 1.492) 11.589 5.701 ( 5.843 -1.198 0.785) 6.016 5.975 ( -2.400 7.385 -3.598) 8.558 6.107 ( 4.460 3.975 0.496) 5.995 6.324 ( -5.324 4.544 -1.357) 7.130 6.459 ( 4.530 1.550 -0.169) 4.791 6.539 ( -4.088 2.374 1.728) 5.033 6.769 ( 0.838 0.844 1.872) 2.218 6.928 ( 2.582 6.393 -1.463) 7.048 7.042 ( -0.066 -2.767 2.707) 3.872 7.208 ( -5.419 3.900 4.019) 7.793 7.410 ( 0.674 -1.369 1.952) 2.477 7.600 ( -1.677 3.636 0.776) 4.078 7.790 ( -5.258 -0.364 -2.016) 5.643 8.747 ( -2.627 -4.345 1.207) 5.220 8.859 ( -5.726 -11.641 -0.161) 12.974 8.969 ( -1.925 -8.894 -0.367) 9.108 9.060 ( 2.222 -6.621 5.659) 8.989 9.364 ( -8.647 -3.802 1.864) 9.628 9.409 ( -1.175 0.621 0.403) 1.389 9.934 ( -2.004 6.075 0.370) 6.407 9.989 ( -1.473 -4.299 -1.431) 4.765 10.317 ( -2.133 1.816 0.782) 2.908 10.828 ( 2.102 1.007 -6.159) 6.586 10.960 ( -3.787 -4.732 -13.814) 15.085 11.025 ( 6.345 -4.473 6.138) 9.897 11.087 ( 12.281 -4.339 1.142) 13.075 11.470 ( 2.709 1.819 -4.168) 5.293 11.664 ( 2.050 0.820 2.231) 3.138 11.774 ( -2.313 -4.494 -1.424) 5.251 11.898 ( -2.586 5.666 -3.722) 7.256 12.061 ( 3.257 -0.154 4.272) 5.374 12.186 ( 3.292 -1.761 -3.564) 5.161 12.321 ( 10.796 6.048 5.596) 13.581 12.445 ( -4.039 2.789 2.764) 5.633 12.654 ( -0.938 5.224 -7.226) 8.966 13.109 ( -21.060 0.185 3.124) 21.291 13.523 ( -9.616 7.819 -2.218) 12.591 14.822 ( -3.294 2.811 4.239) 6.060 14.903 ( -4.973 1.251 2.480) 5.696 15.054 ( 4.207 2.162 -4.335) 6.416 15.234 ( -1.879 -0.590 4.165) 4.607 15.345 ( -1.651 0.382 0.631) 1.809 15.532 ( 6.061 -0.158 -2.817) 6.686 15.597 ( 7.238 -0.785 -6.148) 9.529 15.692 ( 2.630 5.639 4.340) 7.586 15.825 ( -5.248 0.187 -1.348) 5.422 16.220 ( -1.925 -0.667 -1.378) 2.460 16.377 ( -6.543 -2.478 2.572) 7.454 16.649 ( -5.923 -5.340 2.999) 8.520 17.128 ( 15.356 9.271 2.910) 18.172 17.591 ( 6.417 2.649 7.182) 9.989 17.757 ( 0.308 0.908 -3.046) 3.194 18.063 ( 3.764 -0.655 -3.373) 5.096 25.726 ( 0.557 -1.972 0.987) 2.275 25.764 ( 0.799 -1.840 -1.196) 2.336 25.897 ( -1.727 -2.119 1.256) 3.009 25.950 ( -1.410 -0.677 1.513) 2.177 26.119 ( -2.156 3.767 -1.892) 4.735 26.311 ( 1.316 -0.893 -4.905) 5.157 26.568 ( 1.050 -0.077 3.677) 3.825 26.583 ( 2.917 -0.796 4.219) 5.191 27.145 ( -5.129 0.660 -7.788) 9.348 27.619 ( 6.847 7.084 13.726) 16.896 28.072 ( -11.189 -3.138 1.079) 11.671 28.270 ( -8.015 -5.163 -4.434) 10.514 28.598 ( -5.762 -8.724 -0.602) 10.472 28.618 ( -6.254 -7.058 -4.742) 10.556 29.213 ( 9.630 -2.809 5.434) 11.408 30.145 ( 20.451 18.329 -8.380) 28.713 ======================= Grid point 179 (83/140) ======================= q-point: ( 0.44 0.11 -0.67) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 7.23e-05 7.23e-05 7.23e-05 7.23e-05 7.23e-05 7.23e-05 7.23e-05 7.23e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 244 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.876 ( 5.258 -0.675 6.939) 8.732 1.944 ( -0.195 -13.433 6.465) 14.909 2.026 ( -0.025 -5.673 0.356) 5.684 2.288 ( 3.353 -9.841 -4.649) 11.388 2.375 ( -5.886 -11.191 -13.054) 18.174 2.641 ( 5.447 -1.972 -6.832) 8.957 2.714 ( -4.617 -3.736 -4.865) 7.678 2.827 ( -4.433 -2.427 5.037) 7.135 2.849 ( 3.866 1.607 -6.280) 7.547 3.031 ( -1.772 -6.542 -0.090) 6.778 3.098 ( 1.740 0.365 7.036) 7.257 3.218 ( -3.425 -3.705 -3.628) 6.215 3.326 ( -3.559 -10.752 5.056) 12.403 3.608 ( -5.278 -0.061 1.540) 5.498 3.619 ( -0.582 8.437 3.163) 9.029 3.894 ( -2.665 1.087 7.964) 8.468 4.013 ( 2.571 -5.311 2.910) 6.579 4.309 ( 5.417 -6.406 3.408) 9.055 4.346 ( 7.200 -4.970 -2.290) 9.043 4.538 ( -0.622 -0.148 -7.183) 7.211 4.581 ( -4.097 4.524 -6.419) 8.857 4.659 ( 5.058 -3.218 -1.223) 6.118 4.853 ( -5.568 1.016 -1.135) 5.773 4.962 ( 5.992 4.156 -4.328) 8.480 5.336 ( 0.620 -1.428 3.288) 3.638 5.394 ( 0.009 1.865 -2.468) 3.094 5.697 ( -2.348 -7.631 2.859) 8.481 5.766 ( 4.288 -1.485 2.090) 4.996 5.850 ( -0.029 2.701 -0.606) 2.769 6.142 ( 7.760 -0.783 0.519) 7.817 6.201 ( -6.337 3.033 -2.053) 7.319 6.461 ( 1.382 1.386 0.295) 1.980 6.465 ( -2.835 2.967 0.974) 4.217 6.776 ( -1.393 -0.958 1.342) 2.158 6.886 ( 4.796 1.262 0.421) 4.977 7.017 ( -4.213 5.405 1.704) 7.061 7.178 ( -3.290 -1.254 8.459) 9.163 7.396 ( -5.443 -0.712 -1.432) 5.673 7.626 ( 7.857 -0.795 0.786) 7.936 7.719 ( -3.517 3.214 -2.580) 5.417 8.784 ( -5.960 -2.482 3.806) 7.494 8.995 ( -3.071 -7.994 2.441) 8.905 9.111 ( -1.322 -8.468 0.068) 8.571 9.151 ( -0.275 -2.363 0.637) 2.463 9.361 ( -0.598 2.621 -2.195) 3.470 9.472 ( -1.795 -10.492 3.869) 11.326 9.814 ( -3.544 4.691 2.448) 6.368 10.062 ( 0.386 -4.566 -2.163) 5.067 10.258 ( -3.830 3.292 1.880) 5.389 10.778 ( -0.149 1.258 -7.252) 7.362 10.953 ( -0.073 -3.583 -9.021) 9.707 11.191 ( 13.881 3.527 -4.924) 15.145 11.211 ( 4.748 -5.906 4.793) 8.967 11.482 ( 2.040 -2.264 2.966) 4.252 11.636 ( 0.042 4.499 -0.440) 4.521 11.793 ( -5.860 -0.620 0.407) 5.907 11.821 ( 0.387 -1.930 -4.162) 4.603 12.120 ( 0.351 -0.795 2.971) 3.095 12.201 ( 3.563 -1.805 -6.683) 7.785 12.323 ( 7.735 6.277 5.856) 11.555 12.407 ( 6.806 2.705 2.646) 7.787 12.557 ( -1.964 2.306 -3.515) 4.640 12.936 ( -16.566 3.197 -1.494) 16.938 13.292 ( -10.208 7.581 -2.044) 12.878 14.773 ( -0.923 1.356 0.077) 1.642 14.887 ( -4.193 -1.483 4.199) 6.116 15.061 ( 1.365 -1.853 -1.845) 2.950 15.205 ( -1.216 4.769 -1.616) 5.180 15.357 ( -1.284 -3.032 5.063) 6.040 15.549 ( 3.159 -0.146 -4.925) 5.853 15.618 ( 5.895 2.667 -2.804) 7.052 15.670 ( 2.567 2.077 1.427) 3.597 15.812 ( -0.249 -1.771 0.091) 1.790 16.183 ( -5.132 1.254 0.681) 5.327 16.381 ( -6.216 -2.067 5.496) 8.551 16.685 ( -2.776 -1.987 0.088) 3.414 17.135 ( 13.188 5.959 4.290) 15.095 17.564 ( 3.579 6.932 0.922) 7.855 17.746 ( -2.706 -1.769 0.760) 3.321 18.078 ( 2.565 -0.233 -3.378) 4.247 25.777 ( 0.737 -2.401 1.508) 2.929 25.790 ( 0.165 -1.316 -0.536) 1.431 25.919 ( -1.516 -1.480 -0.532) 2.185 25.949 ( -1.535 0.151 1.824) 2.389 26.022 ( -1.344 4.111 -3.050) 5.292 26.318 ( 1.870 -0.953 -4.149) 4.649 26.615 ( 0.026 -1.905 5.288) 5.621 26.633 ( 2.752 -0.025 4.474) 5.253 27.067 ( -2.806 0.065 -10.203) 10.582 27.567 ( 1.337 8.267 9.919) 12.982 28.040 ( -6.949 -3.449 -3.496) 8.509 28.335 ( -3.213 -6.842 2.671) 8.017 28.612 ( -3.303 -3.488 -5.537) 7.330 28.782 ( -3.640 -12.548 0.890) 13.096 29.343 ( 5.002 -1.729 5.718) 7.791 29.915 ( 13.523 19.773 -6.283) 24.766 ======================= Grid point 180 (84/140) ======================= q-point: (-0.44 0.11 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 7.23e-05 7.23e-05 7.23e-05 7.23e-05 7.23e-05 7.23e-05 7.23e-05 7.23e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 244 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.864 ( -5.094 4.852 7.752) 10.468 2.041 ( 0.692 0.985 4.870) 5.017 2.225 ( 1.392 -9.539 5.935) 11.321 2.387 ( -3.154 -2.579 -6.952) 8.058 2.426 ( 1.677 -2.770 -8.042) 8.669 2.544 ( -0.933 6.233 -5.943) 8.662 2.760 ( 2.992 -0.274 -3.681) 4.752 2.814 ( -0.100 -6.287 -3.634) 7.263 2.907 ( -1.994 -2.924 2.622) 4.405 3.038 ( 1.110 4.310 -0.990) 4.559 3.122 ( -0.006 -0.474 1.434) 1.511 3.305 ( -3.503 -9.159 0.967) 9.854 3.470 ( 0.171 -1.191 6.278) 6.393 3.528 ( -2.197 -0.928 2.551) 3.492 3.641 ( 3.978 -2.518 0.321) 4.719 3.852 ( -3.903 2.979 5.066) 7.055 4.128 ( -2.184 -6.036 2.757) 6.986 4.351 ( -2.906 6.405 -7.635) 10.381 4.436 ( 1.547 -2.503 -2.925) 4.149 4.494 ( 1.785 1.901 3.478) 4.347 4.515 ( 5.312 -0.711 -0.667) 5.401 4.698 ( 1.539 2.781 1.018) 3.337 4.758 ( -4.724 2.686 -5.095) 7.449 5.003 ( 8.227 -3.331 -3.732) 9.628 5.308 ( -4.005 -1.335 -5.242) 6.731 5.411 ( 1.783 0.244 1.873) 2.597 5.740 ( -2.296 -0.821 -0.720) 2.542 5.807 ( 4.411 -0.038 1.694) 4.725 5.911 ( 2.234 -2.405 5.165) 6.120 6.107 ( -4.935 1.259 -0.411) 5.110 6.232 ( 8.100 -1.476 -1.112) 8.308 6.361 ( -8.823 2.834 0.466) 9.279 6.502 ( 5.699 -0.557 1.197) 5.850 6.791 ( -4.212 -2.277 -0.825) 4.859 6.910 ( -3.365 1.976 0.557) 3.942 6.923 ( 3.516 0.428 3.083) 4.696 7.234 ( -3.110 -3.785 6.311) 7.989 7.377 ( -2.520 -1.556 0.125) 2.964 7.582 ( -0.692 5.494 -5.953) 8.130 7.722 ( 3.716 -1.794 -0.544) 4.163 8.789 ( -6.504 -1.773 6.450) 9.330 9.100 ( 3.651 -3.311 -0.732) 4.983 9.180 ( 0.100 -0.579 -1.207) 1.342 9.211 ( 1.771 -3.971 0.960) 4.453 9.327 ( 0.465 -0.247 0.088) 0.534 9.639 ( -3.991 -7.394 2.287) 8.708 9.775 ( -0.093 -0.077 5.609) 5.610 10.059 ( -2.494 3.745 -4.412) 6.302 10.223 ( -1.541 -1.339 6.589) 6.898 10.733 ( -0.379 -0.401 -6.831) 6.853 10.961 ( 0.316 -0.572 -4.915) 4.958 11.143 ( 10.687 7.419 -5.869) 14.272 11.299 ( -1.900 1.834 1.086) 2.855 11.561 ( 3.527 -0.423 3.354) 4.886 11.583 ( 0.690 0.478 6.183) 6.239 11.752 ( -5.711 -0.654 0.090) 5.749 11.850 ( 1.237 -2.147 -7.234) 7.647 12.106 ( 0.032 1.489 -0.243) 1.509 12.260 ( 1.166 -3.714 -5.042) 6.370 12.303 ( 1.471 2.069 0.421) 2.574 12.415 ( 6.625 6.705 3.275) 9.979 12.504 ( -2.998 0.509 -5.242) 6.060 12.818 ( -2.175 -3.438 1.177) 4.235 13.151 ( -6.639 0.431 1.558) 6.833 14.755 ( -1.155 0.488 -0.059) 1.255 14.924 ( -3.294 -3.409 2.998) 5.610 15.082 ( -0.485 2.015 -3.299) 3.896 15.121 ( 1.061 -0.860 0.100) 1.370 15.427 ( -0.356 -2.186 2.055) 3.022 15.544 ( 2.396 0.487 -1.644) 2.946 15.596 ( 4.127 3.343 -0.787) 5.369 15.655 ( 2.230 2.295 -0.807) 3.300 15.848 ( 1.368 -1.564 -0.857) 2.248 16.130 ( -7.156 -0.703 2.447) 7.595 16.418 ( -5.129 -3.774 7.449) 9.800 16.680 ( 0.259 0.586 -2.050) 2.148 17.142 ( 7.575 5.722 3.035) 9.967 17.467 ( -0.587 4.701 -2.538) 5.375 17.775 ( -1.587 -2.593 2.256) 3.786 18.077 ( 1.706 0.298 -3.680) 4.067 25.791 ( -1.633 0.161 1.620) 2.306 25.834 ( 1.249 -1.528 0.570) 2.054 25.910 ( -1.558 0.176 -0.281) 1.593 25.929 ( -1.054 2.514 -1.246) 2.998 25.972 ( 0.472 -0.689 0.400) 0.926 26.326 ( 1.911 -0.552 -4.031) 4.495 26.645 ( -1.392 -1.117 -0.100) 1.787 26.702 ( 3.035 -1.237 9.413) 9.967 26.988 ( -1.899 1.128 -11.097) 11.314 27.511 ( -2.089 1.727 4.998) 5.685 28.056 ( 1.096 -2.051 0.601) 2.402 28.442 ( -0.356 -4.868 5.359) 7.249 28.615 ( -0.036 -1.586 -5.798) 6.011 28.962 ( -4.152 -11.484 1.029) 12.255 29.373 ( 0.951 4.236 1.595) 4.625 29.666 ( 5.876 14.520 -3.713) 16.098 ======================= Grid point 181 (85/140) ======================= q-point: (-0.33 0.11 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 7.23e-05 7.23e-05 7.23e-05 7.23e-05 7.23e-05 7.23e-05 7.23e-05 7.23e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 244 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.746 ( -10.444 7.501 11.937) 17.545 2.004 ( 0.118 8.435 10.746) 13.662 2.222 ( -5.634 8.160 -7.993) 12.736 2.369 ( 1.397 2.488 -4.957) 5.719 2.405 ( 3.013 -0.556 2.917) 4.230 2.470 ( 3.245 4.716 1.394) 5.891 2.728 ( 1.199 3.696 -0.675) 3.944 2.863 ( 0.383 3.348 -5.694) 6.617 2.946 ( 3.157 -2.588 0.572) 4.122 3.024 ( -0.019 -4.552 0.243) 4.559 3.144 ( 0.150 -1.468 -0.026) 1.475 3.425 ( 1.701 1.904 2.815) 3.800 3.451 ( 0.456 -2.174 2.408) 3.276 3.553 ( -2.178 0.729 1.710) 2.863 3.727 ( 2.363 -2.519 -0.900) 3.569 3.808 ( -3.277 0.986 3.659) 5.010 4.171 ( -5.055 6.432 -4.719) 9.444 4.232 ( -3.416 -7.719 2.148) 8.710 4.371 ( -5.724 4.080 -0.124) 7.030 4.487 ( 3.283 1.566 -2.563) 4.450 4.606 ( 7.926 0.528 4.658) 9.209 4.638 ( -3.533 1.595 -2.093) 4.406 4.663 ( 3.180 4.600 -2.613) 6.172 5.099 ( 6.500 -2.007 -1.875) 7.057 5.298 ( -4.072 -3.975 -6.657) 8.758 5.419 ( 2.633 1.175 -0.111) 2.885 5.719 ( -1.374 -0.043 -0.718) 1.550 5.828 ( 0.890 2.948 1.183) 3.299 5.949 ( 3.242 2.163 2.297) 4.524 6.067 ( -3.830 -0.055 -0.427) 3.854 6.239 ( -5.695 1.668 0.903) 6.002 6.331 ( 6.787 -1.776 -1.004) 7.087 6.554 ( 3.415 -0.355 1.964) 3.955 6.725 ( -6.289 3.433 0.243) 7.169 6.941 ( 0.907 1.155 1.887) 2.391 6.962 ( -1.384 -7.958 -1.769) 8.269 7.287 ( -3.697 -3.247 -1.373) 5.109 7.416 ( -1.734 -2.042 0.376) 2.705 7.501 ( 2.447 -1.246 0.061) 2.747 7.746 ( 0.542 -0.739 -4.506) 4.598 8.824 ( -3.353 -2.417 7.730) 8.766 9.143 ( 5.476 0.931 -2.919) 6.275 9.176 ( 2.650 0.362 -2.967) 3.995 9.273 ( 1.061 0.838 -0.250) 1.375 9.358 ( 2.516 -1.347 2.143) 3.569 9.701 ( -5.070 -3.854 6.284) 8.947 9.760 ( 2.036 7.732 -0.337) 8.002 9.976 ( -2.369 0.517 4.035) 4.708 10.294 ( -1.800 -3.436 6.550) 7.613 10.718 ( 1.785 -0.523 -4.709) 5.063 10.920 ( -1.660 2.541 -1.781) 3.519 11.082 ( 6.360 5.986 -2.201) 9.007 11.192 ( -1.170 5.545 -0.697) 5.710 11.543 ( -1.380 3.548 -1.459) 4.077 11.640 ( 1.467 -0.179 0.541) 1.573 11.733 ( -3.915 -2.056 -0.622) 4.466 11.874 ( 3.836 -0.785 2.899) 4.872 12.044 ( -1.642 5.566 2.561) 6.343 12.225 ( -8.551 1.098 -4.353) 9.657 12.286 ( 0.771 -0.932 -5.930) 6.052 12.360 ( 2.346 1.825 -8.024) 8.556 12.503 ( 0.303 -6.408 -1.836) 6.673 13.034 ( 9.185 -12.129 6.494) 16.542 13.187 ( -0.109 -5.600 5.436) 7.805 14.733 ( -1.638 0.659 1.067) 2.063 14.917 ( -3.219 2.189 2.001) 4.377 15.085 ( 2.350 -3.376 -1.111) 4.260 15.184 ( -1.193 -5.659 -2.725) 6.393 15.417 ( -1.077 2.225 -0.550) 2.533 15.537 ( 5.028 6.257 0.207) 8.030 15.570 ( -0.640 0.489 1.646) 1.832 15.635 ( 2.039 0.169 -2.368) 3.129 15.888 ( 5.054 -1.640 -1.022) 5.411 16.131 ( -7.936 -4.147 3.239) 9.522 16.485 ( -4.306 -3.638 6.709) 8.763 16.661 ( 0.684 0.338 -2.085) 2.220 17.087 ( 2.135 6.256 1.837) 6.861 17.385 ( -3.857 1.241 -3.718) 5.499 17.821 ( -0.169 -2.420 0.907) 2.590 18.059 ( 1.547 0.848 -4.469) 4.805 25.774 ( -1.832 1.398 2.094) 3.113 25.830 ( -0.520 1.856 -0.435) 1.976 25.887 ( -0.228 1.161 1.963) 2.291 25.924 ( 0.543 -1.388 1.843) 2.370 25.999 ( 0.479 -1.422 -0.556) 1.601 26.324 ( 1.631 0.040 -4.353) 4.648 26.641 ( -2.016 -0.559 -1.714) 2.705 26.791 ( 2.877 -1.055 4.409) 5.369 26.905 ( -1.269 1.198 -4.270) 4.613 27.520 ( -4.842 -4.206 -0.817) 6.465 28.130 ( 6.532 -1.225 5.320) 8.513 28.552 ( 5.250 -3.302 6.536) 9.011 28.605 ( 2.831 0.793 -5.452) 6.194 29.068 ( -1.374 -0.128 -1.514) 2.049 29.252 ( -4.077 4.245 -0.238) 5.890 29.503 ( -3.850 5.415 -2.476) 7.090 ======================= Grid point 182 (86/140) ======================= q-point: (-0.22 0.11 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 7.23e-05 7.23e-05 7.23e-05 7.23e-05 7.23e-05 7.23e-05 7.23e-05 7.23e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 244 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.572 ( -14.643 9.655 16.252) 23.911 1.836 ( -2.045 17.493 9.326) 19.929 2.020 ( 0.783 9.453 1.458) 9.596 2.262 ( 1.061 6.477 -3.268) 7.332 2.347 ( 4.596 11.898 4.206) 13.430 2.461 ( 7.287 5.074 -0.625) 8.902 2.634 ( -3.147 7.381 0.320) 8.030 2.820 ( 4.269 1.277 2.079) 4.917 2.990 ( 2.296 0.532 1.816) 2.975 3.073 ( 0.424 0.173 -4.645) 4.667 3.144 ( -0.843 3.354 1.055) 3.616 3.320 ( 2.459 7.673 1.420) 8.181 3.479 ( -0.550 3.805 -3.806) 5.409 3.530 ( -6.234 4.595 2.879) 8.262 3.705 ( -2.101 -3.006 5.151) 6.323 3.845 ( 1.775 -4.737 -5.055) 7.151 4.046 ( -4.250 2.587 1.301) 5.142 4.181 ( -9.355 5.313 -3.829) 11.419 4.406 ( 0.906 -7.380 1.654) 7.617 4.468 ( 3.520 1.439 -3.719) 5.319 4.569 ( 0.194 1.253 -7.542) 7.648 4.633 ( 3.441 2.681 6.493) 7.822 4.712 ( 6.280 -2.403 4.969) 8.361 5.145 ( 4.242 -0.190 -3.849) 5.731 5.301 ( -4.791 -3.865 -5.619) 8.334 5.398 ( 3.391 3.374 -2.047) 5.203 5.709 ( -5.050 8.412 -0.109) 9.812 5.755 ( 1.048 -4.122 1.778) 4.610 5.915 ( 2.426 4.585 -2.207) 5.637 6.050 ( -1.999 -3.123 -3.814) 5.319 6.235 ( -1.254 -2.431 4.278) 5.078 6.394 ( 4.299 -0.541 -0.894) 4.424 6.602 ( 1.230 -2.138 2.807) 3.737 6.632 ( -1.095 4.086 3.392) 5.422 6.905 ( -4.310 2.487 1.701) 5.259 7.057 ( -1.618 -6.094 -6.833) 9.298 7.284 ( -2.353 -1.669 -3.500) 4.536 7.416 ( -2.469 -3.121 -4.249) 5.821 7.652 ( 5.344 -7.624 4.120) 10.182 7.739 ( -1.847 -2.171 -2.537) 3.816 8.844 ( -0.067 3.542 4.647) 5.844 9.118 ( 3.805 6.642 -0.215) 7.657 9.156 ( -2.777 5.799 -7.147) 9.614 9.213 ( 3.536 0.338 2.395) 4.284 9.421 ( 3.446 -0.645 0.104) 3.507 9.546 ( -4.546 7.109 -4.866) 9.740 9.855 ( 4.040 -4.551 10.609) 12.231 9.972 ( -2.980 1.880 7.747) 8.511 10.349 ( -6.101 -2.540 6.511) 9.277 10.723 ( 6.741 2.158 -3.331) 7.823 10.851 ( -0.754 3.168 -1.640) 3.646 11.001 ( -6.273 2.790 4.004) 7.948 11.168 ( 13.041 2.362 -3.772) 13.779 11.433 ( -1.359 5.392 -3.644) 6.648 11.600 ( -1.731 2.794 0.165) 3.291 11.762 ( -0.837 -2.103 -0.732) 2.379 11.918 ( 1.764 -1.408 1.099) 2.510 11.982 ( -3.899 2.290 4.988) 6.732 12.135 ( -2.979 0.423 -1.766) 3.489 12.273 ( -3.564 -3.639 -11.020) 12.140 12.366 ( 3.375 -2.666 -1.756) 4.645 12.623 ( 2.230 -7.075 -3.741) 8.309 13.268 ( -0.967 -6.572 10.104) 12.091 13.437 ( 11.412 -14.717 2.650) 18.811 14.746 ( -1.366 -3.258 2.982) 4.623 14.875 ( -2.838 0.534 1.823) 3.415 15.158 ( 4.614 -1.559 -0.989) 4.970 15.220 ( -7.348 -2.052 -1.999) 7.887 15.362 ( 0.146 1.481 -2.597) 2.993 15.471 ( 3.035 5.484 1.646) 6.480 15.550 ( 0.217 0.512 -1.889) 1.969 15.645 ( -0.201 -1.300 -1.982) 2.379 15.981 ( 9.743 -1.729 0.591) 9.913 16.157 ( -6.896 -4.125 2.865) 8.531 16.508 ( 1.420 1.941 2.367) 3.374 16.682 ( -7.359 -5.741 1.389) 9.436 17.003 ( -0.443 5.294 2.865) 6.036 17.319 ( -5.623 0.201 -4.580) 7.255 17.848 ( -0.116 -0.636 -1.154) 1.323 18.031 ( 2.402 1.314 -5.685) 6.310 25.739 ( -1.253 2.163 1.592) 2.964 25.786 ( -0.115 2.493 -0.535) 2.552 25.906 ( -0.712 -1.051 5.090) 5.246 25.963 ( 0.803 -0.802 3.723) 3.892 26.014 ( 0.335 -0.656 -0.871) 1.141 26.310 ( 1.696 0.530 -4.201) 4.561 26.616 ( -2.255 0.295 -2.754) 3.571 26.745 ( -1.679 2.648 -10.293) 10.760 26.969 ( 3.755 -2.881 12.258) 13.140 27.551 ( -8.099 -6.661 -5.286) 11.743 28.225 ( 2.829 -1.448 5.793) 6.607 28.571 ( 6.132 3.019 -8.018) 10.536 28.745 ( 16.104 -3.462 11.196) 19.916 28.924 ( 6.070 10.944 -0.921) 12.549 29.172 ( -11.254 4.576 -4.790) 13.059 29.404 ( -11.728 -4.062 -0.726) 12.433 ======================= Grid point 183 (87/140) ======================= q-point: (-0.11 0.11 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 7.23e-05 7.23e-05 7.23e-05 7.23e-05 7.23e-05 7.23e-05 7.23e-05 7.23e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 244 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.361 ( -15.922 11.259 19.597) 27.647 1.557 ( 2.107 18.934 11.554) 22.281 1.899 ( 2.508 10.737 5.538) 12.339 2.147 ( -0.781 6.990 0.951) 7.098 2.198 ( 7.608 12.587 4.380) 15.346 2.382 ( 12.525 11.663 -2.310) 17.269 2.451 ( -2.796 9.735 -0.895) 10.168 2.836 ( 3.742 9.435 11.601) 15.414 2.920 ( -1.285 7.790 5.199) 9.453 2.960 ( -0.513 10.647 -6.329) 12.397 3.080 ( -2.067 -0.053 0.811) 2.221 3.209 ( -6.111 7.301 2.376) 9.813 3.358 ( -0.087 3.309 -6.394) 7.200 3.429 ( -0.784 -1.323 -7.945) 8.093 3.819 ( -2.888 -4.986 4.683) 7.425 3.892 ( -0.611 -0.664 -4.072) 4.171 3.996 ( -3.894 2.501 4.177) 6.234 4.091 ( -0.963 -7.228 -4.877) 8.772 4.419 ( 1.309 2.596 -8.193) 8.694 4.498 ( -1.890 1.199 -0.870) 2.401 4.565 ( 6.307 -3.570 -0.099) 7.249 4.659 ( -0.058 -0.788 3.825) 3.906 4.823 ( 6.113 0.246 8.213) 10.241 5.160 ( 3.537 -2.759 -7.639) 8.859 5.268 ( -9.883 -1.359 -4.610) 10.989 5.380 ( 6.981 1.871 -1.939) 7.483 5.512 ( -3.584 9.748 1.498) 10.493 5.757 ( -1.323 5.475 -7.140) 9.094 5.935 ( 2.008 -6.913 2.825) 7.733 6.114 ( 0.609 -7.049 -3.493) 7.891 6.305 ( 1.678 -2.487 3.833) 4.868 6.424 ( 0.440 -2.089 -0.717) 2.252 6.625 ( 2.951 0.495 7.483) 8.059 6.675 ( 1.265 -3.087 2.582) 4.219 6.822 ( -8.026 1.696 1.711) 8.380 7.090 ( 3.096 -2.941 -8.435) 9.454 7.281 ( -1.966 -0.895 -1.691) 2.744 7.412 ( -3.969 -1.976 -6.913) 8.212 7.776 ( -2.122 -4.626 2.616) 5.722 7.834 ( 2.296 -7.290 1.895) 7.874 8.751 ( 0.946 9.342 3.892) 10.164 8.943 ( -1.310 10.064 -6.533) 12.070 9.011 ( 0.197 8.312 -0.738) 8.347 9.173 ( -1.167 8.629 -6.768) 11.028 9.378 ( -3.219 -0.677 4.966) 5.956 9.530 ( 4.058 -0.054 -2.027) 4.537 9.940 ( 1.204 -0.124 7.985) 8.076 10.007 ( -4.189 -3.628 6.277) 8.373 10.351 ( -8.583 -1.130 7.301) 11.325 10.708 ( 9.348 4.672 -5.943) 12.022 10.791 ( 3.374 4.838 2.207) 6.297 10.944 ( -4.019 0.960 -0.691) 4.190 11.219 ( 4.095 0.784 0.660) 4.221 11.380 ( 8.034 -0.726 -6.724) 10.501 11.551 ( -1.314 3.222 6.614) 7.474 11.782 ( 2.116 -1.287 -3.758) 4.501 11.924 ( -5.938 0.304 3.411) 6.854 12.001 ( 2.378 -4.197 1.903) 5.186 12.131 ( 3.459 0.144 -3.081) 4.634 12.247 ( -4.981 -3.888 -11.533) 13.150 12.470 ( 0.265 -5.948 5.864) 8.357 12.724 ( 3.733 -4.830 -4.847) 7.794 13.382 ( -6.206 -3.286 12.825) 14.622 13.755 ( 7.251 -12.749 -3.847) 15.163 14.863 ( -0.769 -8.684 4.872) 9.987 14.874 ( -2.853 -2.006 1.665) 3.865 15.112 ( -10.897 3.752 -0.272) 11.528 15.168 ( 5.174 4.747 -0.065) 7.022 15.366 ( 2.802 -0.963 -4.425) 5.325 15.412 ( 2.659 2.582 -1.675) 4.068 15.592 ( 0.718 -6.523 -0.274) 6.568 15.656 ( -2.468 -2.178 -2.046) 3.875 16.028 ( -1.370 1.677 2.623) 3.401 16.214 ( 5.277 -1.924 -2.886) 6.315 16.530 ( 10.139 0.271 4.688) 11.174 16.691 ( -15.012 -3.880 -0.289) 15.508 16.941 ( -8.539 1.344 6.876) 11.045 17.249 ( 2.005 2.610 -4.809) 5.827 17.826 ( -1.419 1.631 -1.663) 2.728 18.000 ( 4.364 1.973 -6.050) 7.716 25.707 ( -0.621 1.636 1.598) 2.369 25.745 ( 0.693 2.242 -0.290) 2.364 25.927 ( -1.519 0.161 2.312) 2.771 25.963 ( -1.162 1.901 0.543) 2.293 26.069 ( 1.324 -3.624 6.770) 7.792 26.298 ( 2.643 0.596 -2.984) 4.030 26.571 ( -2.318 1.184 -3.100) 4.048 26.637 ( -2.188 2.241 -8.267) 8.840 27.129 ( 5.604 -4.230 12.838) 14.632 27.547 ( -10.585 -4.951 -7.731) 14.011 28.263 ( -4.612 -1.385 3.670) 6.055 28.510 ( 4.040 4.915 -8.655) 10.742 28.713 ( 4.492 10.035 2.956) 11.385 28.857 ( -15.105 14.469 -4.552) 21.406 29.204 ( 33.076 -11.596 7.929) 35.936 29.408 ( -11.714 -6.984 -1.769) 13.752 ======================= Grid point 186 (88/140) ======================= q-point: ( 0.22 0.22 -0.67) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 7.23e-05 7.23e-05 7.23e-05 7.23e-05 7.23e-05 7.23e-05 7.23e-05 7.23e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 140 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.209 ( -4.876 -0.000 -13.862) 14.695 1.541 ( -3.100 -0.000 -4.334) 5.329 1.647 ( 14.493 0.000 12.207) 18.948 1.829 ( 1.275 0.000 -1.091) 1.678 2.142 ( 0.322 0.000 -14.098) 14.102 2.260 ( -8.832 -0.000 15.814) 18.113 2.329 ( 6.144 0.000 -3.667) 7.156 2.558 ( 5.052 0.000 -14.734) 15.576 2.867 ( 6.846 0.000 5.581) 8.832 2.929 ( 2.290 0.000 9.866) 10.128 2.974 ( -5.966 -0.000 4.677) 7.581 3.218 ( -4.675 -0.000 -6.885) 8.322 3.219 ( 1.511 0.000 -1.196) 1.927 3.507 ( 15.954 0.000 6.035) 17.057 3.772 ( -5.238 -0.000 -4.679) 7.024 3.799 ( -1.577 -0.000 5.942) 6.148 4.072 ( 1.017 0.000 6.701) 6.777 4.120 ( -6.678 -0.000 -2.728) 7.214 4.179 ( -7.315 -0.000 0.190) 7.317 4.370 ( 1.010 0.000 -2.541) 2.734 4.688 ( -3.577 -0.000 -16.026) 16.421 4.696 ( 0.390 0.000 0.812) 0.900 4.935 ( -2.704 -0.000 7.381) 7.861 5.102 ( 7.541 0.000 -0.680) 7.572 5.262 ( -2.203 -0.000 -7.418) 7.739 5.318 ( 2.941 0.000 7.247) 7.821 5.501 ( 1.998 0.000 2.513) 3.210 5.684 ( 10.841 0.000 -0.662) 10.861 6.177 ( 1.308 0.000 0.084) 1.311 6.192 ( -6.377 -0.000 -5.815) 8.631 6.400 ( 1.415 0.000 4.817) 5.021 6.573 ( 3.941 0.000 -4.774) 6.190 6.603 ( -5.316 -0.000 7.274) 9.010 6.799 ( 0.278 0.000 -0.894) 0.936 6.842 ( 2.333 0.000 1.897) 3.007 7.171 ( 1.631 0.000 -2.221) 2.756 7.275 ( -3.987 -0.000 6.122) 7.305 7.445 ( 8.792 0.000 -0.674) 8.818 7.592 ( -18.402 -0.000 -3.502) 18.732 7.787 ( -7.060 -0.000 -0.834) 7.109 8.517 ( -6.798 -0.000 -5.159) 8.534 8.730 ( 1.842 0.000 4.951) 5.282 8.779 ( -0.590 -0.000 1.555) 1.664 8.951 ( 6.896 0.000 9.255) 11.542 9.262 ( -16.045 -0.000 0.479) 16.052 9.441 ( 3.202 0.000 0.198) 3.208 9.818 ( -4.153 -0.000 -4.530) 6.145 10.116 ( 0.603 0.000 -2.079) 2.165 10.377 ( -3.000 -0.000 -0.013) 3.000 10.742 ( 0.099 0.000 -8.985) 8.985 10.853 ( 5.860 0.000 -6.473) 8.731 10.907 ( 2.543 0.000 3.595) 4.403 11.090 ( 1.812 0.000 3.873) 4.276 11.526 ( 5.920 0.000 -8.623) 10.459 11.645 ( -2.827 -0.000 -3.080) 4.180 11.705 ( 2.312 0.000 10.079) 10.341 12.016 ( -2.588 -0.000 -7.106) 7.563 12.087 ( 0.577 0.000 -0.786) 0.975 12.119 ( 4.981 0.000 -0.091) 4.982 12.448 ( 10.947 0.000 6.186) 12.574 12.462 ( -8.859 -0.000 3.493) 9.523 12.769 ( -3.011 -0.000 -9.468) 9.935 13.085 ( -25.195 -0.000 7.356) 26.247 13.657 ( -7.181 -0.000 0.082) 7.182 14.867 ( -0.996 -0.000 2.036) 2.266 14.921 ( -3.763 -0.000 -0.223) 3.770 15.109 ( 2.100 0.000 1.124) 2.382 15.268 ( -9.419 -0.000 3.751) 10.138 15.397 ( 8.606 0.000 -4.171) 9.564 15.531 ( 9.430 0.000 -3.199) 9.958 15.615 ( 1.474 0.000 0.102) 1.478 15.785 ( -6.713 -0.000 -2.711) 7.239 15.922 ( -1.274 -0.000 3.729) 3.940 16.087 ( 2.944 0.000 -1.872) 3.489 16.366 ( -3.185 -0.000 -1.258) 3.424 16.481 ( -6.526 -0.000 5.730) 8.684 17.392 ( 19.150 0.000 -5.981) 20.062 17.539 ( -0.975 -0.000 9.669) 9.718 17.838 ( 7.643 0.000 4.555) 8.897 18.040 ( 3.654 0.000 -2.506) 4.431 25.689 ( -0.019 -0.000 0.056) 0.059 25.723 ( 1.345 0.000 -1.165) 1.779 25.852 ( -1.625 -0.000 2.115) 2.667 25.926 ( -0.768 -0.000 1.207) 1.430 26.189 ( -2.379 -0.000 -1.002) 2.581 26.289 ( -0.080 -0.000 -4.015) 4.016 26.561 ( 2.178 0.000 3.778) 4.361 26.589 ( 1.615 0.000 1.553) 2.241 27.170 ( -6.362 -0.000 -6.027) 8.763 27.693 ( 7.903 0.000 10.164) 12.875 27.972 ( -10.151 -0.000 14.316) 17.550 28.319 ( -2.914 -0.000 1.533) 3.293 28.397 ( -13.892 -0.000 -12.045) 18.387 28.436 ( -6.708 -0.000 -3.467) 7.551 29.170 ( 11.919 0.000 4.786) 12.844 30.502 ( 22.931 0.000 -14.713) 27.245 ======================= Grid point 187 (89/140) ======================= q-point: ( 0.33 0.22 -0.67) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 7.23e-05 7.23e-05 7.23e-05 7.23e-05 7.23e-05 7.23e-05 7.23e-05 7.23e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 244 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.273 ( -3.715 -17.702 -10.280) 20.805 1.665 ( 1.815 -17.804 -3.346) 18.207 1.816 ( 4.692 -5.134 -4.918) 8.518 1.881 ( 5.865 -6.234 -3.425) 9.220 2.121 ( 0.851 -0.635 1.424) 1.776 2.360 ( -5.953 -11.932 -2.048) 13.491 2.426 ( 4.978 -5.571 3.966) 8.458 2.613 ( 1.524 -9.095 -4.811) 10.401 2.876 ( -6.192 2.711 3.404) 7.568 2.970 ( 6.733 -0.128 -3.038) 7.388 3.010 ( 2.185 -1.607 6.241) 6.806 3.159 ( -2.975 -0.470 -1.352) 3.301 3.211 ( -2.621 0.823 -0.892) 2.888 3.602 ( -0.519 0.691 1.375) 1.624 3.765 ( 7.552 -2.412 -0.963) 7.986 3.884 ( 0.281 -3.235 9.054) 9.618 4.019 ( -3.241 2.862 -1.706) 4.649 4.075 ( -6.288 1.484 2.230) 6.835 4.174 ( 1.351 -4.199 5.855) 7.331 4.411 ( -3.493 -5.454 -3.539) 7.381 4.579 ( 3.594 2.193 -14.183) 14.795 4.700 ( 0.111 0.280 -1.749) 1.775 4.938 ( -3.332 1.328 4.172) 5.502 5.115 ( 3.836 2.041 -4.667) 6.377 5.242 ( -1.724 -3.269 -3.950) 5.409 5.416 ( 3.077 -2.984 9.766) 10.665 5.503 ( 0.698 2.239 2.703) 3.578 5.765 ( 10.628 0.420 -0.512) 10.649 6.057 ( -4.535 6.294 -1.985) 8.008 6.177 ( 1.328 1.026 -0.932) 1.920 6.372 ( -3.580 6.629 -0.184) 7.536 6.520 ( 4.474 2.377 1.509) 5.286 6.596 ( 0.519 3.036 0.391) 3.105 6.794 ( -0.782 0.568 0.762) 1.230 6.952 ( 0.060 -7.626 2.188) 7.934 7.073 ( 1.292 9.652 -1.966) 9.935 7.250 ( -5.661 2.554 6.261) 8.819 7.385 ( -6.977 0.672 2.063) 7.307 7.633 ( -2.990 -8.239 -3.034) 9.275 7.690 ( -1.915 4.262 -1.849) 5.025 8.547 ( -6.176 -10.754 -3.704) 12.943 8.783 ( 2.081 -1.119 7.508) 7.871 8.831 ( -1.279 -4.784 2.924) 5.751 9.057 ( 3.375 -1.954 8.607) 9.449 9.194 ( -12.402 -5.143 1.562) 13.517 9.441 ( 0.930 1.937 0.827) 2.303 9.834 ( -2.163 -7.435 -6.141) 9.883 10.057 ( 0.255 6.190 -1.745) 6.437 10.318 ( -3.498 1.729 -3.302) 5.112 10.726 ( -5.041 -6.360 -17.137) 18.961 10.865 ( 6.013 0.436 -4.610) 7.589 11.000 ( 4.746 -5.555 2.153) 7.617 11.155 ( 7.763 -0.315 9.460) 12.242 11.510 ( 5.030 2.076 -7.714) 9.440 11.644 ( -2.131 -3.018 -2.012) 4.207 11.756 ( 1.752 1.102 6.573) 6.892 11.938 ( -2.012 3.390 -4.621) 6.074 12.091 ( 0.755 -0.191 3.368) 3.456 12.165 ( 3.561 -1.615 -3.517) 5.259 12.422 ( -6.550 -0.759 1.730) 6.818 12.523 ( 7.993 3.147 4.805) 9.842 12.665 ( -1.900 3.096 -9.842) 10.491 12.933 ( -23.066 -0.853 4.426) 23.502 13.564 ( -6.383 5.257 -1.175) 8.352 14.845 ( -2.940 1.229 3.994) 5.109 14.915 ( -2.613 0.478 0.071) 2.657 15.066 ( -1.256 3.284 -0.904) 3.630 15.256 ( -5.110 -2.668 3.705) 6.852 15.379 ( 5.104 5.874 -0.856) 7.828 15.574 ( 3.607 2.165 -3.278) 5.333 15.610 ( 6.431 -0.674 -3.893) 7.548 15.766 ( -2.654 -2.643 -1.587) 4.068 15.853 ( 3.195 7.161 2.740) 8.306 16.165 ( -1.289 -4.025 0.952) 4.332 16.328 ( -2.556 0.383 1.500) 2.988 16.530 ( -4.133 -5.970 3.864) 8.226 17.404 ( 14.146 8.364 0.084) 16.434 17.634 ( 2.082 -3.620 5.242) 6.703 17.854 ( 2.721 6.094 4.955) 8.312 18.061 ( 2.758 -0.732 -2.859) 4.039 25.704 ( 0.487 -1.520 0.461) 1.661 25.739 ( 1.316 -1.210 -1.411) 2.278 25.860 ( -1.709 -1.298 1.563) 2.655 25.932 ( -1.557 -0.864 1.348) 2.233 26.140 ( -2.422 2.259 -3.051) 4.503 26.279 ( 0.323 -0.822 -3.562) 3.670 26.583 ( 0.947 0.327 2.369) 2.572 26.625 ( 2.256 -0.926 4.022) 4.703 27.086 ( -4.665 1.246 -6.297) 7.935 27.811 ( 6.045 -1.743 10.467) 12.213 27.956 ( -12.800 3.359 2.007) 13.385 28.135 ( -7.886 -0.643 -2.964) 8.449 28.410 ( -5.307 -7.867 -2.207) 9.743 28.471 ( -0.239 -4.859 -0.984) 4.963 29.302 ( 9.984 -0.412 9.774) 13.977 30.491 ( 17.869 11.017 -14.240) 25.366 ======================= Grid point 188 (90/140) ======================= q-point: ( 0.44 0.22 -0.67) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 7.23e-05 7.23e-05 7.23e-05 7.23e-05 7.23e-05 7.23e-05 7.23e-05 7.23e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 244 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.599 ( -2.194 -24.374 0.178) 24.473 1.881 ( 0.451 -8.998 -11.295) 14.448 1.969 ( 3.247 -7.750 -4.311) 9.444 2.070 ( 8.596 -11.868 1.333) 14.714 2.159 ( -0.431 -3.461 1.146) 3.671 2.503 ( -6.551 -10.630 -3.937) 13.093 2.567 ( 2.803 -8.048 -4.227) 9.512 2.783 ( -7.321 -1.378 -1.392) 7.578 2.818 ( 0.595 -9.440 1.733) 9.616 2.974 ( 5.794 3.841 -2.379) 7.347 3.097 ( 0.686 -5.703 1.924) 6.057 3.131 ( -2.903 -1.112 -5.773) 6.557 3.224 ( -1.437 -1.611 12.211) 12.400 3.554 ( -7.619 0.398 0.926) 7.685 3.768 ( 0.210 6.168 2.973) 6.850 3.954 ( 0.325 -1.650 6.333) 6.552 3.987 ( -1.547 2.681 6.697) 7.378 4.160 ( 4.929 -12.115 -5.804) 14.309 4.316 ( 4.140 -7.008 2.605) 8.547 4.418 ( -6.348 -3.168 -6.802) 9.829 4.553 ( 5.409 -0.667 -11.014) 12.289 4.695 ( 4.081 0.018 -2.641) 4.861 4.866 ( -3.019 4.984 1.467) 6.008 5.055 ( 2.016 4.416 -4.735) 6.781 5.310 ( -1.184 -5.856 0.890) 6.041 5.420 ( -3.034 4.640 1.631) 5.779 5.571 ( -0.115 -5.582 5.947) 8.157 5.835 ( 9.996 0.464 1.385) 10.103 5.924 ( -0.177 5.913 0.651) 5.951 6.186 ( 0.080 0.084 -0.726) 0.735 6.225 ( 1.537 5.382 -1.072) 5.699 6.483 ( -4.019 4.942 1.717) 6.597 6.551 ( 4.587 2.940 -1.733) 5.717 6.764 ( -3.414 1.154 0.371) 3.623 6.963 ( 4.466 2.810 1.656) 5.530 7.088 ( -0.765 -0.406 5.789) 5.853 7.168 ( -6.460 1.632 6.442) 9.268 7.320 ( -8.235 0.604 -0.839) 8.300 7.657 ( -0.878 -1.791 -2.099) 2.895 7.687 ( 1.281 -0.740 -3.382) 3.692 8.673 ( -5.457 -8.871 -0.378) 10.422 8.887 ( 2.934 -4.791 9.539) 11.070 8.940 ( -2.519 -8.568 2.114) 9.177 9.122 ( -4.946 -2.776 4.422) 7.192 9.271 ( -0.923 -7.476 3.152) 8.166 9.423 ( -0.374 0.231 1.799) 1.852 9.912 ( -0.219 5.178 -1.923) 5.528 9.944 ( -0.316 -5.186 -3.436) 6.229 10.253 ( -3.672 0.695 -3.916) 5.413 10.687 ( -3.868 -3.693 -17.746) 18.534 10.897 ( 5.776 -1.383 -4.068) 7.198 11.160 ( 4.881 -6.822 2.714) 8.816 11.306 ( 11.258 -1.964 4.265) 12.198 11.481 ( 3.398 0.109 -2.100) 3.996 11.663 ( -1.686 -0.979 -0.865) 2.132 11.755 ( -1.292 1.207 0.855) 1.964 11.839 ( -1.716 4.650 -1.250) 5.112 12.132 ( 0.375 0.024 4.783) 4.798 12.179 ( 3.368 -0.663 -6.994) 7.791 12.404 ( -3.316 -2.188 -0.947) 4.084 12.514 ( -2.982 0.580 -3.013) 4.279 12.593 ( 8.880 6.261 3.368) 11.375 12.798 ( -17.709 -0.807 -0.356) 17.731 13.363 ( -7.970 10.492 -2.485) 13.408 14.811 ( -3.208 3.364 3.323) 5.714 14.861 ( -3.276 0.602 2.658) 4.262 15.043 ( 2.182 -0.301 -5.286) 5.726 15.242 ( -2.706 3.033 3.176) 5.159 15.345 ( -0.357 -0.855 2.001) 2.205 15.553 ( 3.600 1.007 -6.467) 7.470 15.640 ( 1.945 -0.640 -2.033) 2.886 15.784 ( 5.264 3.059 -3.316) 6.933 15.805 ( 2.878 1.314 5.496) 6.341 16.168 ( -4.480 0.836 1.112) 4.691 16.337 ( -3.303 -1.493 4.967) 6.149 16.613 ( -2.442 -4.745 1.826) 5.641 17.385 ( 14.455 8.120 2.392) 16.751 17.707 ( -0.070 -1.384 5.067) 5.253 17.741 ( -1.281 9.436 2.360) 9.810 18.073 ( 1.757 -0.405 -3.455) 3.897 25.749 ( 0.841 -2.487 1.111) 2.851 25.766 ( 1.067 -1.576 -0.832) 2.077 25.877 ( -1.916 -1.650 0.239) 2.540 25.938 ( -2.131 -0.696 1.249) 2.566 26.059 ( -1.386 3.284 -3.553) 5.033 26.285 ( 0.902 -1.430 -3.745) 4.109 26.601 ( -0.544 -0.769 2.017) 2.226 26.681 ( 2.000 -0.946 5.468) 5.899 27.003 ( -2.900 0.850 -7.820) 8.384 27.713 ( -10.436 7.759 -6.233) 14.421 27.942 ( 3.183 -3.691 7.608) 9.035 28.221 ( -1.094 -7.269 7.592) 10.568 28.490 ( -1.629 -5.687 -3.778) 7.019 28.577 ( -1.992 -9.362 1.046) 9.629 29.410 ( 5.008 0.620 9.953) 11.159 30.296 ( 12.799 17.982 -12.480) 25.356 ======================= Grid point 189 (91/140) ======================= q-point: ( 0.56 0.22 -0.67) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 7.23e-05 7.23e-05 7.23e-05 7.23e-05 7.23e-05 7.23e-05 7.23e-05 7.23e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 244 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.908 ( -9.001 -5.718 7.140) 12.833 1.992 ( 3.905 -6.341 -5.139) 9.048 2.038 ( 0.787 -11.340 -0.882) 11.401 2.249 ( 1.908 -5.399 1.220) 5.855 2.314 ( 4.352 -9.344 -8.499) 13.359 2.567 ( -2.417 -3.712 1.098) 4.564 2.694 ( 1.732 -6.200 -8.248) 10.463 2.728 ( -3.131 -1.651 -4.154) 5.457 2.865 ( -0.433 0.857 -1.114) 1.471 3.033 ( 0.036 -2.707 1.518) 3.104 3.122 ( -2.734 -7.611 -1.729) 8.270 3.231 ( 4.302 2.125 7.898) 9.241 3.323 ( -3.848 -9.563 4.199) 11.131 3.514 ( -3.832 -2.075 0.460) 4.382 3.710 ( 2.210 3.500 6.648) 7.831 3.931 ( -1.237 5.710 6.228) 8.539 4.024 ( -4.092 -5.053 3.158) 7.228 4.337 ( -2.984 -5.484 -4.968) 7.979 4.356 ( -0.649 0.950 -11.554) 11.611 4.474 ( 3.415 -6.454 -4.985) 8.841 4.542 ( 5.978 -0.914 -2.613) 6.588 4.727 ( 2.400 -0.247 -2.316) 3.345 4.788 ( -0.379 3.794 3.007) 4.856 4.996 ( 4.688 0.190 -6.962) 8.396 5.292 ( -3.985 4.767 1.666) 6.433 5.414 ( -1.820 -3.411 3.599) 5.282 5.653 ( -3.695 -4.556 -0.893) 5.934 5.888 ( 5.874 2.426 3.742) 7.375 5.914 ( 5.706 -1.422 -1.214) 6.004 6.116 ( -2.798 2.745 4.754) 6.162 6.272 ( 8.739 -1.139 -1.015) 8.871 6.364 ( -6.253 4.715 1.325) 7.943 6.549 ( 4.090 0.852 0.624) 4.224 6.728 ( -3.523 -1.019 -1.038) 3.812 6.956 ( -3.803 4.694 4.107) 7.305 7.007 ( 1.616 4.412 4.935) 6.814 7.208 ( -2.703 -0.327 5.377) 6.027 7.286 ( -4.463 -5.133 -0.676) 6.835 7.612 ( -3.438 2.818 -6.459) 7.841 7.701 ( 1.975 -1.274 -3.730) 4.408 8.741 ( -4.495 -3.411 4.813) 7.417 9.052 ( 0.780 -6.897 1.755) 7.159 9.099 ( 1.482 -8.161 5.033) 9.702 9.150 ( -1.148 -2.673 4.242) 5.144 9.348 ( 1.575 -0.449 -1.203) 2.032 9.507 ( -0.086 -7.595 4.931) 9.056 9.810 ( -1.829 3.330 4.175) 5.645 10.031 ( -0.512 -3.648 -4.227) 5.607 10.203 ( -3.572 -0.460 -0.291) 3.614 10.638 ( -0.702 -3.145 -15.976) 16.298 10.953 ( 5.560 -1.602 -2.884) 6.465 11.278 ( 0.445 -0.893 -0.462) 1.100 11.327 ( 7.882 4.847 -1.612) 9.393 11.607 ( 6.283 -3.285 3.562) 7.935 11.642 ( -0.003 1.134 5.363) 5.482 11.715 ( -3.167 0.594 -2.746) 4.234 11.766 ( -1.917 -0.176 -1.536) 2.463 12.099 ( -0.131 1.110 -6.920) 7.009 12.201 ( 0.424 -0.692 -2.205) 2.350 12.407 ( -2.981 2.832 4.250) 5.913 12.451 ( -3.463 0.509 -4.514) 5.712 12.609 ( 8.519 5.519 3.754) 10.822 12.714 ( -5.154 -4.324 -2.097) 7.047 13.122 ( -9.191 6.109 -1.385) 11.123 14.762 ( -1.580 1.044 1.563) 2.456 14.864 ( -2.681 -1.516 2.201) 3.785 15.034 ( 0.977 -0.521 -4.260) 4.402 15.177 ( -1.850 3.182 -1.042) 3.826 15.398 ( -0.051 -2.886 4.326) 5.201 15.538 ( 1.763 -0.496 -4.636) 4.984 15.648 ( 1.703 0.451 -1.242) 2.155 15.743 ( 4.999 4.464 -2.645) 7.205 15.851 ( 3.550 -0.252 3.414) 4.932 16.101 ( -6.837 2.286 2.419) 7.604 16.371 ( -3.301 -2.168 7.340) 8.335 16.662 ( -0.459 -2.134 -0.635) 2.274 17.352 ( 9.490 9.222 2.195) 13.414 17.570 ( -1.764 9.125 -0.855) 9.333 17.749 ( -0.642 -1.489 5.372) 5.611 18.070 ( 1.116 -0.163 -3.987) 4.143 25.785 ( -0.463 -0.831 1.382) 1.678 25.815 ( 1.868 -2.565 0.879) 3.293 25.884 ( -1.883 -1.077 -0.896) 2.347 25.932 ( -2.018 -0.003 0.094) 2.020 25.992 ( 0.039 2.218 -0.962) 2.418 26.298 ( 1.161 -1.425 -4.917) 5.249 26.610 ( -1.877 -0.887 -0.299) 2.097 26.744 ( 1.508 -1.468 6.333) 6.674 26.938 ( -1.584 0.516 -6.937) 7.135 27.519 ( -7.540 3.465 -5.493) 9.951 28.064 ( 4.717 -2.563 8.639) 10.172 28.383 ( 1.632 -6.717 8.720) 11.127 28.541 ( 0.713 -3.895 -5.243) 6.570 28.744 ( -2.856 -11.311 1.338) 11.742 29.445 ( 0.317 2.720 6.443) 7.001 29.990 ( 7.175 20.222 -10.442) 23.863 ======================= Grid point 190 (92/140) ======================= q-point: (-0.33 0.22 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 7.23e-05 7.23e-05 7.23e-05 7.23e-05 7.23e-05 7.23e-05 7.23e-05 7.23e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 244 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.851 ( -8.830 5.994 12.276) 16.266 2.056 ( 0.013 -3.906 -3.382) 5.166 2.209 ( -5.242 -1.557 -4.773) 7.259 2.338 ( 0.471 -7.291 2.618) 7.761 2.386 ( 6.883 -0.167 -5.837) 9.026 2.599 ( 5.586 2.347 2.259) 6.466 2.704 ( -3.600 -3.991 -3.989) 6.693 2.836 ( 2.091 -5.274 -0.410) 5.688 2.872 ( -0.269 -4.244 -1.171) 4.411 3.056 ( 1.920 0.027 0.860) 2.104 3.167 ( 2.151 4.635 2.359) 5.628 3.269 ( -1.485 -8.022 -0.089) 8.158 3.477 ( -3.289 -7.847 3.545) 9.217 3.577 ( 1.712 -1.713 5.371) 5.891 3.714 ( 2.744 1.254 -0.520) 3.061 3.845 ( -3.939 5.225 4.444) 7.909 4.091 ( -6.271 -4.907 4.233) 9.018 4.194 ( -4.746 3.898 -7.747) 9.885 4.364 ( 0.146 -1.675 -5.857) 6.094 4.511 ( 4.701 -0.851 -11.641) 12.584 4.599 ( -2.359 2.414 2.264) 4.064 4.716 ( 0.045 0.806 5.297) 5.358 4.749 ( 5.551 3.805 -0.394) 6.741 5.060 ( 5.377 -6.251 -11.767) 14.368 5.227 ( -1.866 1.813 5.439) 6.029 5.454 ( 0.634 -0.492 2.761) 2.875 5.673 ( -3.342 -2.574 -3.140) 5.259 5.918 ( 3.719 3.232 2.816) 5.675 5.946 ( 1.710 -2.555 -5.550) 6.344 6.092 ( -1.664 3.874 7.279) 8.412 6.245 ( -5.438 3.504 2.394) 6.898 6.356 ( 7.365 -1.184 -0.929) 7.517 6.579 ( 0.859 -0.444 3.353) 3.490 6.750 ( 2.167 -1.469 0.057) 2.618 6.859 ( -3.794 1.295 0.946) 4.119 6.990 ( -1.304 2.800 4.237) 5.243 7.204 ( -3.103 -2.121 -1.522) 4.055 7.364 ( -1.972 -3.884 4.282) 6.108 7.499 ( -1.040 2.637 -6.470) 7.064 7.699 ( -1.303 -1.184 -6.142) 6.389 8.794 ( -2.330 -3.069 7.433) 8.373 9.123 ( 1.621 -3.765 -6.312) 7.526 9.211 ( -1.893 -4.467 2.712) 5.558 9.243 ( 6.242 1.616 4.032) 7.605 9.393 ( 4.345 -2.322 2.995) 5.766 9.620 ( -4.426 -4.091 5.182) 7.949 9.829 ( -0.818 -1.682 6.032) 6.316 9.984 ( -2.422 2.519 -2.262) 4.163 10.239 ( -3.576 -4.165 4.017) 6.802 10.641 ( 4.419 -4.356 -13.245) 14.626 10.987 ( 3.689 1.776 0.574) 4.135 11.189 ( -4.828 6.208 -1.093) 7.940 11.300 ( 8.447 5.038 -2.067) 10.050 11.611 ( -0.290 5.883 0.374) 5.902 11.650 ( -3.027 -2.062 5.609) 6.699 11.674 ( -0.219 0.545 -4.430) 4.469 11.868 ( 4.485 -5.653 1.897) 7.461 12.051 ( -2.595 -0.982 -9.327) 9.731 12.159 ( -5.502 2.137 0.020) 5.903 12.327 ( 0.486 5.292 -0.625) 5.351 12.414 ( -0.429 -0.653 -2.847) 2.953 12.472 ( 1.743 9.924 -3.639) 10.713 12.904 ( 5.202 -12.460 4.915) 14.369 13.081 ( -4.247 -6.657 1.861) 8.113 14.753 ( 0.030 0.788 1.713) 1.886 14.880 ( -4.154 -2.154 0.703) 4.732 15.048 ( 0.994 -2.422 -3.341) 4.244 15.116 ( -0.485 0.945 -2.040) 2.300 15.445 ( -0.201 0.158 2.495) 2.508 15.558 ( 0.096 -1.981 -0.960) 2.203 15.634 ( 1.776 2.291 -0.977) 3.059 15.685 ( 2.838 4.004 -3.319) 5.925 15.908 ( 6.244 -1.007 2.468) 6.789 16.037 ( -7.895 -0.317 3.204) 8.527 16.425 ( -4.362 -2.828 8.591) 10.042 16.676 ( 1.602 -0.007 -2.303) 2.805 17.238 ( -0.343 9.275 2.269) 9.555 17.420 ( 1.248 6.644 -4.426) 8.080 17.802 ( 0.335 -1.586 4.645) 4.920 18.057 ( 1.361 0.208 -4.710) 4.907 25.792 ( -1.071 0.611 2.851) 3.106 25.851 ( 0.426 0.731 -0.240) 0.880 25.898 ( -0.103 -2.711 0.993) 2.889 25.910 ( -0.771 0.778 0.511) 1.209 25.981 ( 0.051 -0.457 0.476) 0.662 26.299 ( 1.195 -1.041 -6.565) 6.754 26.605 ( -1.770 -0.690 -1.218) 2.256 26.786 ( -0.891 -0.751 -3.990) 4.156 26.915 ( 0.931 -0.200 5.507) 5.589 27.422 ( -5.621 -0.722 -5.078) 7.609 28.179 ( 3.428 -1.787 8.713) 9.532 28.558 ( 7.124 -5.556 6.290) 11.008 28.586 ( 2.616 -3.001 -2.685) 4.802 28.905 ( -3.609 -10.088 -0.185) 10.716 29.378 ( -2.444 7.142 1.965) 7.800 29.658 ( 0.915 16.943 -7.705) 18.635 ======================= Grid point 191 (93/140) ======================= q-point: (-0.22 0.22 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 7.23e-05 7.23e-05 7.23e-05 7.23e-05 7.23e-05 7.23e-05 7.23e-05 7.23e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 244 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.714 ( -9.621 9.204 13.877) 19.231 2.059 ( -3.512 7.433 2.883) 8.712 2.093 ( 0.903 1.303 -6.382) 6.576 2.367 ( 7.502 4.330 -5.563) 10.294 2.476 ( -2.473 -2.984 5.998) 7.141 2.586 ( 7.348 6.747 1.978) 10.170 2.711 ( -0.954 0.461 -0.322) 1.107 2.833 ( -1.290 -1.606 0.322) 2.085 3.017 ( 1.767 -4.721 -0.963) 5.132 3.054 ( 5.581 2.857 3.448) 7.155 3.170 ( 2.503 -0.191 0.485) 2.557 3.383 ( -3.847 -7.015 -5.240) 9.564 3.522 ( -1.020 6.812 5.015) 8.520 3.560 ( 0.784 1.544 3.884) 4.253 3.738 ( -7.853 1.643 -0.270) 8.028 3.741 ( 1.968 -0.855 -2.064) 2.977 4.048 ( -5.162 2.474 -0.367) 5.736 4.170 ( -5.959 -2.116 2.267) 6.717 4.366 ( 2.971 1.484 1.194) 3.529 4.483 ( 3.509 -0.474 -11.229) 11.774 4.538 ( -0.118 1.244 -2.585) 2.871 4.706 ( -1.097 0.543 5.818) 5.945 4.772 ( 7.194 1.261 0.262) 7.309 5.118 ( 0.887 -4.750 -13.492) 14.331 5.233 ( 0.542 1.926 7.118) 7.394 5.466 ( 3.096 1.825 -0.911) 3.708 5.680 ( -2.850 -2.316 0.135) 3.675 5.856 ( 0.697 6.297 1.371) 6.482 5.964 ( 0.436 -1.604 -5.577) 5.819 5.994 ( -3.917 5.395 -0.055) 6.667 6.231 ( 0.129 -0.378 7.017) 7.028 6.396 ( 1.117 -0.405 -2.329) 2.615 6.611 ( 0.250 -0.868 4.295) 4.389 6.752 ( 5.246 4.559 5.622) 8.939 6.906 ( -0.613 -5.181 -3.454) 6.257 6.914 ( -4.919 2.363 -1.706) 5.718 7.218 ( -1.781 -2.697 -2.190) 3.904 7.353 ( -2.477 0.775 -3.813) 4.612 7.547 ( -0.293 -7.579 2.843) 8.100 7.682 ( -0.926 -1.914 -4.228) 4.733 8.877 ( -0.273 -2.925 7.125) 7.707 9.151 ( 0.253 -0.494 -6.646) 6.670 9.229 ( 2.008 3.321 0.980) 4.002 9.262 ( 2.469 0.068 0.543) 2.528 9.439 ( 2.522 1.799 2.713) 4.118 9.591 ( -7.076 4.373 -2.435) 8.668 9.866 ( -0.337 -1.918 10.619) 10.796 9.989 ( -0.931 -1.603 3.180) 3.681 10.283 ( -6.513 -3.012 5.001) 8.746 10.722 ( 10.452 -4.542 -9.898) 15.094 10.958 ( 0.816 4.611 4.613) 6.574 11.033 ( -5.903 6.001 0.167) 8.420 11.304 ( 12.474 3.600 -1.342) 13.052 11.480 ( -2.867 5.354 -5.995) 8.534 11.644 ( 1.228 1.896 -0.032) 2.259 11.693 ( -4.071 -3.180 2.555) 5.763 11.929 ( -0.087 0.934 -1.722) 1.961 11.997 ( -2.976 0.668 -3.954) 4.994 12.116 ( -1.083 -0.627 4.668) 4.832 12.229 ( 0.467 4.947 -4.729) 6.859 12.356 ( 2.152 1.154 -3.618) 4.365 12.483 ( 1.483 -6.702 -4.650) 8.291 13.151 ( -3.110 -10.504 6.919) 12.957 13.269 ( 4.893 -13.806 1.741) 14.750 14.749 ( 0.710 1.147 3.673) 3.913 14.865 ( -2.950 0.237 -1.002) 3.124 15.093 ( -1.095 -3.656 -1.533) 4.113 15.139 ( 0.476 -4.642 -2.290) 5.198 15.412 ( -0.506 4.300 2.272) 4.890 15.540 ( -1.429 2.864 -1.815) 3.679 15.602 ( 1.324 2.291 -0.299) 2.663 15.642 ( 2.506 1.645 -3.452) 4.572 16.005 ( -1.496 -1.625 2.605) 3.415 16.039 ( 1.946 -5.671 2.401) 6.458 16.473 ( -6.375 -3.027 7.910) 10.600 16.669 ( 3.375 1.682 -2.511) 4.530 17.082 ( -7.549 6.852 3.195) 10.684 17.330 ( 5.178 3.786 -6.236) 8.946 17.839 ( -0.497 -0.481 2.553) 2.645 18.041 ( 2.746 0.610 -5.344) 6.039 25.774 ( -1.000 1.959 2.212) 3.119 25.822 ( 0.219 2.058 -0.641) 2.167 25.914 ( -0.724 -0.394 4.031) 4.114 25.961 ( 0.928 -2.753 3.590) 4.619 25.992 ( -0.555 -0.803 -0.561) 1.125 26.292 ( 1.835 -0.980 -7.288) 7.579 26.592 ( -1.286 0.197 -1.215) 1.780 26.721 ( -2.487 1.905 -8.801) 9.342 27.009 ( 2.847 -2.795 12.464) 13.087 27.391 ( -5.133 -3.219 -5.667) 8.296 28.245 ( -1.551 -0.379 7.414) 7.584 28.601 ( 4.837 0.306 -7.876) 9.248 28.807 ( 11.084 -8.540 9.985) 17.189 29.015 ( -0.129 -5.696 -1.730) 5.954 29.201 ( -2.611 10.773 0.447) 11.094 29.377 ( -5.781 10.634 -5.895) 13.463 ======================= Grid point 192 (94/140) ======================= q-point: (-0.11 0.22 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 7.23e-05 7.23e-05 7.23e-05 7.23e-05 7.23e-05 7.23e-05 7.23e-05 7.23e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 244 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.546 ( -6.964 10.900 15.056) 19.849 1.881 ( 1.305 12.454 4.488) 13.302 2.035 ( -0.938 5.835 -2.555) 6.439 2.290 ( 6.271 9.200 0.511) 11.146 2.446 ( -2.194 4.331 -3.317) 5.880 2.517 ( 9.135 8.419 -0.516) 12.434 2.676 ( 1.647 6.289 7.257) 9.743 2.890 ( -1.223 -2.845 2.815) 4.185 3.018 ( -1.740 2.217 -2.210) 3.582 3.082 ( 2.799 2.161 3.687) 5.109 3.170 ( 3.950 4.367 2.273) 6.312 3.332 ( -5.420 0.051 -11.678) 12.875 3.352 ( -5.028 12.621 3.712) 14.083 3.489 ( 0.114 9.720 1.443) 9.827 3.729 ( 0.152 -3.443 1.147) 3.632 3.805 ( -1.993 -7.036 -1.534) 7.472 3.980 ( -4.313 0.448 1.067) 4.466 4.099 ( -2.448 6.138 6.053) 8.962 4.375 ( -1.983 -1.045 -6.738) 7.101 4.500 ( 0.946 -0.128 2.820) 2.977 4.542 ( 8.210 -2.897 -8.449) 12.132 4.723 ( 2.707 1.914 3.444) 4.780 4.855 ( 4.905 -4.727 3.495) 7.656 5.094 ( -3.757 -1.702 -13.816) 14.419 5.213 ( -2.048 3.389 5.955) 7.151 5.446 ( 5.581 2.046 -5.553) 8.134 5.645 ( -3.858 5.661 4.626) 8.266 5.793 ( -0.335 3.824 0.017) 3.838 5.911 ( 2.454 0.869 -0.780) 2.718 5.979 ( -1.308 -5.375 -5.801) 8.016 6.289 ( 0.477 -2.082 5.638) 6.029 6.390 ( -0.137 -1.027 -2.605) 2.803 6.660 ( 1.421 -1.126 5.992) 6.260 6.759 ( 0.072 1.320 3.326) 3.579 6.780 ( -4.224 4.395 -0.672) 6.133 6.995 ( 3.779 -4.921 -6.856) 9.247 7.242 ( -1.575 -2.294 -0.151) 2.787 7.322 ( -2.372 -1.412 -3.574) 4.516 7.658 ( -5.915 -5.958 1.411) 8.514 7.749 ( 2.799 -6.058 0.670) 6.707 8.910 ( 0.940 4.318 4.586) 6.369 9.034 ( -3.760 6.951 -5.224) 9.473 9.161 ( -1.455 6.761 0.098) 6.917 9.257 ( 3.253 5.001 -1.330) 6.112 9.397 ( -5.361 4.480 0.404) 6.998 9.494 ( 1.432 -2.632 -2.089) 3.652 9.943 ( -7.530 -2.454 9.011) 11.997 10.004 ( 0.905 0.998 4.981) 5.160 10.298 ( -6.054 -2.013 5.416) 8.368 10.821 ( 14.238 -0.002 -8.960) 16.822 10.909 ( -3.659 1.874 2.434) 4.778 10.930 ( 2.232 4.879 3.543) 6.430 11.277 ( -1.308 4.978 -4.455) 6.807 11.405 ( 7.967 0.917 -5.520) 9.736 11.629 ( 0.316 2.743 4.229) 5.050 11.737 ( 2.753 -4.195 -1.800) 5.331 11.915 ( -2.476 -0.294 1.888) 3.127 11.957 ( -2.079 -1.080 1.001) 2.548 12.141 ( 0.154 0.633 -7.524) 7.552 12.161 ( 4.335 0.584 -0.185) 4.378 12.398 ( -1.238 -4.906 2.963) 5.863 12.597 ( 1.957 -8.015 -6.549) 10.534 13.293 ( -7.815 -7.213 8.288) 13.483 13.544 ( 1.244 -14.002 -1.888) 14.183 14.783 ( -0.960 -2.770 5.807) 6.505 14.846 ( 0.308 -0.664 -0.091) 0.738 15.080 ( -6.924 1.059 -0.240) 7.009 15.243 ( 5.080 -3.903 -1.302) 6.537 15.345 ( -0.990 2.725 1.225) 3.148 15.468 ( 1.290 2.769 -4.124) 5.132 15.576 ( 0.928 1.603 1.359) 2.297 15.618 ( 1.634 0.832 -4.155) 4.541 15.991 ( -9.805 -1.808 2.644) 10.315 16.197 ( 7.477 -4.519 -0.771) 8.770 16.512 ( -7.167 -4.077 4.902) 9.593 16.666 ( 7.612 1.522 0.734) 7.798 16.926 ( -12.601 4.536 3.848) 13.934 17.319 ( 9.921 1.406 -4.162) 10.850 17.832 ( -1.626 0.962 -0.171) 1.897 18.030 ( 4.484 0.923 -5.217) 6.941 25.741 ( -0.587 2.152 1.637) 2.767 25.788 ( 1.012 2.157 -0.758) 2.501 25.931 ( -1.642 0.014 3.742) 4.087 25.982 ( -1.177 0.815 0.124) 1.437 26.047 ( 0.472 -3.719 5.686) 6.810 26.296 ( 3.605 -1.119 -6.264) 7.313 26.563 ( -1.537 1.288 -1.291) 2.385 26.623 ( -1.897 2.614 -6.579) 7.329 27.160 ( 3.617 -4.438 13.363) 14.537 27.379 ( -5.374 -3.455 -6.459) 9.085 28.244 ( -5.611 0.872 5.781) 8.103 28.558 ( 2.141 3.216 -9.542) 10.295 28.902 ( -3.772 4.343 2.641) 6.330 28.982 ( -6.995 13.227 -1.928) 15.086 29.162 ( -2.797 -0.214 -0.675) 2.885 29.306 ( 21.722 -13.004 0.994) 25.337 ======================= Grid point 196 (95/140) ======================= q-point: ( 0.33 0.33 -0.67) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 7.23e-05 7.23e-05 7.23e-05 7.23e-05 7.23e-05 7.23e-05 7.23e-05 7.23e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 140 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.047 ( 1.966 0.000 -11.924) 12.085 1.403 ( -2.919 -0.000 -8.739) 9.214 1.673 ( 1.565 0.000 -21.842) 21.898 1.964 ( 9.156 0.000 5.351) 10.605 2.196 ( 3.715 0.000 5.320) 6.489 2.205 ( -2.224 -0.000 4.323) 4.862 2.453 ( 3.770 0.000 6.843) 7.813 2.488 ( -1.338 -0.000 -5.907) 6.057 2.788 ( -12.727 -0.000 -7.378) 14.712 3.017 ( -0.602 -0.000 4.977) 5.013 3.098 ( 13.283 0.000 1.168) 13.334 3.150 ( 1.743 0.000 3.603) 4.002 3.189 ( -5.091 -0.000 -0.424) 5.109 3.640 ( -5.800 -0.000 -4.013) 7.054 3.699 ( 8.769 0.000 -1.961) 8.986 3.908 ( -1.011 -0.000 2.298) 2.510 4.004 ( -6.343 -0.000 -0.385) 6.354 4.083 ( 0.500 0.000 4.487) 4.515 4.176 ( 0.235 0.000 5.691) 5.696 4.321 ( -4.973 -0.000 1.242) 5.126 4.566 ( 8.955 0.000 -17.261) 19.446 4.701 ( -1.929 -0.000 2.268) 2.977 4.922 ( -6.692 -0.000 4.182) 7.891 5.120 ( 0.986 0.000 -5.036) 5.132 5.203 ( 1.362 0.000 -1.449) 1.988 5.469 ( 2.666 0.000 8.785) 9.180 5.540 ( 0.979 0.000 1.021) 1.415 5.857 ( 11.658 0.000 -1.151) 11.715 6.073 ( -3.720 -0.000 0.074) 3.721 6.168 ( -1.641 -0.000 0.018) 1.641 6.460 ( 1.867 0.000 0.770) 2.020 6.572 ( 2.242 0.000 -4.723) 5.228 6.632 ( -1.641 -0.000 6.704) 6.902 6.745 ( -3.393 -0.000 -3.023) 4.545 6.923 ( 4.452 0.000 2.431) 5.072 7.211 ( 4.031 0.000 -1.282) 4.230 7.238 ( -9.378 -0.000 5.145) 10.697 7.307 ( -11.361 -0.000 1.402) 11.448 7.485 ( -4.333 -0.000 1.041) 4.456 7.739 ( 4.061 0.000 -4.191) 5.835 8.391 ( -2.887 -0.000 -3.017) 4.175 8.822 ( -0.671 -0.000 8.223) 8.251 8.828 ( 2.264 0.000 6.860) 7.224 9.004 ( -15.758 -0.000 5.897) 16.825 9.167 ( 6.281 0.000 6.748) 9.219 9.484 ( 3.016 0.000 -1.562) 3.396 9.684 ( -4.619 -0.000 -7.593) 8.888 10.108 ( 1.392 0.000 -3.095) 3.394 10.279 ( -5.300 -0.000 -6.207) 8.162 10.526 ( -5.252 -0.000 -19.343) 20.044 10.924 ( 9.468 0.000 -4.069) 10.306 10.970 ( 1.268 0.000 2.625) 2.916 11.263 ( 6.924 0.000 11.260) 13.218 11.522 ( 4.146 0.000 -8.320) 9.296 11.603 ( 0.938 0.000 -1.573) 1.831 11.810 ( -0.288 -0.000 5.516) 5.524 11.933 ( -1.099 -0.000 -3.868) 4.022 12.109 ( -0.060 -0.000 4.916) 4.916 12.149 ( 1.021 0.000 -4.483) 4.598 12.372 ( -6.293 -0.000 1.531) 6.476 12.506 ( -5.777 -0.000 -13.686) 14.856 12.655 ( -7.045 -0.000 -0.638) 7.074 12.854 ( -2.727 -0.000 9.370) 9.758 13.567 ( -4.347 -0.000 -1.734) 4.680 14.872 ( -1.396 -0.000 2.328) 2.715 14.876 ( -1.041 -0.000 -0.601) 1.202 15.146 ( -10.769 -0.000 6.890) 12.785 15.153 ( 2.597 0.000 1.076) 2.811 15.482 ( 8.255 0.000 -7.138) 10.913 15.587 ( -3.400 -0.000 -4.155) 5.369 15.650 ( 1.989 0.000 1.236) 2.342 15.707 ( 4.717 0.000 -1.895) 5.084 15.964 ( 2.869 0.000 2.162) 3.593 16.124 ( -0.464 -0.000 4.002) 4.028 16.338 ( -0.138 -0.000 0.295) 0.326 16.455 ( -3.796 -0.000 3.959) 5.484 17.609 ( 15.203 0.000 -2.930) 15.483 17.618 ( 1.763 0.000 6.858) 7.081 17.951 ( -3.115 -0.000 8.805) 9.340 18.056 ( 1.716 0.000 -2.743) 3.236 25.696 ( 0.652 0.000 0.387) 0.758 25.733 ( 1.758 0.000 -1.624) 2.393 25.844 ( -1.936 -0.000 1.559) 2.486 25.915 ( -2.056 -0.000 0.838) 2.220 26.123 ( -2.824 -0.000 -3.406) 4.425 26.260 ( 0.547 0.000 -2.763) 2.816 26.610 ( 0.307 0.000 1.364) 1.398 26.631 ( 0.777 0.000 2.223) 2.355 27.045 ( -3.781 -0.000 -3.532) 5.174 27.730 ( -9.433 -0.000 -12.876) 15.961 28.001 ( -5.824 -0.000 15.852) 16.888 28.115 ( 3.641 0.000 0.384) 3.661 28.298 ( -1.909 -0.000 1.976) 2.747 28.430 ( 0.389 0.000 -0.858) 0.942 29.431 ( 7.163 0.000 14.692) 16.345 30.636 ( 15.164 0.000 -16.824) 22.650 ======================= Grid point 197 (96/140) ======================= q-point: ( 0.44 0.33 -0.67) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 7.23e-05 7.23e-05 7.23e-05 7.23e-05 7.23e-05 7.23e-05 7.23e-05 7.23e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 244 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.181 ( 1.058 -19.018 -5.075) 19.712 1.598 ( 1.379 -23.343 -9.389) 25.198 1.677 ( 5.653 -7.343 -14.693) 17.372 2.052 ( -2.525 -6.205 2.779) 7.253 2.231 ( 8.008 3.691 6.111) 10.728 2.281 ( -2.600 -7.312 0.115) 7.761 2.452 ( 0.658 -3.150 -4.771) 5.754 2.624 ( -6.915 -8.525 -0.327) 10.982 2.679 ( -4.789 -4.339 -0.323) 6.470 3.031 ( 0.053 -1.608 0.087) 1.611 3.085 ( -0.487 4.090 -7.318) 8.397 3.156 ( 7.086 5.249 3.626) 9.535 3.240 ( -1.782 -3.326 10.473) 11.132 3.542 ( -3.023 3.162 -0.518) 4.405 3.826 ( 5.221 -1.827 -5.082) 7.512 3.888 ( -7.837 -4.738 1.235) 9.241 3.977 ( -1.431 -4.547 0.735) 4.823 4.124 ( 2.778 3.157 7.252) 8.383 4.210 ( -0.646 -4.959 -1.396) 5.192 4.323 ( -2.060 -1.863 -0.954) 2.937 4.556 ( 9.585 1.073 -12.360) 15.678 4.703 ( -0.475 -1.161 0.963) 1.581 4.884 ( -6.704 0.507 1.682) 6.930 5.091 ( -0.668 1.758 -4.130) 4.538 5.224 ( 0.756 -1.906 2.635) 3.339 5.504 ( 0.911 3.546 2.263) 4.305 5.550 ( 0.768 -1.143 4.017) 4.247 5.913 ( 8.129 0.670 -5.603) 9.895 6.024 ( 0.159 4.040 3.408) 5.288 6.182 ( -0.414 -0.502 5.127) 5.168 6.365 ( 4.219 8.145 -2.226) 9.439 6.554 ( -3.012 4.615 0.077) 5.512 6.594 ( 1.319 1.456 -3.956) 4.417 6.743 ( -5.799 -1.213 0.874) 5.988 6.990 ( 1.699 -3.096 1.967) 4.042 7.123 ( 4.675 3.893 5.030) 7.894 7.210 ( -7.661 3.515 7.240) 11.111 7.276 ( -6.708 0.115 0.401) 6.721 7.524 ( -4.038 -6.592 -2.420) 8.101 7.724 ( 4.209 2.364 -4.193) 6.394 8.468 ( -0.006 -9.920 -1.066) 9.977 8.826 ( -4.924 -2.485 0.793) 5.572 8.922 ( 2.383 -3.097 10.224) 10.946 9.004 ( -10.026 -5.441 13.178) 17.429 9.248 ( 4.914 -1.038 6.089) 7.893 9.438 ( -1.420 2.677 -0.894) 3.159 9.750 ( 1.482 -10.554 -8.384) 13.560 10.037 ( -0.622 6.572 -2.608) 7.098 10.202 ( -3.276 -0.034 -7.502) 8.186 10.458 ( -3.824 -6.726 -21.444) 22.797 10.934 ( 5.123 1.560 -0.522) 5.380 11.081 ( 4.121 -6.837 -0.068) 7.983 11.378 ( 7.081 -1.404 10.446) 12.698 11.510 ( 4.359 1.005 -7.087) 8.381 11.621 ( 0.627 -1.306 0.219) 1.466 11.786 ( -4.232 2.221 1.408) 4.982 11.892 ( 0.104 2.742 -1.529) 3.141 12.141 ( -0.175 -1.801 -6.579) 6.824 12.159 ( 0.505 -1.775 6.785) 7.031 12.310 ( -6.105 0.177 -5.243) 8.050 12.419 ( -6.514 -2.399 -8.244) 10.777 12.589 ( -9.711 -2.048 -0.919) 9.967 12.879 ( 7.738 6.534 9.118) 13.627 13.459 ( -4.905 7.337 -3.251) 9.405 14.841 ( -2.241 1.631 3.052) 4.123 14.882 ( -1.853 1.350 0.863) 2.449 15.054 ( -0.438 2.595 1.870) 3.228 15.242 ( -1.115 -3.891 3.051) 5.069 15.397 ( -0.836 7.852 -3.373) 8.586 15.555 ( 2.320 -0.668 -7.226) 7.619 15.645 ( 1.446 1.309 0.462) 2.004 15.788 ( 4.270 -2.558 -0.638) 5.018 15.943 ( 4.659 5.208 2.577) 7.448 16.150 ( -3.147 -0.615 2.808) 4.262 16.333 ( -0.110 0.209 3.124) 3.133 16.509 ( -3.093 -5.958 2.274) 7.087 17.625 ( 12.696 5.287 2.603) 13.997 17.713 ( 3.474 -0.167 2.628) 4.360 17.887 ( -6.603 6.738 7.707) 12.182 18.059 ( 0.953 -0.440 -3.277) 3.441 25.722 ( 0.929 -1.893 0.762) 2.242 25.749 ( 1.687 -1.108 -1.242) 2.370 25.841 ( -2.290 -0.883 0.782) 2.576 25.909 ( -2.518 -0.909 0.404) 2.708 26.071 ( -2.198 1.634 -2.913) 3.999 26.257 ( 1.016 -0.649 -3.409) 3.616 26.601 ( -0.910 0.492 0.608) 1.200 26.672 ( -0.119 -2.565 1.719) 3.090 26.985 ( -2.392 2.082 -2.667) 4.143 27.587 ( -10.565 -1.226 -17.240) 20.257 28.035 ( 0.020 0.949 14.380) 14.411 28.179 ( 4.428 -2.160 8.124) 9.502 28.372 ( 0.464 -6.341 -0.155) 6.359 28.458 ( -0.511 -3.928 -0.341) 3.976 29.531 ( 2.652 2.071 15.857) 16.210 30.566 ( 12.119 10.787 -16.934) 23.452 ======================= Grid point 198 (97/140) ======================= q-point: ( 0.56 0.33 -0.67) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 7.23e-05 7.23e-05 7.23e-05 7.23e-05 7.23e-05 7.23e-05 7.23e-05 7.23e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 244 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.554 ( -2.675 -23.939 -2.025) 24.173 1.815 ( 1.120 -10.287 -3.152) 10.818 1.922 ( 5.167 -15.242 -9.920) 18.905 2.186 ( 0.420 -8.299 5.765) 10.114 2.222 ( -0.871 2.587 2.278) 3.555 2.431 ( -1.933 -11.345 1.255) 11.577 2.499 ( -3.863 -6.550 -10.190) 12.714 2.621 ( -2.559 -6.369 -3.414) 7.666 2.869 ( 0.794 -7.107 3.822) 8.108 2.974 ( -0.726 0.823 -6.309) 6.404 3.063 ( -0.187 2.510 1.101) 2.747 3.151 ( 2.647 -5.253 1.103) 5.985 3.343 ( -0.151 -3.296 10.176) 10.698 3.473 ( -1.056 3.213 -1.185) 3.584 3.812 ( 0.421 2.658 4.885) 5.577 3.919 ( -6.758 -4.663 3.403) 8.888 4.057 ( -3.516 5.500 8.424) 10.657 4.163 ( 3.622 -10.352 -8.439) 13.839 4.279 ( -3.149 -2.654 -6.787) 7.939 4.356 ( 5.736 -5.695 -7.804) 11.236 4.557 ( 7.057 0.668 -5.569) 9.014 4.730 ( -2.531 -1.229 0.359) 2.836 4.835 ( 0.664 0.964 0.248) 1.196 5.009 ( -2.363 3.269 -4.280) 5.881 5.308 ( -0.692 -4.694 4.729) 6.699 5.426 ( 0.795 6.554 4.330) 7.895 5.581 ( -1.919 -1.221 -0.232) 2.286 5.898 ( 2.106 0.714 -10.579) 10.810 6.010 ( 4.826 2.409 5.299) 7.562 6.205 ( 2.169 2.905 10.372) 10.987 6.317 ( 4.460 1.417 -2.924) 5.518 6.435 ( -1.639 5.662 3.186) 6.700 6.583 ( 3.240 -0.013 -2.945) 4.379 6.692 ( -6.109 0.931 0.620) 6.210 7.019 ( -1.861 1.926 3.284) 4.237 7.104 ( -6.202 5.149 6.347) 10.260 7.191 ( -2.251 -1.086 0.700) 2.595 7.227 ( 3.582 -0.678 5.074) 6.248 7.559 ( -2.088 -2.003 -5.896) 6.568 7.687 ( -0.338 1.362 -5.148) 5.335 8.637 ( 0.191 -8.193 2.061) 8.450 8.879 ( -5.038 -8.715 -2.168) 10.297 9.064 ( 1.846 -5.437 7.082) 9.118 9.121 ( -1.076 -5.237 18.600) 19.353 9.335 ( 3.704 -1.518 0.281) 4.013 9.427 ( -2.642 -4.031 4.385) 6.515 9.869 ( -1.330 -1.484 -4.654) 5.062 9.924 ( -0.753 -0.478 -1.119) 1.431 10.155 ( -1.465 -0.555 -6.321) 6.513 10.461 ( 1.429 -7.427 -21.568) 22.855 10.965 ( 4.228 -0.823 0.491) 4.335 11.210 ( 0.911 -5.534 -2.450) 6.120 11.459 ( 5.386 3.805 -1.132) 6.691 11.554 ( 4.879 -6.782 1.903) 8.568 11.626 ( -4.511 -0.162 -0.227) 4.520 11.734 ( -0.808 1.601 4.125) 4.498 11.833 ( 1.513 4.757 1.470) 5.204 12.076 ( -3.649 2.186 -10.812) 11.619 12.205 ( 1.142 0.446 0.535) 1.338 12.316 ( -6.437 -6.976 -0.003) 9.492 12.390 ( -2.331 -2.803 -2.429) 4.381 12.583 ( -4.675 -4.392 -2.112) 6.753 12.841 ( 9.203 9.607 6.648) 14.872 13.224 ( -6.105 12.534 -3.973) 14.496 14.783 ( -4.686 2.878 3.493) 6.514 14.861 ( 0.080 0.851 2.367) 2.516 15.051 ( 4.832 1.147 -3.622) 6.147 15.206 ( -2.941 4.995 -1.363) 5.955 15.355 ( -1.766 -3.906 2.995) 5.229 15.534 ( 2.030 1.256 -5.692) 6.172 15.650 ( 0.884 -0.490 0.281) 1.049 15.806 ( 2.787 2.124 -4.670) 5.838 15.934 ( 4.492 2.398 5.987) 7.860 16.114 ( -3.477 2.545 1.555) 4.581 16.362 ( -1.065 -1.083 6.257) 6.439 16.590 ( -2.119 -5.050 -0.067) 5.477 17.597 ( 5.226 10.742 2.550) 12.215 17.706 ( 1.203 6.115 2.068) 6.567 17.775 ( -0.985 2.285 6.289) 6.763 18.052 ( 0.617 -0.294 -4.230) 4.285 25.769 ( 0.641 -1.950 1.185) 2.370 25.787 ( 1.515 -2.461 0.137) 2.893 25.844 ( -2.165 -1.310 -0.071) 2.531 25.906 ( -2.507 -0.901 0.002) 2.664 26.019 ( -1.027 1.762 -0.889) 2.225 26.259 ( 1.532 -0.991 -5.799) 6.079 26.589 ( -1.448 -0.055 -0.094) 1.452 26.718 ( -1.345 -2.855 -0.538) 3.202 26.935 ( -0.475 1.445 1.234) 1.959 27.449 ( -7.188 0.482 -12.263) 14.223 28.114 ( 2.167 -1.344 11.581) 11.858 28.331 ( 3.449 -6.811 9.324) 12.051 28.460 ( 2.592 -4.143 -4.468) 6.621 28.565 ( -1.269 -8.761 1.652) 9.005 29.551 ( -1.199 4.619 12.857) 13.714 30.313 ( 7.569 18.372 -15.636) 25.284 ======================= Grid point 199 (98/140) ======================= q-point: (-0.33 -0.67 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 7.23e-05 7.23e-05 7.23e-05 7.23e-05 7.23e-05 7.23e-05 7.23e-05 7.23e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 244 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.808 ( -6.487 -10.350 3.954) 12.838 1.977 ( -4.457 -8.180 -1.189) 9.391 2.084 ( 1.774 -0.452 2.018) 2.725 2.194 ( -1.353 -9.300 -5.422) 10.850 2.392 ( 7.128 -6.129 1.885) 9.588 2.496 ( -8.038 -9.442 -9.827) 15.821 2.627 ( 2.673 -6.368 2.593) 7.376 2.755 ( 4.707 -8.485 -1.170) 9.773 2.833 ( -0.262 2.517 -1.045) 2.738 3.054 ( 1.223 -1.129 1.928) 2.547 3.098 ( -0.395 -9.074 -0.400) 9.092 3.276 ( -2.465 -3.067 -1.987) 4.408 3.378 ( 4.866 1.029 6.647) 8.302 3.505 ( 0.011 -7.282 1.635) 7.463 3.782 ( -1.116 4.664 5.865) 7.576 3.960 ( -2.118 6.802 3.795) 8.072 3.979 ( -7.394 -6.008 5.583) 11.042 4.177 ( -4.010 3.358 -7.662) 9.277 4.277 ( 3.844 -5.376 -11.110) 12.927 4.459 ( 6.625 -3.723 -9.760) 12.370 4.607 ( 0.583 -2.376 1.729) 2.995 4.701 ( -7.432 -0.773 1.312) 7.587 4.862 ( 6.835 2.743 1.201) 7.462 4.941 ( -0.913 -1.876 -8.728) 8.974 5.331 ( 4.013 3.953 6.010) 8.237 5.443 ( 0.053 -2.582 7.480) 7.913 5.575 ( -2.982 -2.679 -4.110) 5.741 5.846 ( -1.051 -1.086 -11.631) 11.728 6.055 ( 6.896 1.882 6.534) 9.684 6.180 ( -4.224 4.803 3.950) 7.518 6.293 ( -0.543 3.112 3.980) 5.081 6.399 ( 3.671 1.510 -0.207) 3.975 6.590 ( -2.959 0.962 3.602) 4.760 6.700 ( 4.244 -4.660 -1.910) 6.586 6.937 ( -2.202 5.809 4.765) 7.829 7.044 ( -2.846 2.622 5.407) 6.649 7.154 ( -2.610 -0.311 -1.882) 3.233 7.337 ( 3.345 -2.049 6.612) 7.689 7.501 ( -1.259 2.555 -7.719) 8.228 7.633 ( -2.996 -0.547 -6.894) 7.536 8.755 ( -0.179 -4.261 5.570) 7.016 8.988 ( -1.233 -8.425 -5.133) 9.942 9.162 ( -0.458 -2.665 5.142) 5.810 9.336 ( 6.627 -3.350 13.956) 15.809 9.355 ( -0.530 -3.266 -0.375) 3.330 9.544 ( -1.098 -5.648 4.385) 7.234 9.818 ( -3.597 0.019 5.598) 6.654 9.947 ( -4.802 -2.448 -4.563) 7.062 10.152 ( -1.763 -3.196 -2.321) 4.325 10.527 ( 9.365 -6.857 -17.070) 20.642 11.018 ( 2.437 -1.093 1.455) 3.042 11.205 ( -4.752 2.151 -5.110) 7.302 11.439 ( 6.091 3.080 1.724) 7.040 11.576 ( -7.554 -1.346 -2.876) 8.194 11.657 ( 0.830 0.245 -1.826) 2.020 11.754 ( 3.487 5.362 2.379) 6.825 11.812 ( 2.800 -4.377 5.207) 7.356 11.973 ( -1.427 0.020 -10.206) 10.305 12.174 ( -4.020 2.152 2.061) 5.004 12.341 ( 0.202 -1.405 -2.842) 3.177 12.450 ( 0.244 -0.297 2.257) 2.289 12.593 ( -0.343 2.225 -3.569) 4.220 12.832 ( 6.146 -0.259 4.413) 7.570 12.989 ( -4.775 3.652 -2.540) 6.526 14.748 ( -3.106 -0.886 2.526) 4.101 14.857 ( -0.209 1.074 1.742) 2.058 15.034 ( 3.135 1.790 -3.129) 4.778 15.130 ( -0.442 1.592 -3.333) 3.720 15.427 ( -1.322 -3.527 3.649) 5.244 15.515 ( 0.107 -1.046 -2.755) 2.949 15.658 ( 0.395 0.509 -0.588) 0.872 15.744 ( 0.528 3.701 -4.182) 5.610 15.961 ( 0.689 0.803 4.948) 5.059 16.053 ( 1.738 3.586 0.968) 4.101 16.407 ( -2.492 -1.409 8.430) 8.903 16.642 ( -0.609 -3.236 -2.227) 3.975 17.403 ( -6.570 11.457 3.574) 13.682 17.576 ( 4.483 10.495 -1.583) 11.521 17.819 ( 2.573 -0.531 5.106) 5.742 18.041 ( 1.239 -0.445 -5.008) 5.178 25.804 ( -0.115 -0.503 3.227) 3.268 25.846 ( -1.340 -2.814 -0.171) 3.122 25.854 ( 1.219 -1.491 0.489) 1.987 25.900 ( -1.856 -0.600 -0.148) 1.956 25.990 ( -0.659 0.949 1.043) 1.556 26.255 ( 2.321 -0.956 -8.650) 9.007 26.586 ( -0.618 -0.411 0.735) 1.045 26.725 ( -2.770 -1.533 -5.652) 6.478 26.956 ( 1.268 -0.495 8.809) 8.914 27.348 ( -4.433 0.065 -8.521) 9.605 28.206 ( -0.128 -1.913 9.416) 9.609 28.526 ( 3.821 -4.520 -4.935) 7.706 28.538 ( 6.036 -7.196 7.743) 12.173 28.719 ( -0.960 -9.819 -0.022) 9.866 29.487 ( -3.743 6.843 8.267) 11.366 29.946 ( 2.127 20.581 -12.655) 24.254 ======================= Grid point 200 (99/140) ======================= q-point: (-0.22 -0.67 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 7.23e-05 7.23e-05 7.23e-05 7.23e-05 7.23e-05 7.23e-05 7.23e-05 7.23e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 244 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.839 ( -8.176 5.009 13.218) 16.330 2.026 ( -0.806 -5.572 -0.563) 5.658 2.085 ( -4.333 -1.562 -4.579) 6.495 2.340 ( 2.848 -6.491 -3.565) 7.935 2.501 ( 6.266 -0.123 -0.299) 6.274 2.579 ( -1.715 -9.178 -6.222) 11.220 2.732 ( 4.166 -0.672 4.436) 6.123 2.807 ( -1.293 -0.390 -0.150) 1.359 2.939 ( 3.101 -6.934 2.686) 8.057 3.121 ( 3.360 -2.013 2.220) 4.502 3.192 ( 0.732 -1.845 -2.168) 2.940 3.235 ( -1.475 -1.656 -3.887) 4.476 3.479 ( -2.586 -3.980 4.690) 6.673 3.630 ( 0.420 -3.357 2.263) 4.070 3.696 ( -4.980 4.067 1.281) 6.557 3.827 ( 2.816 6.992 -0.822) 7.583 4.028 ( -7.505 -2.645 4.806) 9.296 4.108 ( -0.878 -0.582 0.318) 1.101 4.372 ( 7.288 -5.586 -5.820) 10.872 4.459 ( 4.152 2.600 -9.768) 10.928 4.592 ( -3.021 3.899 2.826) 5.684 4.684 ( -6.880 -3.284 3.528) 8.400 4.854 ( 6.146 3.242 -1.780) 7.173 4.956 ( -1.394 -5.187 -10.102) 11.441 5.358 ( 6.587 3.580 7.847) 10.853 5.490 ( 1.218 0.008 -1.015) 1.585 5.612 ( -1.284 -4.360 1.416) 4.761 5.815 ( -2.101 -2.836 -8.788) 9.471 6.035 ( -6.173 5.928 0.304) 8.564 6.081 ( 4.926 5.885 3.410) 8.399 6.276 ( -0.247 1.156 6.448) 6.556 6.393 ( 0.344 0.797 -2.612) 2.753 6.578 ( -6.781 -2.390 4.698) 8.589 6.801 ( 1.785 -3.066 -3.864) 5.246 6.881 ( 1.183 3.421 3.133) 4.787 6.999 ( 5.801 5.559 4.857) 9.389 7.153 ( -2.683 -2.161 -0.305) 3.458 7.363 ( 0.571 2.965 -2.922) 4.202 7.462 ( -0.690 -3.137 2.499) 4.069 7.607 ( -1.949 -2.840 -5.801) 6.746 8.849 ( 0.464 -3.525 6.494) 7.403 9.077 ( 1.833 -5.050 -6.541) 8.465 9.198 ( -3.698 -1.363 2.167) 4.498 9.348 ( 2.632 1.915 -2.151) 3.901 9.482 ( -1.850 -0.950 7.339) 7.628 9.591 ( -0.965 0.353 2.109) 2.346 9.865 ( -3.073 -2.635 7.341) 8.383 9.947 ( -1.998 -3.347 2.286) 4.519 10.187 ( -4.166 -4.270 -0.856) 6.027 10.663 ( 12.912 -6.812 -11.263) 18.438 10.997 ( -7.654 3.010 0.417) 8.235 11.112 ( 1.753 3.306 0.508) 3.776 11.460 ( 9.092 3.150 2.246) 9.881 11.490 ( -6.402 2.774 -9.761) 11.998 11.605 ( -4.257 0.946 3.489) 5.585 11.725 ( 3.256 2.146 1.837) 4.311 11.914 ( 1.280 -3.159 -3.694) 5.026 11.953 ( 2.395 -0.490 -5.147) 5.698 12.126 ( -5.365 0.469 6.673) 8.575 12.329 ( 1.981 5.051 -0.537) 5.452 12.417 ( 1.927 3.498 -1.602) 4.303 12.453 ( 3.745 6.916 -5.953) 9.863 12.960 ( -4.876 -10.595 3.694) 12.234 13.081 ( 3.103 -11.597 0.145) 12.006 14.785 ( 0.530 -2.569 2.707) 3.769 14.835 ( -1.281 1.295 0.390) 1.863 15.030 ( -1.037 -1.776 -1.816) 2.743 15.101 ( 3.194 0.838 -2.852) 4.363 15.471 ( -0.477 0.085 3.768) 3.799 15.533 ( -1.136 -1.377 -1.835) 2.561 15.634 ( -0.898 0.744 -1.275) 1.728 15.661 ( -1.108 3.423 -2.690) 4.492 15.949 ( -5.042 0.157 1.578) 5.286 16.070 ( 8.921 0.106 1.847) 9.111 16.442 ( -4.563 -0.761 8.933) 10.059 16.673 ( 1.321 -1.961 -3.115) 3.911 17.178 ( -8.629 10.142 3.560) 13.784 17.442 ( 4.957 7.377 -3.639) 9.603 17.852 ( 0.314 0.577 3.055) 3.125 18.040 ( 3.032 -0.381 -5.026) 5.882 25.808 ( -0.761 1.245 2.866) 3.216 25.845 ( -0.488 0.801 -0.403) 1.021 25.907 ( -0.653 -1.710 1.552) 2.400 25.923 ( 0.222 -3.384 1.964) 3.919 25.982 ( -1.272 0.037 1.621) 2.061 26.250 ( 3.950 -1.129 -9.494) 10.345 26.594 ( 0.022 0.211 1.783) 1.795 26.681 ( -2.876 0.279 -6.194) 6.834 27.046 ( 2.390 -2.226 11.980) 12.417 27.293 ( -3.107 -1.381 -7.364) 8.111 28.256 ( -3.668 -0.665 7.748) 8.598 28.583 ( 4.437 -2.011 -7.882) 9.266 28.740 ( 0.745 -7.769 4.547) 9.033 28.896 ( 7.266 -10.393 -0.595) 12.694 29.349 ( -4.795 9.170 4.877) 11.440 29.572 ( -1.420 17.557 -7.273) 19.057 ======================= Grid point 201 (100/140) ======================= q-point: (-0.11 0.33 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 7.23e-05 7.23e-05 7.23e-05 7.23e-05 7.23e-05 7.23e-05 7.23e-05 7.23e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 244 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.737 ( -2.852 7.717 11.111) 13.825 2.026 ( -3.318 3.715 2.794) 5.711 2.093 ( 1.744 0.691 0.507) 1.943 2.410 ( 2.884 -2.312 -7.864) 8.689 2.480 ( 3.103 5.825 0.104) 6.601 2.674 ( 2.889 -2.749 -3.108) 5.056 2.750 ( 3.070 4.268 5.733) 7.779 2.840 ( 1.283 -2.730 1.235) 3.260 3.010 ( -2.480 -0.394 1.191) 2.779 3.153 ( -1.329 -0.919 -3.182) 3.569 3.168 ( -4.820 1.606 -6.345) 8.128 3.252 ( 2.899 -0.865 -0.804) 3.130 3.500 ( -5.706 2.817 3.572) 7.298 3.561 ( -5.802 2.870 -0.087) 6.474 3.656 ( -0.887 -2.454 1.421) 2.971 3.826 ( 7.673 3.892 4.375) 9.652 4.001 ( -4.396 2.237 3.784) 6.217 4.152 ( 0.445 -1.478 4.603) 4.855 4.379 ( 3.406 4.208 -6.019) 8.096 4.493 ( 6.876 -5.178 -6.685) 10.899 4.527 ( -1.442 1.721 1.738) 2.839 4.748 ( -1.210 -4.324 7.693) 8.908 4.844 ( 4.970 0.652 -3.746) 6.257 4.954 ( -4.661 -2.579 -10.943) 12.171 5.342 ( 2.585 6.828 5.790) 9.318 5.468 ( 2.446 0.869 -7.899) 8.315 5.673 ( -1.355 -1.538 5.062) 5.462 5.834 ( 0.002 -2.923 -2.416) 3.792 5.894 ( -5.314 4.272 -1.492) 6.980 6.015 ( 5.478 6.823 1.033) 8.811 6.296 ( -1.672 -0.490 4.337) 4.674 6.369 ( 0.882 0.098 -3.104) 3.228 6.603 ( -9.968 -4.433 5.412) 12.178 6.777 ( -0.804 4.501 0.404) 4.590 6.832 ( 1.305 0.410 -5.515) 5.682 7.026 ( 9.539 3.349 3.585) 10.727 7.164 ( -5.185 -2.648 0.596) 5.853 7.323 ( 4.253 1.021 -1.552) 4.641 7.540 ( -3.156 -4.435 3.067) 6.248 7.660 ( 0.936 -6.189 -1.627) 6.467 8.935 ( -1.204 -2.393 5.408) 6.035 9.066 ( -3.813 3.364 -3.299) 6.061 9.207 ( 0.059 -1.984 -3.471) 3.998 9.299 ( -0.877 2.581 -2.153) 3.473 9.429 ( -5.922 3.693 0.596) 7.004 9.563 ( 3.839 6.226 2.949) 7.886 9.891 ( -7.601 -1.347 5.647) 9.565 10.023 ( 1.294 -2.094 5.681) 6.191 10.226 ( -4.329 -4.357 1.243) 6.267 10.812 ( 5.957 -4.443 -5.415) 9.195 10.906 ( 1.407 0.078 -3.602) 3.868 11.085 ( 3.542 4.812 5.212) 7.929 11.310 ( -3.850 6.269 -10.054) 12.458 11.492 ( 7.424 3.574 -0.720) 8.271 11.587 ( -6.531 -3.765 0.161) 7.540 11.773 ( 7.342 -0.212 6.137) 9.572 11.908 ( 0.948 1.262 -2.589) 3.032 11.950 ( 0.628 0.861 -1.145) 1.564 12.146 ( -0.439 -1.331 2.622) 2.973 12.240 ( 2.803 5.218 1.042) 6.014 12.323 ( -1.130 0.365 -5.204) 5.338 12.491 ( 5.226 -3.881 -3.762) 7.519 13.107 ( -8.861 -10.247 3.464) 13.983 13.308 ( -0.839 -12.909 -0.784) 12.960 14.796 ( -0.616 1.844 1.523) 2.470 14.849 ( 2.260 -1.097 2.077) 3.260 15.051 ( -1.607 -1.180 -0.114) 1.997 15.140 ( 1.219 -5.514 -1.661) 5.886 15.440 ( -0.816 5.341 3.642) 6.516 15.502 ( 0.583 1.681 -2.524) 3.088 15.598 ( -0.503 1.739 -1.777) 2.536 15.634 ( 0.370 -0.978 -2.258) 2.488 15.909 ( -6.146 0.092 1.133) 6.250 16.174 ( 5.515 -3.661 0.455) 6.635 16.451 ( -5.597 -0.666 6.984) 8.975 16.709 ( 4.044 -2.057 -2.037) 4.974 16.974 ( -7.957 8.439 4.276) 12.362 17.393 ( 7.295 1.821 -3.369) 8.239 17.836 ( -1.915 1.329 0.612) 2.410 18.049 ( 4.206 0.065 -4.291) 6.009 25.785 ( -0.208 2.287 1.913) 2.989 25.820 ( 0.177 1.431 -0.708) 1.606 25.934 ( -1.107 -0.696 3.095) 3.360 25.972 ( -0.832 -0.525 -1.021) 1.418 26.002 ( -2.072 -3.776 4.158) 5.987 26.269 ( 5.953 -1.692 -7.509) 9.731 26.581 ( -1.409 1.813 0.782) 2.426 26.626 ( -0.639 1.574 -2.315) 2.872 27.177 ( 2.717 -3.257 12.109) 12.830 27.269 ( -2.330 -2.906 -6.938) 7.874 28.247 ( -6.306 1.025 5.955) 8.734 28.562 ( 0.397 1.929 -9.492) 9.695 28.816 ( -6.375 -3.888 -2.614) 7.912 29.114 ( -2.478 5.193 -4.598) 7.365 29.232 ( 9.147 -3.952 3.820) 10.671 29.317 ( 5.723 6.960 3.260) 9.582 ======================= Grid point 206 (101/140) ======================= q-point: ( 0.44 0.44 -0.67) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 7.23e-05 7.23e-05 7.23e-05 7.23e-05 7.23e-05 7.23e-05 7.23e-05 7.23e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 140 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.049 ( 7.303 0.000 -3.941) 8.299 1.304 ( -0.371 -0.000 -8.026) 8.034 1.629 ( 12.567 0.000 -6.935) 14.354 1.931 ( -7.376 -0.000 -1.039) 7.449 2.174 ( -6.068 -0.000 -5.259) 8.030 2.335 ( -6.449 -0.000 0.268) 6.454 2.446 ( -0.334 -0.000 -6.120) 6.129 2.463 ( 0.017 0.000 1.803) 1.803 2.641 ( 3.324 0.000 7.583) 8.279 3.033 ( 4.009 0.000 -1.568) 4.304 3.086 ( -6.087 -0.000 -1.233) 6.210 3.213 ( -1.432 -0.000 -0.082) 1.434 3.286 ( 1.951 0.000 9.614) 9.810 3.586 ( 7.652 0.000 -4.398) 8.826 3.752 ( -12.818 -0.000 -0.560) 12.830 3.794 ( 5.612 0.000 -7.578) 9.430 3.935 ( -3.454 -0.000 2.993) 4.570 4.106 ( 0.751 0.000 -6.419) 6.463 4.275 ( 1.411 0.000 9.822) 9.923 4.282 ( -2.536 -0.000 2.393) 3.487 4.606 ( 13.845 0.000 -10.897) 17.619 4.651 ( -6.984 -0.000 0.558) 7.006 4.863 ( -4.613 -0.000 5.327) 7.046 5.069 ( -1.750 -0.000 -3.535) 3.945 5.250 ( 1.932 0.000 3.473) 3.974 5.541 ( -0.556 -0.000 3.048) 3.098 5.582 ( 3.468 0.000 1.307) 3.706 5.907 ( 2.251 0.000 -12.271) 12.476 6.089 ( 2.010 0.000 4.430) 4.865 6.231 ( 2.658 0.000 11.844) 12.139 6.438 ( -1.522 -0.000 -8.815) 8.945 6.567 ( 3.098 0.000 -3.836) 4.931 6.613 ( -5.804 -0.000 4.101) 7.106 6.663 ( -2.856 -0.000 -3.131) 4.238 6.999 ( 2.396 0.000 3.033) 3.865 7.201 ( -4.047 -0.000 7.171) 8.234 7.224 ( -2.365 -0.000 -1.085) 2.602 7.275 ( 0.272 0.000 9.502) 9.506 7.415 ( -1.427 -0.000 -1.820) 2.313 7.753 ( 2.695 0.000 -6.324) 6.875 8.396 ( 5.178 0.000 0.891) 5.254 8.738 ( -10.430 -0.000 -5.010) 11.571 8.902 ( -2.168 -0.000 12.188) 12.380 9.028 ( -2.448 -0.000 20.377) 20.523 9.303 ( 0.337 0.000 7.710) 7.718 9.509 ( 3.056 0.000 -2.777) 4.129 9.568 ( 3.172 0.000 -10.935) 11.386 10.089 ( 0.523 0.000 -4.146) 4.179 10.123 ( -4.810 -0.000 -7.743) 9.115 10.258 ( -2.517 -0.000 -22.185) 22.327 10.990 ( -1.907 -0.000 2.170) 2.888 11.038 ( 7.904 0.000 -2.288) 8.228 11.462 ( 3.867 0.000 8.425) 9.270 11.508 ( 2.787 0.000 -4.704) 5.468 11.642 ( 5.109 0.000 -0.384) 5.124 11.742 ( -10.436 -0.000 -0.012) 10.436 11.919 ( 3.113 0.000 -1.132) 3.312 12.075 ( -3.519 -0.000 -6.193) 7.123 12.149 ( -2.193 -0.000 2.493) 3.321 12.273 ( -4.391 -0.000 -12.606) 13.349 12.308 ( -3.303 -0.000 3.663) 4.933 12.518 ( -3.502 -0.000 -0.498) 3.538 13.047 ( 8.346 0.000 8.611) 11.992 13.470 ( -4.539 -0.000 -4.342) 6.282 14.858 ( -3.265 -0.000 2.004) 3.831 14.886 ( 2.665 0.000 -0.078) 2.666 15.100 ( -4.218 -0.000 7.945) 8.995 15.201 ( 1.064 0.000 1.682) 1.990 15.462 ( -3.510 -0.000 -5.727) 6.717 15.502 ( 4.774 0.000 -9.407) 10.549 15.702 ( 1.000 0.000 4.306) 4.420 15.780 ( 4.302 0.000 -0.533) 4.335 16.044 ( 5.101 0.000 0.868) 5.174 16.130 ( -3.908 -0.000 3.707) 5.386 16.361 ( 1.531 0.000 1.696) 2.284 16.426 ( -4.233 -0.000 2.568) 4.951 17.727 ( 4.147 0.000 4.990) 6.488 17.816 ( 12.514 0.000 0.124) 12.514 17.910 ( -12.351 -0.000 8.470) 14.976 18.050 ( 2.486 0.000 -3.267) 4.105 25.716 ( 1.160 0.000 0.685) 1.347 25.745 ( 1.577 0.000 -1.476) 2.160 25.819 ( -2.610 -0.000 0.889) 2.757 25.880 ( -2.501 -0.000 -0.246) 2.513 26.053 ( -2.451 -0.000 -1.643) 2.950 26.243 ( 1.060 0.000 -3.857) 4.000 26.599 ( -1.834 -0.000 -0.176) 1.843 26.646 ( -0.431 -0.000 0.327) 0.541 26.982 ( -2.533 -0.000 0.319) 2.553 27.423 ( -5.762 -0.000 -17.013) 17.962 28.075 ( -4.541 -0.000 14.324) 15.027 28.281 ( 9.431 0.000 3.129) 9.937 28.306 ( 0.034 0.000 3.127) 3.127 28.424 ( 0.025 0.000 -0.701) 0.701 29.648 ( -1.100 -0.000 19.623) 19.654 30.663 ( 11.529 0.000 -19.359) 22.532 ======================= Grid point 207 (102/140) ======================= q-point: (-0.44 -0.56 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 7.23e-05 7.23e-05 7.23e-05 7.23e-05 7.23e-05 7.23e-05 7.23e-05 7.23e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 244 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.190 ( 2.819 -15.287 0.090) 15.545 1.501 ( -1.761 -20.004 -11.920) 23.353 1.775 ( 12.349 -6.053 2.231) 13.933 1.999 ( -2.209 -13.127 3.338) 13.724 2.166 ( -12.983 -7.414 -9.138) 17.523 2.215 ( -11.308 -3.990 -0.849) 12.021 2.457 ( 4.508 1.633 -2.663) 5.485 2.480 ( -1.322 -3.122 -1.075) 3.557 2.783 ( 3.788 -6.186 9.066) 11.611 2.974 ( -3.742 3.224 -1.939) 5.306 3.113 ( 8.785 -1.748 -2.163) 9.215 3.149 ( -5.296 2.766 -4.578) 7.527 3.331 ( 0.775 -0.052 9.823) 9.853 3.566 ( 4.539 5.462 -3.565) 7.947 3.714 ( -11.838 -7.455 1.640) 14.085 3.859 ( 0.826 -3.310 -0.472) 3.444 3.990 ( 2.734 -6.810 -1.165) 7.430 4.139 ( -0.402 -6.622 -6.841) 9.529 4.186 ( -2.035 7.069 4.041) 8.393 4.346 ( 3.171 0.142 0.835) 3.282 4.618 ( -3.647 -2.050 -0.759) 4.252 4.651 ( 7.074 2.014 -5.467) 9.164 4.862 ( 1.036 -0.109 3.588) 3.736 5.018 ( -3.504 2.565 -3.323) 5.468 5.292 ( 1.385 -1.567 7.068) 7.371 5.533 ( -0.995 1.659 0.537) 2.007 5.587 ( 2.787 2.925 1.310) 4.247 5.851 ( -0.230 0.031 -13.927) 13.929 6.108 ( 3.650 2.143 5.368) 6.836 6.311 ( 2.074 0.836 11.152) 11.374 6.337 ( -3.332 2.515 -6.730) 7.920 6.535 ( -0.957 4.594 0.890) 4.776 6.586 ( 5.851 -1.008 -2.434) 6.416 6.647 ( -6.636 -0.324 0.144) 6.646 7.031 ( -0.218 -0.199 3.524) 3.536 7.164 ( -7.019 3.276 0.590) 7.768 7.187 ( -2.375 2.408 5.423) 6.391 7.305 ( 7.952 0.895 7.288) 10.823 7.477 ( 0.643 -4.316 -2.387) 4.973 7.697 ( -0.526 3.379 -7.127) 7.905 8.533 ( 6.826 -7.481 2.495) 10.430 8.685 ( -7.572 -6.255 -4.274) 10.711 9.000 ( -2.093 -5.556 11.095) 12.584 9.138 ( -2.215 -3.553 20.475) 20.899 9.352 ( -2.753 -3.376 7.348) 8.542 9.404 ( 3.611 5.026 -2.953) 6.857 9.717 ( 3.942 -9.058 -8.794) 13.225 9.977 ( -3.569 5.606 -2.356) 7.050 10.106 ( 0.177 -1.131 -6.860) 6.955 10.217 ( 2.597 -9.185 -23.676) 25.528 10.979 ( -1.601 -0.482 2.443) 2.961 11.119 ( 2.618 -4.191 -2.961) 5.760 11.491 ( -5.018 -0.646 -2.078) 5.469 11.512 ( 2.920 -0.583 -2.663) 3.995 11.633 ( -0.245 2.403 5.205) 5.738 11.747 ( 0.104 -2.817 6.231) 6.840 11.929 ( 5.953 2.841 0.036) 6.596 11.995 ( -7.447 -0.090 -10.424) 12.811 12.152 ( -6.328 -3.389 -3.657) 8.056 12.223 ( 3.603 -1.657 -3.745) 5.454 12.336 ( -0.394 -1.835 4.522) 4.896 12.511 ( -0.280 -0.887 -1.196) 1.515 13.086 ( 6.960 6.877 7.181) 12.137 13.341 ( -4.752 8.030 -5.488) 10.825 14.813 ( -4.560 2.887 2.843) 6.100 14.903 ( 2.754 1.200 1.515) 3.365 15.092 ( 1.781 1.347 2.951) 3.701 15.259 ( -1.169 -3.594 2.611) 4.594 15.323 ( -1.231 7.692 -5.033) 9.274 15.522 ( 2.686 -1.731 -7.667) 8.307 15.680 ( 0.246 3.076 3.321) 4.533 15.826 ( 2.518 -0.071 -2.985) 3.905 16.030 ( 0.768 3.533 4.099) 5.466 16.134 ( 0.127 -0.024 0.886) 0.895 16.373 ( -0.232 -0.278 4.515) 4.530 16.473 ( -2.790 -5.855 0.376) 6.497 17.739 ( -8.170 5.874 4.671) 11.094 17.814 ( 1.492 1.271 5.895) 6.212 17.880 ( 6.523 3.753 0.939) 7.584 18.048 ( 3.919 1.928 -3.352) 5.505 25.744 ( 0.733 -1.892 0.368) 2.062 25.762 ( 1.014 -1.502 -0.891) 2.020 25.812 ( -2.174 -0.772 1.522) 2.764 25.870 ( -2.013 -0.962 -0.475) 2.281 26.025 ( -1.913 0.764 0.283) 2.079 26.233 ( 1.667 -0.399 -6.020) 6.259 26.582 ( -1.347 0.224 0.689) 1.529 26.658 ( -1.298 -1.794 -1.618) 2.742 26.962 ( -1.499 0.633 3.586) 3.938 27.329 ( -3.768 -1.405 -13.340) 13.933 28.132 ( -3.441 -2.668 11.038) 11.866 28.324 ( 4.296 -1.829 5.674) 7.349 28.405 ( 4.321 -3.470 -2.776) 6.198 28.457 ( 0.592 -4.394 1.175) 4.587 29.689 ( -3.960 4.155 18.969) 19.818 30.547 ( 8.883 11.705 -19.985) 24.805 ======================= Grid point 208 (103/140) ======================= q-point: (-0.33 -0.56 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 7.23e-05 7.23e-05 7.23e-05 7.23e-05 7.23e-05 7.23e-05 7.23e-05 7.23e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 244 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.529 ( -1.270 -19.771 3.085) 20.051 1.702 ( -3.971 -15.593 -9.048) 18.460 2.009 ( -0.567 -8.427 3.290) 9.064 2.109 ( -17.513 -9.281 -3.055) 20.054 2.197 ( 1.790 -1.109 0.011) 2.106 2.332 ( 5.560 -13.528 4.731) 15.372 2.502 ( -0.673 -6.048 -0.699) 6.125 2.586 ( 0.839 -12.685 -5.425) 13.822 2.881 ( -0.485 1.612 -1.371) 2.171 2.963 ( 0.149 -5.430 2.216) 5.867 3.067 ( 1.609 0.945 0.535) 1.941 3.224 ( 8.104 -3.214 -3.181) 9.280 3.400 ( -0.243 -4.056 3.967) 5.679 3.492 ( 3.029 4.258 -0.807) 5.287 3.792 ( -11.651 -9.861 4.212) 15.834 3.894 ( 1.128 2.048 5.979) 6.420 4.050 ( -5.617 5.744 7.736) 11.154 4.122 ( 0.544 -6.405 -9.192) 11.217 4.194 ( 3.804 0.046 -6.553) 7.578 4.392 ( 6.198 -4.965 -5.975) 9.938 4.574 ( -7.720 -0.069 -4.764) 9.072 4.659 ( 3.579 1.312 4.524) 5.916 4.899 ( -2.997 1.822 -4.144) 5.429 4.939 ( 5.821 0.109 -0.002) 5.822 5.396 ( 3.003 -3.184 8.874) 9.895 5.492 ( -0.010 1.529 0.411) 1.584 5.547 ( 1.680 3.956 0.470) 4.324 5.775 ( -0.770 0.107 -13.009) 13.032 6.143 ( 3.914 0.515 5.308) 6.615 6.209 ( -7.027 4.069 -2.886) 8.618 6.362 ( 0.355 0.993 6.377) 6.464 6.454 ( -1.476 4.049 -1.236) 4.483 6.585 ( -6.617 1.017 0.131) 6.696 6.683 ( 9.303 -2.554 1.498) 9.763 7.019 ( -2.149 2.835 4.622) 5.833 7.093 ( -0.630 0.731 3.876) 3.995 7.145 ( -1.590 2.781 2.379) 3.990 7.400 ( 6.481 -0.002 6.707) 9.327 7.492 ( 0.916 0.737 -6.083) 6.196 7.588 ( -3.331 2.790 -7.052) 8.283 8.699 ( 1.585 -6.520 3.556) 7.594 8.798 ( 1.380 -10.548 -3.246) 11.122 9.132 ( -0.707 -4.791 8.117) 9.452 9.272 ( -3.788 -4.399 5.668) 8.113 9.391 ( -0.085 -2.321 9.496) 9.776 9.471 ( 2.593 -5.079 6.154) 8.390 9.782 ( -3.477 -4.648 -4.770) 7.513 9.852 ( -6.659 3.169 -0.686) 7.407 10.095 ( 1.572 -1.167 -6.781) 7.058 10.377 ( 14.534 -12.211 -18.966) 26.834 11.000 ( -3.751 -2.187 2.464) 4.992 11.157 ( -0.743 -1.441 -4.951) 5.210 11.426 ( -9.837 -1.368 -2.433) 10.225 11.526 ( 2.353 -0.283 -1.898) 3.036 11.677 ( 2.798 -1.585 6.695) 7.427 11.793 ( -2.434 0.587 1.646) 2.996 11.895 ( 2.052 4.223 -1.836) 5.042 11.927 ( 3.627 0.157 -4.458) 5.749 12.133 ( -8.628 -2.775 -0.852) 9.104 12.307 ( 7.310 -3.500 -1.971) 8.341 12.414 ( 1.238 -4.076 4.632) 6.293 12.533 ( 0.188 -3.328 -2.656) 4.262 13.013 ( 4.320 10.556 4.850) 12.394 13.100 ( -2.445 11.792 -5.485) 13.233 14.739 ( -5.036 2.301 3.781) 6.705 14.905 ( 2.274 2.182 2.332) 3.920 15.113 ( 5.742 0.545 -2.519) 6.293 15.143 ( -0.624 7.146 -4.073) 8.249 15.349 ( -3.107 -5.251 3.879) 7.230 15.512 ( 1.377 1.059 -3.948) 4.314 15.663 ( -0.447 0.565 1.225) 1.421 15.780 ( 0.228 3.097 -4.945) 5.839 15.995 ( -3.402 2.357 3.513) 5.429 16.144 ( 6.152 1.837 0.548) 6.444 16.410 ( -1.898 -1.337 7.369) 7.726 16.548 ( -1.347 -5.171 -1.885) 5.666 17.532 ( -12.128 9.734 4.736) 16.256 17.779 ( -1.560 8.191 3.940) 9.223 17.895 ( 11.498 3.123 0.544) 11.927 18.020 ( 1.558 0.614 -4.936) 5.212 25.784 ( -1.541 -2.839 -0.555) 3.278 25.800 ( 0.867 -2.165 1.336) 2.688 25.831 ( -0.696 -1.505 2.441) 2.951 25.873 ( -1.136 -0.945 -0.277) 1.504 26.003 ( -1.486 0.833 1.405) 2.208 26.227 ( 3.956 -0.543 -8.243) 9.159 26.584 ( -0.278 -0.381 2.274) 2.322 26.656 ( -2.044 -1.192 -3.990) 4.639 26.994 ( 0.201 -1.275 8.959) 9.051 27.266 ( -2.678 -0.895 -10.100) 10.487 28.199 ( -3.100 -2.546 7.666) 8.652 28.454 ( 4.185 -5.010 -3.402) 7.361 28.494 ( 4.592 -6.408 4.699) 9.178 28.568 ( 0.864 -7.470 -0.948) 7.580 29.636 ( -5.272 7.763 15.430) 18.060 30.230 ( 2.997 19.423 -18.072) 26.699 ======================= Grid point 209 (104/140) ======================= q-point: (-0.22 -0.56 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 7.23e-05 7.23e-05 7.23e-05 7.23e-05 7.23e-05 7.23e-05 7.23e-05 7.23e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 244 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.807 ( -2.991 -13.569 6.240) 15.232 1.893 ( -6.484 -11.106 1.657) 12.967 1.947 ( -9.825 1.751 -0.290) 9.984 2.200 ( -6.362 -12.523 -0.269) 14.049 2.372 ( 6.942 -8.745 -3.532) 11.711 2.512 ( 6.085 -3.332 -2.140) 7.260 2.661 ( -1.016 -11.172 2.669) 11.531 2.756 ( 1.434 -6.226 -6.641) 9.215 2.885 ( 1.708 -3.265 4.785) 6.039 3.051 ( 0.379 -6.076 -4.970) 7.859 3.118 ( -0.516 -2.856 2.630) 3.917 3.270 ( 5.537 2.933 -0.556) 6.290 3.468 ( 0.410 -0.825 -0.566) 1.081 3.534 ( 3.232 -7.046 1.027) 7.819 3.807 ( -4.379 7.237 5.468) 10.072 3.894 ( -8.547 -4.174 5.132) 10.808 3.961 ( 2.842 4.620 0.503) 5.447 4.109 ( 1.053 -0.996 -0.304) 1.482 4.281 ( 3.600 -7.057 -4.672) 9.197 4.484 ( 7.482 -0.677 -9.226) 11.897 4.528 ( -8.098 -4.828 2.450) 9.741 4.656 ( -3.400 2.715 4.132) 6.001 4.822 ( -3.678 -1.307 -5.730) 6.933 4.974 ( 6.854 3.232 -2.317) 7.924 5.468 ( 0.297 -0.405 -1.321) 1.414 5.511 ( 6.813 2.045 2.008) 7.391 5.557 ( 2.037 -3.331 6.801) 7.842 5.725 ( -0.140 -1.731 -8.601) 8.775 6.052 ( -9.523 4.790 -2.456) 10.940 6.189 ( 1.804 0.082 3.799) 4.207 6.336 ( -1.338 4.810 0.814) 5.059 6.394 ( -1.937 0.002 1.420) 2.402 6.515 ( -6.679 0.852 0.312) 6.740 6.777 ( 5.179 -1.395 -1.356) 5.533 6.980 ( 0.815 4.906 4.931) 7.004 7.102 ( -3.151 0.117 -1.688) 3.577 7.159 ( 8.906 0.280 9.194) 12.803 7.418 ( 1.447 4.208 -5.556) 7.118 7.459 ( 0.468 0.281 7.103) 7.124 7.519 ( -0.786 -1.296 -7.107) 7.267 8.829 ( 2.102 -4.624 4.709) 6.926 8.962 ( 4.255 -7.585 -3.549) 9.394 9.179 ( -3.789 0.510 2.589) 4.618 9.313 ( -1.874 -3.509 -1.723) 4.335 9.464 ( -4.615 -1.249 3.131) 5.715 9.588 ( 0.968 -3.533 4.416) 5.737 9.799 ( -6.402 -3.319 3.371) 7.960 9.860 ( -2.532 -7.285 6.636) 10.175 10.107 ( 2.472 -1.719 -5.641) 6.394 10.593 ( 15.495 -7.882 -12.195) 21.236 10.962 ( -8.834 1.170 -2.741) 9.323 11.156 ( 1.311 -0.330 1.907) 2.338 11.368 ( -10.158 -2.275 -3.120) 10.867 11.543 ( 1.899 0.866 -2.002) 2.892 11.704 ( 4.218 4.769 5.557) 8.451 11.785 ( 0.545 -0.628 -2.639) 2.766 11.829 ( -1.419 0.465 -1.716) 2.275 11.959 ( 5.100 -1.028 -4.245) 6.715 12.111 ( -5.738 -0.746 4.019) 7.045 12.385 ( 4.520 0.408 0.631) 4.582 12.486 ( 1.273 0.423 2.408) 2.757 12.591 ( 5.868 1.019 -3.111) 6.719 12.822 ( -5.975 4.270 -2.588) 7.786 13.012 ( 5.631 0.484 1.506) 5.849 14.727 ( -2.523 -2.750 3.690) 5.248 14.877 ( 0.335 2.942 -0.381) 2.985 15.040 ( 0.428 3.471 0.696) 3.566 15.140 ( 5.980 0.419 -4.452) 7.467 15.429 ( -1.898 -4.676 2.347) 5.565 15.495 ( -0.868 -0.498 -0.195) 1.020 15.634 ( -2.850 2.071 -0.597) 3.573 15.706 ( -0.642 3.314 -2.789) 4.379 15.941 ( -2.604 1.618 -0.125) 3.068 16.167 ( 7.309 2.202 0.630) 7.660 16.449 ( -3.011 -0.636 8.637) 9.169 16.608 ( 0.518 -4.013 -3.247) 5.188 17.297 ( -11.094 9.941 4.422) 15.539 17.609 ( -0.530 10.740 0.901) 10.790 17.902 ( 3.983 3.316 -0.436) 5.201 18.026 ( 3.249 -1.469 -4.476) 5.723 25.807 ( -2.396 -1.732 0.620) 3.020 25.848 ( 0.369 -0.150 2.705) 2.734 25.862 ( -0.961 -3.027 -0.440) 3.206 25.886 ( -0.856 -1.612 1.839) 2.591 25.988 ( -0.703 0.662 1.046) 1.424 26.236 ( 6.754 -0.466 -7.854) 10.369 26.602 ( -1.021 -0.425 1.778) 2.093 26.640 ( -0.520 -0.514 -1.711) 1.861 27.084 ( 1.632 -2.468 11.120) 11.507 27.219 ( -1.151 -0.564 -7.900) 8.003 28.237 ( -4.841 -1.543 5.563) 7.534 28.530 ( 4.293 -3.704 -7.503) 9.405 28.636 ( -0.800 -5.832 0.323) 5.896 28.764 ( 7.167 -11.981 0.361) 13.966 29.508 ( -5.550 9.968 11.228) 16.007 29.822 ( -2.212 18.991 -11.911) 22.527 ======================= Grid point 210 (105/140) ======================= q-point: (-0.11 -0.56 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 7.23e-05 7.23e-05 7.23e-05 7.23e-05 7.23e-05 7.23e-05 7.23e-05 7.23e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 244 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.840 ( -6.328 2.540 7.657) 10.253 1.978 ( -6.865 -6.821 2.606) 10.023 2.062 ( 1.754 -7.513 6.995) 10.414 2.344 ( 0.944 -5.634 -1.309) 5.860 2.482 ( 3.704 -5.290 -11.779) 13.433 2.602 ( 2.286 -3.099 1.460) 4.118 2.790 ( -1.202 -5.023 -3.433) 6.201 2.820 ( 3.040 -3.265 2.225) 4.985 2.983 ( -0.717 -3.403 2.296) 4.167 3.068 ( -1.737 2.879 -10.101) 10.646 3.170 ( -0.696 -2.200 -1.247) 2.623 3.244 ( 2.403 0.022 3.304) 4.086 3.482 ( 0.196 -1.155 0.285) 1.206 3.589 ( -6.388 5.194 2.229) 8.529 3.681 ( 1.298 2.939 0.747) 3.298 3.892 ( -6.820 -1.993 4.765) 8.555 4.017 ( 9.604 -0.998 2.651) 10.013 4.177 ( 4.361 -1.549 6.784) 8.212 4.388 ( -0.290 -7.374 -6.162) 9.614 4.451 ( 3.056 3.650 -4.570) 6.599 4.557 ( -3.073 2.718 2.003) 4.566 4.649 ( -2.316 -7.223 6.545) 10.019 4.819 ( -2.671 -3.659 -8.740) 9.844 4.934 ( 5.315 4.512 -2.388) 7.370 5.444 ( 0.625 0.197 -7.728) 7.756 5.503 ( 2.553 6.289 0.723) 6.826 5.643 ( 1.722 -3.077 2.713) 4.449 5.788 ( 3.051 -4.174 3.599) 6.299 5.901 ( -7.660 3.327 -2.358) 8.678 6.172 ( 2.195 5.179 0.639) 5.661 6.264 ( -5.327 -0.272 -1.018) 5.430 6.387 ( 2.247 1.468 -0.365) 2.709 6.484 ( -8.184 -2.749 4.022) 9.525 6.813 ( 4.477 -0.037 -2.805) 5.284 6.901 ( 1.116 6.867 2.604) 7.428 7.062 ( -5.996 -0.728 -4.140) 7.322 7.227 ( 5.781 5.862 9.326) 12.440 7.362 ( 3.706 0.414 -3.280) 4.966 7.518 ( 3.292 -0.578 6.323) 7.152 7.545 ( -0.004 -6.126 -3.181) 6.903 8.915 ( -1.343 -1.562 5.043) 5.447 9.068 ( 3.704 -1.765 -3.272) 5.247 9.129 ( -3.325 -0.791 -2.093) 4.007 9.310 ( -3.183 0.625 -2.857) 4.323 9.419 ( -5.585 0.630 -1.230) 5.753 9.662 ( 1.315 -1.273 5.582) 5.874 9.828 ( -5.899 -1.753 0.846) 6.212 10.021 ( -0.838 -6.764 12.319) 14.079 10.122 ( 1.539 -1.250 -5.132) 5.502 10.747 ( 4.451 -4.704 -5.063) 8.220 10.886 ( 2.179 -1.485 -5.282) 5.903 11.164 ( -2.108 2.071 3.540) 4.611 11.313 ( -2.789 -0.266 -7.935) 8.415 11.501 ( -3.478 0.719 2.556) 4.376 11.632 ( 1.435 7.828 -0.268) 7.963 11.815 ( 3.232 -1.874 3.628) 5.208 11.882 ( 1.125 -4.743 -1.868) 5.221 11.975 ( 1.839 -1.174 -4.074) 4.622 12.119 ( 0.541 -0.228 5.568) 5.599 12.351 ( -0.387 4.897 -0.718) 4.965 12.423 ( 2.191 10.051 -0.366) 10.294 12.522 ( 10.154 4.537 -4.771) 12.102 12.869 ( -7.729 -10.668 -0.208) 13.176 13.124 ( 0.999 -7.815 1.440) 8.009 14.805 ( 0.121 -1.248 -0.018) 1.254 14.846 ( 0.081 -3.087 2.412) 3.919 15.013 ( 0.246 1.102 1.919) 2.227 15.147 ( 5.137 1.850 -2.502) 6.006 15.488 ( -0.641 -2.142 -1.899) 2.933 15.506 ( -1.080 -0.148 2.989) 3.182 15.566 ( -4.967 0.489 -0.465) 5.013 15.637 ( 0.261 2.478 -1.729) 3.033 15.901 ( -1.263 1.286 -1.556) 2.381 16.188 ( 3.754 0.849 0.516) 3.883 16.461 ( -3.560 1.129 7.828) 8.674 16.664 ( 2.061 -3.560 -3.377) 5.322 17.086 ( -7.796 8.318 4.820) 12.377 17.472 ( 1.717 5.098 -1.424) 5.565 17.859 ( -0.364 2.742 -1.048) 2.958 18.055 ( 3.759 -0.794 -3.610) 5.272 25.811 ( -1.907 -0.240 1.490) 2.432 25.839 ( 0.109 1.467 0.246) 1.491 25.908 ( -0.740 -2.567 0.610) 2.740 25.925 ( -2.403 -3.325 1.289) 4.301 25.977 ( -0.061 0.874 0.488) 1.003 26.271 ( 7.564 -0.780 -5.278) 9.257 26.590 ( -1.545 0.518 0.447) 1.690 26.650 ( 0.930 0.722 2.664) 2.913 27.167 ( -2.312 -2.847 -7.800) 8.619 27.226 ( 4.750 -1.151 11.608) 12.594 28.225 ( -6.925 -0.025 2.572) 7.387 28.543 ( 0.608 0.448 -7.825) 7.862 28.703 ( -1.812 -4.171 -3.895) 5.988 29.031 ( 7.776 -11.819 -2.843) 14.431 29.339 ( -4.156 9.711 6.312) 12.305 29.512 ( -0.341 11.102 -0.459) 11.117 ======================= Grid point 216 (106/140) ======================= q-point: (-0.44 -0.44 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 7.23e-05 7.23e-05 7.23e-05 7.23e-05 7.23e-05 7.23e-05 7.23e-05 7.23e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 140 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.141 ( 5.704 0.000 -0.709) 5.748 1.192 ( -5.132 -0.000 -8.234) 9.703 1.838 ( -9.286 -0.000 -0.739) 9.315 1.883 ( 15.605 0.000 9.171) 18.100 1.949 ( -17.309 -0.000 -7.960) 19.052 2.021 ( -3.300 -0.000 -6.516) 7.304 2.453 ( -2.910 -0.000 0.354) 2.931 2.498 ( -0.445 -0.000 -0.511) 0.678 2.806 ( 0.352 0.000 10.537) 10.542 2.986 ( -5.996 -0.000 0.705) 6.037 3.048 ( -1.891 -0.000 -8.764) 8.966 3.173 ( 6.209 0.000 -0.892) 6.273 3.397 ( 1.082 0.000 8.895) 8.961 3.529 ( -7.943 -0.000 -2.433) 8.307 3.726 ( 7.889 0.000 2.519) 8.282 3.764 ( 0.360 0.000 -9.328) 9.335 3.956 ( 2.509 0.000 1.985) 3.199 4.041 ( -1.240 -0.000 -4.121) 4.303 4.276 ( -0.685 -0.000 1.498) 1.647 4.364 ( -0.727 -0.000 5.448) 5.496 4.528 ( -4.105 -0.000 -5.279) 6.687 4.769 ( 15.521 0.000 -3.849) 15.991 4.876 ( -2.952 -0.000 7.462) 8.024 5.006 ( -2.496 -0.000 -2.430) 3.483 5.322 ( 0.231 0.000 8.274) 8.277 5.524 ( -2.251 -0.000 -1.198) 2.550 5.654 ( 3.856 0.000 0.475) 3.885 5.773 ( -1.924 -0.000 -13.560) 13.696 6.174 ( 2.895 0.000 3.147) 4.276 6.287 ( -4.945 -0.000 -5.966) 7.749 6.371 ( -1.381 -0.000 8.510) 8.621 6.562 ( -0.281 -0.000 -6.542) 6.548 6.572 ( -3.013 -0.000 2.969) 4.230 6.649 ( 4.757 0.000 1.669) 5.041 7.036 ( -3.821 -0.000 5.564) 6.750 7.124 ( -6.728 -0.000 -1.788) 6.962 7.274 ( 7.182 0.000 5.218) 8.878 7.418 ( 2.197 0.000 10.389) 10.619 7.424 ( 4.643 0.000 -3.118) 5.593 7.685 ( -1.214 -0.000 -9.315) 9.394 8.539 ( -7.691 -0.000 -5.609) 9.519 8.554 ( 11.129 0.000 3.861) 11.780 8.994 ( -1.976 -0.000 13.168) 13.315 9.171 ( -4.096 -0.000 16.462) 16.964 9.317 ( -4.633 -0.000 5.112) 6.899 9.520 ( 1.276 0.000 -2.507) 2.813 9.609 ( 11.522 0.000 -4.931) 12.533 10.007 ( -2.481 -0.000 -3.758) 4.503 10.022 ( 1.125 0.000 -23.313) 23.340 10.052 ( 0.721 0.000 -4.119) 4.182 10.945 ( -6.600 -0.000 1.545) 6.778 11.095 ( 2.227 0.000 -2.382) 3.261 11.401 ( -10.295 -0.000 -3.205) 10.783 11.531 ( 4.494 0.000 -1.376) 4.700 11.711 ( -4.235 -0.000 9.623) 10.514 11.724 ( 1.762 0.000 3.609) 4.016 11.883 ( -5.556 -0.000 -9.409) 10.927 12.016 ( 7.799 0.000 1.192) 7.890 12.060 ( -4.403 -0.000 -5.547) 7.082 12.207 ( 4.830 0.000 -5.099) 7.023 12.363 ( 1.950 0.000 7.421) 7.673 12.508 ( 1.794 0.000 -2.081) 2.748 13.224 ( 4.173 0.000 7.078) 8.217 13.345 ( -4.209 -0.000 -6.455) 7.706 14.823 ( -2.964 -0.000 1.625) 3.380 14.947 ( 4.484 0.000 0.187) 4.488 15.157 ( 1.022 0.000 7.519) 7.588 15.186 ( -6.184 -0.000 3.412) 7.063 15.413 ( 5.703 0.000 -7.307) 9.269 15.456 ( 0.968 0.000 -8.325) 8.381 15.747 ( -0.430 -0.000 3.044) 3.074 15.825 ( 2.771 0.000 -1.451) 3.128 16.082 ( -4.751 -0.000 1.341) 4.936 16.128 ( 4.203 0.000 1.146) 4.356 16.374 ( -5.298 -0.000 2.158) 5.721 16.412 ( 2.449 0.000 2.313) 3.369 17.734 ( -14.539 -0.000 4.798) 15.310 17.850 ( 1.299 0.000 5.253) 5.411 17.915 ( 1.699 0.000 -3.470) 3.864 18.159 ( 14.201 0.000 -0.225) 14.203 25.727 ( -0.705 -0.000 -0.735) 1.018 25.746 ( 0.016 0.000 -1.248) 1.248 25.807 ( -0.359 -0.000 3.509) 3.528 25.847 ( -0.781 -0.000 -0.618) 0.996 26.024 ( -1.779 -0.000 2.552) 3.111 26.208 ( 0.975 0.000 -6.401) 6.475 26.581 ( -0.932 -0.000 1.970) 2.179 26.630 ( -0.606 -0.000 -1.328) 1.459 26.966 ( -2.690 -0.000 4.474) 5.220 27.235 ( -1.357 -0.000 -11.394) 11.475 28.118 ( -5.263 -0.000 9.618) 10.964 28.359 ( 1.601 0.000 4.167) 4.464 28.392 ( 3.947 0.000 -3.721) 5.425 28.440 ( 3.793 0.000 -0.297) 3.804 29.787 ( -6.432 -0.000 21.347) 22.295 30.618 ( 9.545 0.000 -23.501) 25.366 ======================= Grid point 217 (107/140) ======================= q-point: (-0.33 -0.44 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 7.23e-05 7.23e-05 7.23e-05 7.23e-05 7.23e-05 7.23e-05 7.23e-05 7.23e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 244 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.218 ( -5.100 -15.076 0.807) 15.936 1.343 ( -0.660 -16.187 -8.094) 18.110 1.707 ( -23.678 -9.559 -12.343) 28.362 1.967 ( 1.449 -3.763 10.821) 11.548 2.113 ( -0.116 -13.277 -0.182) 13.279 2.171 ( 9.434 -12.436 7.623) 17.372 2.394 ( -6.658 0.551 -0.320) 6.688 2.471 ( -1.816 -0.460 -1.931) 2.690 2.841 ( -8.265 -2.822 5.834) 10.503 2.940 ( 0.485 0.667 -1.598) 1.798 3.035 ( -1.293 -4.666 -4.353) 6.511 3.263 ( 12.151 -0.719 -2.793) 12.489 3.438 ( 3.408 2.067 6.285) 7.443 3.479 ( -6.689 -2.145 -1.240) 7.134 3.659 ( 0.626 1.998 -1.579) 2.622 3.885 ( 1.238 -5.498 4.795) 7.399 4.009 ( -0.116 -3.242 -0.482) 3.280 4.106 ( 4.486 -7.974 -4.961) 10.408 4.197 ( -1.118 7.518 3.748) 8.475 4.370 ( -2.534 0.384 -1.049) 2.769 4.490 ( 0.178 -0.506 -7.983) 8.001 4.802 ( 4.787 5.817 6.489) 9.943 4.907 ( -0.433 2.214 -0.881) 2.422 4.960 ( 3.698 -0.966 -2.413) 4.520 5.402 ( 0.967 -3.598 10.986) 11.600 5.489 ( -1.710 0.981 -3.159) 3.723 5.648 ( 2.515 3.337 -1.588) 4.470 5.698 ( -1.820 -0.712 -10.880) 11.054 6.195 ( -2.769 2.248 -1.533) 3.882 6.200 ( -1.070 1.708 -0.210) 2.027 6.383 ( -3.863 0.110 5.499) 6.721 6.491 ( -2.175 2.921 -4.487) 5.779 6.556 ( -3.043 1.236 1.405) 3.572 6.736 ( 8.256 -2.168 2.925) 9.023 7.034 ( -5.520 0.318 5.432) 7.751 7.066 ( -3.595 -1.580 0.054) 3.927 7.282 ( 6.814 7.346 3.568) 10.636 7.476 ( 4.894 -0.583 5.973) 7.743 7.483 ( 2.908 -1.068 -2.328) 3.875 7.595 ( -1.255 3.376 -8.014) 8.786 8.541 ( -3.725 -8.608 -3.877) 10.149 8.716 ( 10.365 -5.654 3.505) 12.316 9.084 ( -1.445 -4.405 10.571) 11.542 9.213 ( -4.855 -1.379 3.824) 6.332 9.346 ( -3.189 -4.173 8.522) 10.011 9.492 ( 1.514 0.532 1.823) 2.428 9.687 ( 2.570 -0.877 -3.309) 4.281 9.891 ( -4.042 5.903 -1.999) 7.428 10.048 ( 2.425 -3.606 -7.520) 8.685 10.159 ( 13.980 -15.417 -14.046) 25.108 10.913 ( -9.028 -2.466 1.225) 9.439 11.109 ( -0.416 -1.755 -2.500) 3.082 11.320 ( -9.260 -0.780 -0.962) 9.342 11.552 ( 3.570 1.422 -0.698) 3.906 11.674 ( -6.459 -0.892 2.927) 7.147 11.768 ( -2.474 -1.810 2.044) 3.684 11.873 ( 2.698 -2.560 -1.430) 3.985 12.004 ( -6.891 -1.159 -3.143) 7.663 12.045 ( 6.093 3.920 0.791) 7.288 12.283 ( 7.925 -5.370 -2.970) 10.023 12.426 ( 4.302 -0.008 6.614) 7.890 12.508 ( 1.942 -0.078 -2.989) 3.565 13.211 ( -0.974 8.246 -3.641) 9.066 13.230 ( 0.915 6.041 2.988) 6.801 14.777 ( -3.299 3.505 3.030) 5.687 14.973 ( 3.911 1.176 1.123) 4.236 15.122 ( -1.392 1.370 0.360) 1.986 15.253 ( -2.499 -2.095 2.545) 4.137 15.307 ( 4.111 6.654 -1.885) 8.046 15.497 ( 3.788 -2.431 -6.818) 8.169 15.704 ( -1.510 3.738 3.147) 5.114 15.807 ( 0.409 2.960 -5.139) 5.944 16.024 ( -3.256 2.603 1.507) 4.433 16.190 ( 4.417 -1.643 0.225) 4.718 16.372 ( -5.503 -3.184 3.406) 7.213 16.474 ( 2.507 -3.167 1.752) 4.403 17.580 ( -15.327 5.857 3.998) 16.888 17.852 ( -2.489 2.625 3.559) 5.074 17.942 ( 3.276 -2.936 -3.406) 5.564 18.184 ( 13.450 9.890 -1.782) 16.790 25.727 ( -2.011 -1.747 -0.699) 2.754 25.757 ( -0.585 -2.293 -0.999) 2.568 25.836 ( 0.913 -0.395 4.541) 4.649 25.852 ( 0.434 -0.917 0.256) 1.046 26.016 ( -1.845 1.241 3.377) 4.044 26.203 ( 3.353 -1.719 -6.550) 7.556 26.589 ( -0.411 -0.059 2.726) 2.758 26.622 ( -0.286 -0.288 -1.366) 1.425 26.995 ( -2.022 -2.400 7.953) 8.550 27.190 ( -0.333 -1.196 -8.597) 8.686 28.149 ( -5.106 -3.203 6.372) 8.771 28.403 ( 2.164 -2.219 -1.597) 3.486 28.443 ( 2.972 -4.945 2.052) 6.123 28.488 ( 3.464 -2.749 -3.949) 5.929 29.790 ( -7.464 5.332 19.870) 21.885 30.442 ( 4.937 13.637 -24.765) 28.699 ======================= Grid point 218 (108/140) ======================= q-point: (-0.22 -0.44 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 7.23e-05 7.23e-05 7.23e-05 7.23e-05 7.23e-05 7.23e-05 7.23e-05 7.23e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 244 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.466 ( -10.505 -19.665 -1.932) 22.378 1.604 ( -5.232 -17.300 3.250) 18.364 1.804 ( -7.610 -21.945 -6.508) 24.121 1.972 ( -10.200 3.489 12.386) 16.420 2.337 ( 6.159 -6.542 2.216) 9.254 2.405 ( -7.868 -11.339 -0.669) 13.817 2.500 ( 6.705 -4.769 3.323) 8.874 2.547 ( 2.879 -15.913 -4.574) 16.805 2.862 ( -1.160 -3.287 -1.395) 3.754 2.951 ( -0.262 -3.022 -0.209) 3.041 3.111 ( -0.298 -2.351 1.671) 2.900 3.309 ( 7.686 -2.977 -7.443) 11.105 3.441 ( 2.245 3.318 2.562) 4.756 3.527 ( 0.291 -4.301 0.815) 4.388 3.671 ( -6.095 -4.977 3.903) 8.783 3.986 ( 0.779 0.765 3.877) 4.028 4.031 ( 0.233 1.771 1.057) 2.075 4.098 ( 0.120 1.527 5.708) 5.910 4.219 ( 3.341 -1.027 -1.673) 3.875 4.378 ( -1.258 -8.188 -4.153) 9.267 4.470 ( 4.751 -0.499 -9.472) 10.608 4.737 ( -3.181 6.565 6.622) 9.852 4.801 ( -3.710 4.347 -1.516) 5.912 5.040 ( 8.017 -0.632 -3.156) 8.639 5.448 ( -0.049 0.623 -3.943) 3.993 5.531 ( 0.448 -3.346 6.004) 6.888 5.610 ( 3.397 -0.897 -2.875) 4.540 5.672 ( 1.712 0.006 -2.279) 2.850 6.047 ( -8.334 5.428 -3.605) 10.579 6.196 ( -1.025 0.952 0.458) 1.472 6.373 ( -4.923 -0.187 4.176) 6.458 6.391 ( -3.435 3.656 -2.863) 5.776 6.517 ( -0.293 2.190 -0.329) 2.234 6.809 ( 4.321 0.276 0.925) 4.427 7.004 ( -7.199 -0.458 3.156) 7.873 7.155 ( 3.329 -3.303 2.366) 5.253 7.219 ( 6.554 4.418 2.897) 8.418 7.470 ( 2.455 2.444 -2.171) 4.089 7.505 ( -0.525 3.651 -0.586) 3.735 7.541 ( 6.409 0.963 1.388) 6.627 8.704 ( 1.191 -12.020 -1.416) 12.161 8.905 ( 8.097 -5.830 2.803) 10.364 9.147 ( -5.386 -0.834 -0.507) 5.474 9.231 ( -2.111 -4.606 3.429) 6.118 9.420 ( -2.927 0.166 -2.454) 3.824 9.520 ( -1.878 -5.966 3.437) 7.137 9.717 ( -3.448 -1.507 0.894) 3.867 9.805 ( -2.034 -0.345 8.543) 8.789 10.093 ( 5.983 -2.211 -2.733) 6.939 10.501 ( 19.619 -12.923 -13.162) 26.929 10.873 ( -10.373 -1.378 -1.960) 10.646 11.126 ( -2.548 -2.947 0.476) 3.925 11.270 ( -7.676 -0.482 1.016) 7.758 11.535 ( -1.567 -0.378 -2.978) 3.387 11.692 ( -1.549 -3.967 -1.398) 4.483 11.801 ( 1.532 0.174 5.573) 5.783 11.909 ( -0.460 5.881 -3.473) 6.845 11.924 ( -1.234 -2.154 -4.344) 5.003 12.072 ( 0.951 -2.783 7.036) 7.626 12.442 ( 0.089 -5.661 -2.049) 6.021 12.445 ( 5.740 0.651 1.384) 5.940 12.561 ( 5.705 -3.024 2.420) 6.896 12.988 ( 2.513 13.562 -7.441) 15.673 13.152 ( 2.883 7.587 5.844) 10.001 14.720 ( -2.467 1.716 5.081) 5.903 14.950 ( 0.878 5.536 -0.285) 5.612 15.104 ( 2.338 0.296 -3.125) 3.914 15.165 ( 1.263 3.076 -1.404) 3.609 15.363 ( 0.302 -3.226 5.075) 6.021 15.499 ( 1.077 1.280 -3.055) 3.483 15.651 ( -2.667 2.659 1.050) 3.910 15.728 ( -0.729 2.213 -4.449) 5.022 15.956 ( -2.058 2.770 -1.398) 3.723 16.237 ( 4.494 0.297 -0.566) 4.539 16.417 ( -4.468 -4.302 3.794) 7.271 16.559 ( 3.901 -2.659 1.510) 4.957 17.366 ( -13.983 7.659 3.327) 16.287 17.758 ( -6.353 7.474 4.883) 10.957 17.994 ( 1.934 -1.712 -4.229) 4.955 18.056 ( 9.386 10.478 -5.273) 15.023 25.747 ( -2.343 -2.712 -0.091) 3.585 25.796 ( -1.056 -3.281 -1.065) 3.608 25.864 ( 1.043 -0.402 1.469) 1.846 25.876 ( -1.054 0.027 4.844) 4.958 25.998 ( -0.629 0.480 0.917) 1.211 26.247 ( 7.471 -1.422 -5.677) 9.490 26.589 ( -0.992 0.019 0.755) 1.247 26.641 ( 1.207 -0.830 2.945) 3.289 27.062 ( -2.797 -3.042 1.720) 4.476 27.209 ( 5.163 -1.591 3.007) 6.183 28.184 ( -5.305 -2.574 2.779) 6.518 28.461 ( 3.005 -4.074 -4.650) 6.874 28.539 ( 1.030 -4.087 -5.189) 6.685 28.619 ( 4.710 -10.754 1.199) 11.801 29.693 ( -7.522 9.491 16.041) 20.099 30.042 ( -3.877 18.908 -19.890) 27.716 ======================= Grid point 219 (109/140) ======================= q-point: (-0.11 -0.44 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 7.23e-05 7.23e-05 7.23e-05 7.23e-05 7.23e-05 7.23e-05 7.23e-05 7.23e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 244 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.694 ( -8.976 -16.259 1.497) 18.632 1.792 ( -13.660 -7.695 10.614) 18.933 2.002 ( 2.359 -7.649 12.144) 14.545 2.132 ( 0.334 -18.433 -1.699) 18.514 2.383 ( -0.188 -2.889 -7.468) 8.010 2.584 ( -2.610 -11.525 -5.312) 12.956 2.591 ( 1.101 -1.598 1.493) 2.448 2.776 ( 6.447 -7.618 -4.083) 10.783 2.918 ( 0.580 -3.531 -1.407) 3.845 3.038 ( 0.589 -5.025 2.262) 5.542 3.119 ( 0.287 -1.328 0.439) 1.428 3.356 ( 0.585 7.966 -0.985) 8.048 3.446 ( 4.091 -6.792 -3.707) 8.753 3.575 ( -0.369 -0.441 1.663) 1.760 3.742 ( -6.704 -5.151 3.815) 9.276 3.842 ( -1.911 7.664 0.691) 7.929 4.120 ( 9.626 -0.484 6.978) 11.899 4.164 ( -1.564 -6.674 2.170) 7.190 4.249 ( 0.594 -1.559 3.779) 4.131 4.482 ( 3.709 -0.728 -5.299) 6.509 4.543 ( 2.403 -8.853 0.006) 9.173 4.617 ( -2.272 4.784 -1.580) 5.526 4.703 ( -7.054 1.262 -1.542) 7.330 5.044 ( 5.976 4.020 -3.176) 7.872 5.425 ( 1.733 0.622 -5.371) 5.678 5.529 ( -4.262 -0.199 -4.999) 6.572 5.686 ( 7.490 0.574 3.270) 8.193 5.756 ( 3.200 -6.098 5.368) 8.731 5.877 ( -8.520 4.005 -3.311) 9.980 6.168 ( -3.613 -0.351 -1.380) 3.883 6.279 ( -1.491 3.836 -3.817) 5.613 6.375 ( -6.249 -1.363 5.352) 8.340 6.481 ( 2.828 2.483 -1.025) 3.900 6.843 ( 4.848 -0.226 -0.863) 4.930 6.951 ( -10.677 -1.017 -0.517) 10.738 7.091 ( 3.938 9.396 1.737) 10.335 7.335 ( 4.314 -3.412 0.664) 5.540 7.435 ( 1.069 7.128 5.931) 9.335 7.452 ( 1.321 -1.751 -4.977) 5.439 7.597 ( 8.512 -0.031 4.342) 9.555 8.882 ( 0.362 -5.521 1.447) 5.719 9.028 ( 2.731 -2.737 -0.605) 3.914 9.122 ( -0.310 -1.487 0.427) 1.578 9.266 ( -2.878 0.107 -3.206) 4.309 9.364 ( -1.960 -1.245 -4.051) 4.669 9.613 ( -1.245 -4.456 1.070) 4.748 9.754 ( -3.365 -4.300 5.308) 7.615 9.894 ( -4.622 -6.927 6.709) 10.694 10.180 ( 8.202 0.061 2.922) 8.707 10.688 ( 3.681 -2.876 -4.990) 6.835 10.837 ( 3.835 -3.834 -6.632) 8.567 11.175 ( -4.651 -2.211 4.276) 6.694 11.200 ( -8.070 -0.498 -2.919) 8.596 11.519 ( -0.996 -0.463 -1.797) 2.107 11.754 ( -1.976 7.137 -4.224) 8.525 11.761 ( -0.277 -5.346 -1.879) 5.673 11.852 ( 1.615 -1.176 7.384) 7.650 11.913 ( -1.478 -0.663 -4.274) 4.571 12.174 ( 5.078 -1.091 5.127) 7.299 12.393 ( -2.174 2.187 -2.691) 4.093 12.534 ( 2.588 1.055 0.688) 2.878 12.656 ( -6.279 -3.544 -4.383) 8.438 12.790 ( 16.222 11.424 0.071) 19.841 13.114 ( 3.447 2.527 5.119) 6.669 14.761 ( 1.071 -4.215 5.408) 6.940 14.837 ( -2.709 4.155 -2.379) 5.501 15.100 ( 2.327 3.899 4.728) 6.555 15.179 ( 5.560 -1.944 -5.454) 8.028 15.432 ( 0.243 -2.554 0.866) 2.708 15.470 ( -3.082 -0.551 0.288) 3.144 15.580 ( -3.591 2.896 1.588) 4.879 15.670 ( -0.219 2.527 -2.920) 3.868 15.902 ( -0.021 1.101 -3.640) 3.803 16.241 ( 1.310 1.964 0.512) 2.416 16.470 ( -2.045 -2.430 3.423) 4.669 16.631 ( 4.821 -1.266 0.186) 4.988 17.157 ( -11.896 6.636 3.669) 14.108 17.576 ( -5.838 8.555 2.598) 10.678 17.916 ( 2.028 4.994 -5.593) 7.768 18.048 ( 3.587 -1.009 -3.425) 5.062 25.774 ( -2.345 -2.375 0.636) 3.397 25.831 ( -1.309 -2.383 -0.967) 2.886 25.874 ( -1.432 -0.418 1.015) 1.805 25.890 ( -0.513 -0.297 3.772) 3.818 25.998 ( 1.279 0.473 -0.200) 1.378 26.295 ( 6.938 -0.564 -4.852) 8.485 26.597 ( 0.961 -0.030 2.794) 2.955 26.678 ( 0.665 -0.225 4.139) 4.198 27.062 ( -2.982 -2.453 -8.087) 8.961 27.330 ( 9.063 0.094 13.321) 16.112 28.170 ( -6.253 -0.672 -1.457) 6.456 28.511 ( 1.929 -1.535 -5.114) 5.677 28.599 ( 0.600 -5.196 -5.292) 7.441 28.859 ( 5.397 -12.885 -2.269) 14.153 29.518 ( -7.502 11.933 8.902) 16.671 29.661 ( -5.869 11.310 -6.625) 14.362 ======================= Grid point 226 (110/140) ======================= q-point: (-0.33 -0.33 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 7.23e-05 7.23e-05 7.23e-05 7.23e-05 7.23e-05 7.23e-05 7.23e-05 7.23e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 140 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.968 ( -13.279 -0.000 -6.692) 14.870 1.202 ( 3.572 0.000 0.038) 3.573 1.348 ( -28.329 -0.000 -12.466) 30.950 1.974 ( 2.051 0.000 -1.291) 2.424 1.989 ( 2.341 0.000 11.312) 11.552 2.185 ( 5.468 0.000 9.564) 11.016 2.358 ( -19.671 -0.000 3.795) 20.033 2.434 ( 5.123 0.000 -0.060) 5.123 2.754 ( -13.256 -0.000 9.065) 16.059 2.911 ( -2.103 -0.000 -10.015) 10.233 2.971 ( 0.684 0.000 0.886) 1.120 3.295 ( 8.244 0.000 -1.661) 8.409 3.490 ( 2.122 0.000 4.453) 4.933 3.530 ( 4.576 0.000 -0.037) 4.576 3.675 ( 1.826 0.000 -7.916) 8.124 3.850 ( 1.858 0.000 7.673) 7.895 4.011 ( 0.909 0.000 0.215) 0.934 4.029 ( 6.232 0.000 -1.807) 6.489 4.297 ( -7.973 -0.000 -2.704) 8.419 4.297 ( 1.392 0.000 1.784) 2.262 4.487 ( 4.855 0.000 -6.423) 8.052 4.902 ( -3.443 -0.000 7.588) 8.333 4.943 ( -2.590 -0.000 -2.873) 3.868 4.979 ( 13.979 0.000 -1.651) 14.076 5.415 ( -2.352 -0.000 13.089) 13.299 5.467 ( -0.449 -0.000 -6.266) 6.282 5.597 ( -5.616 -0.000 -9.101) 10.694 5.699 ( 2.883 0.000 -1.865) 3.433 6.164 ( -4.727 -0.000 -3.522) 5.895 6.243 ( 3.086 0.000 3.535) 4.692 6.378 ( -3.787 -0.000 4.838) 6.144 6.451 ( -4.401 -0.000 -7.906) 9.048 6.596 ( -0.964 -0.000 6.034) 6.111 6.761 ( 5.529 0.000 0.398) 5.543 7.013 ( -6.256 -0.000 6.654) 9.133 7.025 ( -3.714 -0.000 -1.546) 4.023 7.453 ( 2.348 0.000 -5.928) 6.376 7.478 ( 11.808 0.000 2.499) 12.070 7.505 ( -2.095 -0.000 7.813) 8.089 7.586 ( 3.249 0.000 -8.152) 8.776 8.413 ( -1.683 -0.000 -4.022) 4.360 8.773 ( 10.462 0.000 3.797) 11.130 9.088 ( -1.585 -0.000 10.673) 10.790 9.174 ( -5.195 -0.000 -1.832) 5.509 9.331 ( -0.671 -0.000 7.376) 7.406 9.481 ( -1.068 -0.000 -5.638) 5.738 9.810 ( 11.215 0.000 9.826) 14.910 9.858 ( 4.718 0.000 -18.077) 18.683 9.964 ( -1.976 -0.000 1.293) 2.362 10.070 ( 5.816 0.000 -0.868) 5.881 10.818 ( -10.513 -0.000 0.872) 10.549 11.073 ( -1.597 -0.000 -2.083) 2.625 11.252 ( -7.319 -0.000 1.705) 7.515 11.584 ( -10.576 -0.000 -0.849) 10.610 11.603 ( 3.076 0.000 -3.382) 4.571 11.733 ( -3.427 -0.000 5.681) 6.634 11.875 ( 3.238 0.000 0.881) 3.356 11.952 ( -4.215 -0.000 2.379) 4.840 12.133 ( 4.487 0.000 -1.532) 4.741 12.264 ( 6.254 0.000 -2.679) 6.804 12.501 ( 1.530 0.000 -4.675) 4.919 12.517 ( 8.187 0.000 7.152) 10.871 13.241 ( 1.616 0.000 -8.215) 8.372 13.317 ( -1.539 -0.000 8.333) 8.474 14.811 ( -0.253 -0.000 1.669) 1.688 14.996 ( 2.070 0.000 -2.499) 3.245 15.126 ( -6.547 -0.000 7.161) 9.703 15.241 ( 1.381 0.000 1.722) 2.207 15.400 ( 0.118 0.000 -0.863) 0.871 15.466 ( 10.089 0.000 -8.286) 13.056 15.731 ( -3.363 -0.000 -0.903) 3.482 15.840 ( 2.756 0.000 -3.968) 4.831 16.033 ( -1.403 -0.000 -0.457) 1.475 16.188 ( 1.532 0.000 1.796) 2.360 16.304 ( -6.618 -0.000 2.370) 7.030 16.480 ( 3.599 0.000 1.987) 4.111 17.522 ( -16.930 -0.000 3.431) 17.274 17.882 ( 1.510 0.000 -6.020) 6.206 17.907 ( -0.620 -0.000 3.858) 3.907 18.383 ( 15.011 0.000 -5.031) 15.831 25.693 ( -2.263 -0.000 -0.248) 2.276 25.723 ( -1.135 -0.000 -1.012) 1.520 25.849 ( 1.178 0.000 0.173) 1.191 25.874 ( 2.961 0.000 4.550) 5.429 26.055 ( -0.345 -0.000 8.030) 8.038 26.162 ( 1.279 0.000 -5.695) 5.837 26.606 ( 0.324 0.000 3.349) 3.364 26.615 ( 0.259 0.000 -0.554) 0.612 26.997 ( -1.917 -0.000 11.442) 11.601 27.135 ( -0.190 -0.000 -7.246) 7.249 28.103 ( -5.944 -0.000 5.268) 7.942 28.398 ( 1.791 0.000 -2.615) 3.170 28.416 ( 1.354 0.000 2.038) 2.447 28.472 ( 4.273 0.000 -6.858) 8.081 29.872 ( -9.170 -0.000 20.399) 22.365 30.468 ( 4.210 0.000 -32.155) 32.430 ======================= Grid point 227 (111/140) ======================= q-point: (-0.22 -0.33 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 7.23e-05 7.23e-05 7.23e-05 7.23e-05 7.23e-05 7.23e-05 7.23e-05 7.23e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 244 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.031 ( -12.698 -19.356 0.736) 23.161 1.231 ( -20.562 -16.916 -1.932) 26.696 1.400 ( 3.428 -17.629 1.188) 17.998 1.998 ( -18.679 3.333 13.437) 23.251 2.124 ( 2.339 -12.712 -1.109) 12.973 2.293 ( -3.016 -8.222 5.656) 10.426 2.300 ( -0.780 -8.105 -1.534) 8.286 2.532 ( 8.104 -1.265 6.037) 10.185 2.737 ( -7.948 -4.921 2.622) 9.709 2.910 ( 0.831 -4.912 -5.377) 7.330 3.001 ( -1.250 -3.850 0.209) 4.053 3.389 ( 6.918 -2.508 -3.659) 8.218 3.404 ( -3.082 5.813 -0.524) 6.600 3.536 ( 2.356 1.960 1.551) 3.435 3.674 ( 3.454 0.623 0.122) 3.512 3.993 ( -0.396 -6.437 4.650) 7.950 4.012 ( 4.744 -0.393 5.786) 7.493 4.156 ( 7.480 -7.974 -5.504) 12.241 4.178 ( -4.736 4.536 -2.429) 6.993 4.312 ( 1.330 1.019 0.580) 1.773 4.474 ( 4.191 1.748 -6.449) 7.887 4.829 ( -2.557 6.184 -2.185) 7.040 4.889 ( -4.704 4.867 6.847) 9.628 5.074 ( 10.860 -0.843 -2.564) 11.191 5.424 ( -0.362 -0.644 -10.369) 10.396 5.494 ( -3.753 -2.402 6.962) 8.266 5.536 ( -3.505 -3.122 0.126) 4.696 5.706 ( 3.552 0.264 -2.315) 4.248 6.075 ( -4.524 4.886 -2.344) 7.059 6.245 ( 1.318 4.501 2.525) 5.327 6.352 ( -4.219 1.187 -2.967) 5.292 6.389 ( -3.123 0.263 1.509) 3.478 6.569 ( -0.532 3.241 3.593) 4.868 6.831 ( 0.148 -1.670 1.789) 2.452 6.966 ( -6.715 2.214 0.126) 7.072 7.057 ( -0.236 -7.375 1.947) 7.631 7.390 ( 6.251 4.682 -1.316) 7.920 7.509 ( -2.419 1.201 1.430) 3.056 7.568 ( 7.699 1.685 0.314) 7.888 7.596 ( 6.702 -0.218 -2.310) 7.092 8.503 ( 2.673 -11.101 -1.380) 11.501 8.885 ( 6.199 -3.921 1.407) 7.469 9.089 ( -5.877 0.665 -4.283) 7.303 9.162 ( -2.157 -3.707 4.821) 6.452 9.403 ( 0.183 -1.021 1.280) 1.648 9.436 ( -0.309 -2.054 -2.289) 3.091 9.734 ( 1.905 4.137 -0.420) 4.574 9.885 ( -0.293 4.921 7.274) 8.787 10.089 ( 6.602 -4.484 4.150) 8.995 10.320 ( 19.368 -19.359 -7.677) 28.440 10.756 ( -10.720 -1.610 0.423) 10.849 11.061 ( -3.212 -1.453 -0.870) 3.631 11.220 ( -5.909 -0.582 3.349) 6.817 11.481 ( -7.775 1.226 -3.666) 8.683 11.603 ( -5.485 -4.044 -4.213) 8.012 11.803 ( 2.106 -2.352 8.693) 9.248 11.901 ( 1.106 0.458 1.251) 1.732 11.946 ( -1.090 0.012 2.006) 2.283 12.118 ( 2.953 2.293 2.985) 4.784 12.342 ( 2.575 -4.532 -4.989) 7.215 12.489 ( 3.328 0.265 -1.965) 3.873 12.606 ( 4.991 0.015 4.718) 6.868 13.174 ( 8.904 7.570 -6.980) 13.613 13.304 ( -1.226 4.316 9.110) 10.155 14.784 ( -0.046 3.728 4.280) 5.676 15.019 ( 2.056 -1.758 -2.640) 3.780 15.091 ( -2.378 2.995 0.977) 3.947 15.209 ( -2.782 2.336 -0.894) 3.741 15.404 ( 3.865 1.672 6.194) 7.490 15.510 ( 5.566 0.106 -6.825) 8.807 15.682 ( -3.766 0.972 0.247) 3.897 15.754 ( 0.291 6.736 -5.267) 8.556 15.991 ( -0.423 3.566 -2.164) 4.193 16.240 ( 2.355 -2.340 -1.416) 3.609 16.306 ( -6.188 -4.867 3.298) 8.536 16.559 ( 5.397 -3.539 2.332) 6.862 17.367 ( -15.761 4.377 2.289) 16.517 17.825 ( -2.998 4.044 0.997) 5.132 17.949 ( 0.562 -2.789 -1.932) 3.439 18.308 ( 7.215 13.822 -10.823) 18.980 25.691 ( -2.187 -1.729 0.335) 2.808 25.733 ( -0.969 -2.435 -0.958) 2.790 25.867 ( 1.364 -0.539 0.670) 1.612 25.918 ( 2.342 0.456 4.561) 5.147 26.022 ( -2.184 3.867 3.631) 5.737 26.232 ( 6.019 -4.417 -3.167) 8.110 26.604 ( 0.881 0.684 1.985) 2.276 26.647 ( 0.883 -1.411 3.022) 3.450 27.017 ( -2.676 1.334 1.681) 3.430 27.225 ( 8.377 -7.797 11.040) 15.901 28.101 ( -6.150 -2.628 1.418) 6.837 28.406 ( 1.195 -1.906 -2.413) 3.299 28.476 ( 3.683 -2.077 -7.122) 8.283 28.502 ( 2.362 -6.396 -0.718) 6.856 29.841 ( -10.095 5.841 17.740) 21.230 30.167 ( -6.543 14.360 -32.334) 35.980 ======================= Grid point 228 (112/140) ======================= q-point: (-0.11 -0.33 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 7.23e-05 7.23e-05 7.23e-05 7.23e-05 7.23e-05 7.23e-05 7.23e-05 7.23e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 244 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.329 ( -8.162 -21.108 11.943) 25.589 1.510 ( -10.701 -21.959 7.243) 25.479 1.777 ( 2.157 -19.808 1.605) 19.989 1.911 ( -16.669 -7.858 15.134) 23.846 2.273 ( -1.451 -5.681 -6.088) 8.452 2.385 ( 2.528 -7.214 -5.639) 9.499 2.582 ( 5.576 -11.562 0.429) 12.844 2.605 ( -1.033 -5.563 2.025) 6.010 2.840 ( 0.516 -7.782 1.057) 7.870 2.983 ( 3.143 -2.824 1.023) 4.347 3.088 ( -2.627 -5.916 -0.035) 6.473 3.302 ( 0.617 -1.357 -5.030) 5.246 3.495 ( 1.885 4.671 -1.458) 5.244 3.501 ( -4.081 -7.288 2.843) 8.824 3.693 ( 1.696 1.011 3.873) 4.347 3.952 ( -0.797 6.035 -2.501) 6.581 4.085 ( -3.599 0.748 1.282) 3.893 4.198 ( 7.353 -4.676 8.887) 12.446 4.312 ( 8.093 -2.082 -0.981) 8.414 4.350 ( 1.796 -7.659 -3.509) 8.614 4.457 ( 1.522 -0.913 -3.012) 3.496 4.685 ( -0.061 5.981 -6.937) 9.159 4.762 ( -7.187 8.322 7.783) 13.471 5.122 ( 6.885 1.904 -3.986) 8.180 5.400 ( -1.372 -2.788 -8.175) 8.746 5.470 ( -2.441 0.877 -0.650) 2.674 5.658 ( -2.444 -8.326 3.741) 9.449 5.741 ( 6.368 -1.391 -1.559) 6.702 5.913 ( -4.725 7.989 -1.452) 9.395 6.174 ( -0.641 3.916 0.083) 3.969 6.277 ( -2.380 1.050 -5.178) 5.794 6.369 ( -3.514 1.947 5.257) 6.616 6.541 ( 1.490 2.059 1.372) 2.888 6.844 ( -10.092 -0.489 1.465) 10.209 6.862 ( -0.397 0.636 -1.815) 1.964 7.193 ( 0.307 -3.927 -1.173) 4.110 7.380 ( 8.671 4.403 3.255) 10.255 7.447 ( 0.678 3.652 -3.883) 5.373 7.575 ( 3.119 3.560 2.610) 5.405 7.663 ( 8.190 -1.445 0.936) 8.368 8.742 ( 2.906 -12.051 0.931) 12.431 9.003 ( -0.097 -2.391 -1.743) 2.960 9.039 ( -0.667 -5.999 -3.079) 6.776 9.227 ( -1.016 -2.500 -1.001) 2.878 9.336 ( 0.135 1.240 -2.991) 3.241 9.548 ( 1.295 -4.151 -0.882) 4.437 9.714 ( -1.040 -0.954 7.740) 7.868 9.857 ( -1.091 1.831 7.368) 7.670 10.238 ( 7.429 -3.103 7.011) 10.676 10.655 ( 4.424 -2.607 -4.638) 6.919 10.744 ( 7.019 -8.699 -6.520) 12.940 11.070 ( -5.413 -3.582 2.004) 6.793 11.171 ( -8.773 2.410 0.478) 9.111 11.426 ( -4.839 -4.085 -4.285) 7.646 11.633 ( -5.228 -6.090 -1.773) 8.220 11.819 ( 0.103 3.972 -1.049) 4.109 11.898 ( 0.094 1.581 5.843) 6.054 11.931 ( 1.842 2.167 -0.889) 2.980 12.200 ( 2.929 -3.001 9.101) 10.021 12.348 ( -1.219 -1.008 -9.274) 9.408 12.546 ( 3.865 -0.905 1.278) 4.170 12.612 ( -1.538 1.156 -2.286) 2.988 13.105 ( 16.288 9.431 0.460) 18.828 13.267 ( 4.551 6.581 8.332) 11.552 14.774 ( 1.994 0.781 6.568) 6.908 14.917 ( -2.747 8.839 -1.914) 9.452 15.115 ( 2.210 -4.818 -5.527) 7.658 15.187 ( 1.885 0.486 4.991) 5.357 15.429 ( 1.525 0.930 2.354) 2.955 15.466 ( -3.123 2.590 -2.212) 4.621 15.615 ( -2.629 4.023 1.359) 4.994 15.681 ( 0.886 0.380 -4.153) 4.264 15.913 ( 0.670 2.686 -4.579) 5.351 16.261 ( -1.095 -0.154 0.250) 1.134 16.386 ( -1.010 -5.953 0.441) 6.054 16.675 ( 7.918 -1.876 2.383) 8.479 17.169 ( -14.616 5.856 1.700) 15.837 17.681 ( -11.181 9.139 6.014) 15.643 17.957 ( -0.015 1.193 -7.101) 7.201 18.079 ( 2.921 5.971 -9.303) 11.434 25.716 ( -1.922 -2.672 0.724) 3.370 25.768 ( -0.999 -2.975 -0.992) 3.291 25.885 ( 0.274 0.694 1.942) 2.080 25.916 ( -1.083 2.056 5.761) 6.212 26.002 ( 0.760 -0.810 -0.518) 1.226 26.301 ( 4.933 -1.354 -5.464) 7.485 26.627 ( 2.490 -0.240 2.228) 3.350 26.697 ( 1.274 -1.038 5.430) 5.673 26.972 ( -3.215 -0.408 -5.410) 6.306 27.504 ( 17.349 -0.618 18.440) 25.326 28.089 ( -5.370 -2.128 -4.185) 7.133 28.464 ( 2.388 -4.755 -3.432) 6.332 28.505 ( 3.164 -2.666 -5.854) 7.169 28.673 ( 2.893 -11.430 -2.127) 11.980 29.672 ( -13.450 11.761 -4.451) 18.413 29.733 ( -11.831 9.566 -1.883) 15.331 ======================= Grid point 236 (113/140) ======================= q-point: (-0.22 -0.22 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 7.23e-05 7.23e-05 7.23e-05 7.23e-05 7.23e-05 7.23e-05 7.23e-05 7.23e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 140 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.725 ( -13.514 -0.000 4.763) 14.329 0.909 ( -19.739 -0.000 12.765) 23.507 1.291 ( 5.328 0.000 2.903) 6.068 1.905 ( -34.203 -0.000 17.319) 38.338 2.017 ( 2.452 0.000 0.040) 2.452 2.211 ( 2.003 0.000 -5.309) 5.674 2.234 ( 0.965 0.000 6.610) 6.680 2.636 ( 8.071 0.000 10.340) 13.117 2.656 ( -8.006 -0.000 3.493) 8.735 2.790 ( -1.184 -0.000 -9.784) 9.855 2.993 ( 0.634 0.000 2.210) 2.299 3.360 ( 0.228 0.000 0.602) 0.644 3.500 ( 0.251 0.000 -9.989) 9.992 3.539 ( 3.741 0.000 -4.123) 5.567 3.716 ( 1.193 0.000 5.302) 5.435 3.936 ( -0.148 -0.000 7.284) 7.285 4.104 ( 7.716 0.000 4.415) 8.890 4.117 ( 8.186 0.000 -2.483) 8.554 4.147 ( -3.972 -0.000 -6.981) 8.032 4.345 ( 3.187 0.000 -0.489) 3.224 4.503 ( 4.581 0.000 -4.837) 6.662 4.862 ( -2.904 -0.000 -4.890) 5.688 4.909 ( -4.584 -0.000 6.144) 7.666 5.146 ( 9.191 0.000 -1.863) 9.378 5.337 ( -2.525 -0.000 -13.054) 13.296 5.470 ( -6.405 -0.000 9.973) 11.852 5.498 ( -2.759 -0.000 1.194) 3.006 5.710 ( 2.697 0.000 -4.769) 5.479 6.088 ( -2.187 -0.000 -0.389) 2.222 6.306 ( -2.659 -0.000 -7.143) 7.622 6.371 ( -3.733 -0.000 5.102) 6.322 6.373 ( 5.024 0.000 7.750) 9.236 6.641 ( -1.573 -0.000 7.180) 7.350 6.771 ( -1.974 -0.000 -2.232) 2.980 6.952 ( -3.279 -0.000 -3.061) 4.486 6.976 ( -6.512 -0.000 6.004) 8.857 7.466 ( -6.552 -0.000 0.944) 6.620 7.466 ( 9.310 0.000 -0.849) 9.348 7.607 ( 5.296 0.000 -7.462) 9.150 7.698 ( 10.953 0.000 3.214) 11.415 8.421 ( 5.057 0.000 -0.205) 5.061 8.888 ( 1.213 0.000 -0.491) 1.308 9.012 ( -7.517 -0.000 -8.820) 11.589 9.136 ( -1.666 -0.000 3.098) 3.518 9.400 ( 0.605 0.000 3.984) 4.030 9.426 ( 2.966 0.000 -6.227) 6.897 9.828 ( 8.573 0.000 -8.749) 12.249 9.953 ( -1.273 -0.000 3.968) 4.168 10.172 ( 16.516 0.000 17.893) 24.351 10.209 ( 8.711 0.000 3.948) 9.564 10.671 ( -8.653 -0.000 1.651) 8.810 11.023 ( -1.929 -0.000 -1.608) 2.511 11.196 ( -4.871 -0.000 5.465) 7.320 11.433 ( -10.264 -0.000 -9.636) 14.079 11.459 ( -7.284 -0.000 3.925) 8.274 11.862 ( 2.895 0.000 8.612) 9.086 11.928 ( 3.564 0.000 -0.545) 3.605 11.944 ( -2.910 -0.000 6.503) 7.124 12.194 ( 5.308 0.000 6.424) 8.333 12.285 ( 0.834 0.000 -7.514) 7.560 12.508 ( 5.234 0.000 -1.424) 5.424 12.645 ( -0.568 -0.000 1.377) 1.489 13.322 ( 19.630 0.000 -4.499) 20.139 13.356 ( -5.870 -0.000 12.321) 13.648 14.858 ( 3.853 0.000 2.726) 4.720 14.965 ( -1.490 -0.000 -2.388) 2.815 15.120 ( -3.808 -0.000 5.828) 6.962 15.195 ( -2.952 -0.000 -4.308) 5.223 15.482 ( 2.945 0.000 6.122) 6.793 15.538 ( 7.979 0.000 -7.087) 10.672 15.619 ( -7.140 -0.000 -3.016) 7.751 15.847 ( 5.258 0.000 -6.378) 8.265 16.037 ( 3.407 0.000 -2.407) 4.172 16.199 ( -3.689 -0.000 -2.221) 4.306 16.231 ( -3.792 -0.000 5.888) 7.003 16.567 ( 6.032 0.000 0.966) 6.109 17.289 ( -16.050 -0.000 1.827) 16.154 17.863 ( 4.234 0.000 -6.713) 7.937 17.902 ( -4.667 -0.000 3.751) 5.988 18.400 ( -1.198 -0.000 -22.207) 22.240 25.663 ( -1.814 -0.000 0.979) 2.062 25.700 ( -0.710 -0.000 -0.566) 0.908 25.877 ( 1.379 0.000 0.865) 1.628 25.948 ( 2.258 0.000 1.033) 2.483 26.148 ( 2.394 0.000 -2.544) 3.493 26.159 ( 1.996 0.000 6.395) 6.700 26.631 ( 0.897 0.000 0.416) 0.989 26.635 ( -0.485 -0.000 1.695) 1.763 27.090 ( 1.316 0.000 -3.109) 3.376 27.265 ( 15.820 0.000 33.410) 36.966 28.036 ( -6.359 -0.000 0.739) 6.402 28.395 ( 1.502 0.000 -3.760) 4.049 28.436 ( 0.415 0.000 -0.501) 0.650 28.465 ( 5.204 0.000 -7.583) 9.197 29.889 ( -12.432 -0.000 16.503) 20.661 30.026 ( -16.667 -0.000 -43.339) 46.433 ======================= Grid point 237 (114/140) ======================= q-point: (-0.11 -0.22 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 7.23e-05 7.23e-05 7.23e-05 7.23e-05 7.23e-05 7.23e-05 7.23e-05 7.23e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 244 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.000 ( -4.833 -29.841 10.009) 31.844 1.061 ( -5.225 -15.164 26.052) 30.594 1.511 ( 4.834 -17.452 6.093) 19.107 1.714 ( -33.806 -0.995 22.587) 40.669 2.126 ( 4.317 -8.378 -9.383) 13.299 2.288 ( 3.193 -6.975 -1.621) 7.841 2.346 ( 1.341 -10.303 -3.442) 10.945 2.589 ( -5.634 -0.364 4.272) 7.079 2.760 ( 2.665 -3.493 6.876) 8.160 2.857 ( -1.471 -11.172 -4.008) 11.959 3.016 ( 0.811 -0.481 3.382) 3.511 3.335 ( -5.099 3.552 -0.629) 6.246 3.413 ( 2.054 -0.007 -5.347) 5.728 3.540 ( 2.410 1.006 -7.196) 7.656 3.744 ( 0.186 0.503 7.296) 7.316 4.004 ( -0.969 -1.037 1.644) 2.172 4.064 ( -1.936 1.462 -6.103) 6.568 4.182 ( 5.829 -2.952 2.333) 6.938 4.244 ( 8.003 -4.299 0.864) 9.125 4.374 ( 5.132 -1.443 -1.819) 5.633 4.488 ( 4.165 3.101 -2.293) 5.677 4.755 ( -1.345 5.614 -5.293) 7.832 4.859 ( -7.656 4.776 6.425) 11.077 5.196 ( 7.760 1.629 -3.249) 8.569 5.280 ( -1.820 -2.665 -8.877) 9.445 5.473 ( -3.343 0.302 1.304) 3.601 5.508 ( -5.831 -5.900 1.843) 8.498 5.725 ( 3.642 -2.540 -5.357) 6.958 6.024 ( -1.417 6.569 1.180) 6.823 6.247 ( -1.253 1.763 -5.615) 6.017 6.291 ( -1.236 6.659 4.810) 8.307 6.418 ( 0.083 1.896 4.769) 5.133 6.577 ( -2.274 2.985 3.430) 5.084 6.803 ( -6.398 0.910 6.133) 8.909 6.869 ( -2.386 2.698 -2.815) 4.572 7.068 ( 1.066 -9.227 -1.419) 9.396 7.409 ( -4.718 0.338 -2.182) 5.210 7.589 ( 8.990 1.299 -2.423) 9.401 7.615 ( 7.042 -1.695 -0.763) 7.283 7.734 ( 7.615 3.884 3.057) 9.078 8.577 ( 4.302 -10.684 1.556) 11.622 8.913 ( 0.621 -5.201 -3.376) 6.232 8.929 ( -5.150 -1.902 -6.835) 8.767 9.150 ( -2.359 -3.302 -1.892) 4.478 9.389 ( 1.815 3.685 -0.985) 4.224 9.465 ( -0.535 -5.218 0.661) 5.287 9.794 ( 5.161 5.066 3.533) 8.049 9.960 ( 2.929 2.973 4.811) 6.369 10.284 ( 5.383 -1.406 9.645) 11.135 10.577 ( 18.156 -15.412 -4.970) 24.328 10.636 ( -5.123 -1.136 2.930) 6.010 11.007 ( -2.763 -0.612 -0.055) 2.831 11.164 ( -6.184 3.263 3.042) 7.625 11.320 ( -4.190 -1.510 -4.017) 5.998 11.489 ( -6.152 -5.290 3.573) 8.866 11.862 ( -2.131 1.946 -0.218) 2.894 11.959 ( 3.102 0.002 -1.462) 3.429 11.960 ( 0.306 1.434 6.290) 6.459 12.220 ( -2.490 0.894 -0.271) 2.659 12.323 ( 8.564 -0.920 3.355) 9.244 12.577 ( 5.209 -0.782 1.037) 5.368 12.598 ( -2.772 0.888 -4.079) 5.011 13.323 ( -0.270 4.886 10.892) 11.941 13.475 ( 22.561 3.342 2.028) 22.897 14.862 ( 3.301 3.082 5.170) 6.865 15.007 ( 1.721 -2.972 -2.826) 4.448 15.046 ( -3.175 5.008 -1.572) 6.135 15.191 ( -0.406 -2.473 2.687) 3.674 15.441 ( -10.041 1.654 -4.336) 11.061 15.505 ( 2.708 4.025 0.348) 4.864 15.658 ( 3.333 -2.930 1.065) 4.564 15.736 ( 2.811 10.962 -3.132) 11.742 15.965 ( 1.204 5.268 -4.377) 6.955 16.211 ( -3.543 -3.809 -0.122) 5.204 16.298 ( 2.113 -4.694 1.439) 5.345 16.686 ( 8.806 -5.516 1.200) 10.459 17.144 ( -14.391 3.885 0.538) 14.915 17.771 ( -10.852 8.818 4.899) 14.817 17.913 ( -0.384 -1.336 -6.506) 6.653 18.113 ( -10.533 6.260 -20.230) 23.651 25.671 ( -1.298 -1.580 1.405) 2.482 25.714 ( -0.461 -2.144 -0.528) 2.256 25.896 ( 1.175 -0.562 0.975) 1.627 25.977 ( 1.186 -1.537 -0.189) 1.951 26.030 ( -1.512 7.811 6.359) 10.185 26.271 ( 3.078 -3.234 -4.395) 6.265 26.632 ( 0.047 -0.480 -1.014) 1.123 26.680 ( -0.012 -4.144 0.479) 4.172 27.008 ( 1.035 6.718 2.715) 7.319 27.771 ( 35.975 -6.290 29.900) 47.199 27.977 ( -7.757 -0.653 -5.328) 9.433 28.389 ( 1.768 -2.182 -4.687) 5.465 28.490 ( 6.051 -1.597 -3.669) 7.254 28.516 ( 1.598 -7.904 -1.948) 8.296 29.561 ( -29.707 5.921 -30.726) 43.146 29.810 ( -14.146 5.626 12.443) 19.662 ======================= Grid point 246 (115/140) ======================= q-point: (-0.11 -0.11 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 7.23e-05 7.23e-05 7.23e-05 7.23e-05 7.23e-05 7.23e-05 7.23e-05 7.23e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 140 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.734 ( -1.373 -0.000 21.491) 21.535 1.097 ( 2.301 0.000 36.859) 36.930 1.411 ( 1.747 0.000 11.800) 11.929 1.580 ( -27.506 -0.000 25.374) 37.422 2.015 ( 3.043 0.000 -7.961) 8.523 2.230 ( 5.914 0.000 -5.114) 7.818 2.264 ( 1.134 0.000 -6.296) 6.398 2.569 ( -8.871 -0.000 6.176) 10.810 2.684 ( -0.591 -0.000 -7.737) 7.760 2.805 ( 0.109 0.000 10.389) 10.390 3.041 ( 0.419 0.000 6.012) 6.026 3.301 ( -7.142 -0.000 -2.511) 7.571 3.400 ( 1.734 0.000 -12.143) 12.267 3.526 ( 3.091 0.000 -8.887) 9.409 3.783 ( -1.320 -0.000 9.439) 9.531 3.982 ( -0.874 -0.000 3.315) 3.428 4.044 ( -0.853 -0.000 -7.337) 7.387 4.240 ( 10.189 0.000 -1.796) 10.346 4.275 ( 6.300 0.000 5.093) 8.101 4.362 ( 3.286 0.000 -6.197) 7.014 4.560 ( 6.625 0.000 0.270) 6.631 4.752 ( -5.232 -0.000 -5.137) 7.333 4.869 ( -7.771 -0.000 4.890) 9.182 5.208 ( 1.950 0.000 0.515) 2.017 5.264 ( 7.212 0.000 -9.092) 11.605 5.403 ( -7.899 -0.000 1.186) 7.987 5.446 ( -5.878 -0.000 -0.726) 5.923 5.688 ( 1.943 0.000 -7.362) 7.614 6.088 ( 0.071 0.000 3.044) 3.044 6.233 ( 0.502 0.000 -3.693) 3.727 6.361 ( -4.130 -0.000 5.671) 7.016 6.432 ( -1.942 -0.000 0.605) 2.034 6.674 ( -3.360 -0.000 6.351) 7.185 6.831 ( 6.683 0.000 -1.035) 6.763 6.893 ( 3.417 0.000 -0.079) 3.418 6.933 ( -6.632 -0.000 5.983) 8.932 7.346 ( -6.313 -0.000 -2.576) 6.819 7.557 ( -0.792 -0.000 -9.492) 9.525 7.725 ( 16.540 0.000 6.145) 17.644 7.869 ( 6.737 0.000 2.878) 7.326 8.511 ( 2.622 0.000 1.467) 3.004 8.840 ( -2.161 -0.000 -4.756) 5.224 8.841 ( -2.810 -0.000 -4.986) 5.724 9.081 ( -3.706 -0.000 -5.039) 6.255 9.406 ( -1.503 -0.000 1.094) 1.859 9.431 ( 1.119 0.000 -1.659) 2.001 9.948 ( 12.800 0.000 -2.699) 13.082 9.999 ( 1.151 0.000 4.649) 4.789 10.351 ( 3.264 0.000 3.696) 4.931 10.511 ( 2.631 0.000 6.008) 6.559 10.628 ( -0.105 -0.000 4.906) 4.908 10.987 ( -1.599 -0.000 -2.696) 3.134 11.200 ( -3.039 -0.000 7.465) 8.060 11.283 ( 7.903 0.000 -6.148) 10.013 11.431 ( -4.402 -0.000 8.283) 9.380 11.846 ( -4.191 -0.000 -1.338) 4.400 11.983 ( 3.528 0.000 0.211) 3.535 12.004 ( 0.741 0.000 3.840) 3.910 12.173 ( -1.713 -0.000 -10.183) 10.326 12.463 ( 8.650 0.000 12.178) 14.937 12.550 ( -4.701 -0.000 -4.545) 6.539 12.621 ( 8.340 0.000 1.007) 8.400 13.387 ( -8.290 -0.000 16.601) 18.556 13.730 ( 32.394 0.000 -2.980) 32.531 14.931 ( -0.074 -0.000 -1.361) 1.363 14.974 ( 6.235 0.000 1.682) 6.458 15.101 ( -3.858 -0.000 2.338) 4.511 15.127 ( -1.531 -0.000 -2.023) 2.537 15.333 ( -14.877 -0.000 -2.915) 15.160 15.558 ( 3.052 0.000 -6.134) 6.851 15.681 ( 2.746 0.000 9.317) 9.713 15.877 ( 5.461 0.000 -5.365) 7.656 16.077 ( 6.082 0.000 -5.472) 8.181 16.087 ( -3.441 -0.000 -5.419) 6.419 16.301 ( 5.937 0.000 7.164) 9.304 16.680 ( 5.473 0.000 1.159) 5.595 17.086 ( -8.657 -0.000 -0.616) 8.679 17.806 ( -39.170 -0.000 -22.314) 45.080 17.843 ( -7.536 -0.000 4.056) 8.559 17.888 ( 3.429 0.000 -5.962) 6.877 25.660 ( -0.514 -0.000 1.968) 2.034 25.692 ( 0.025 0.000 -0.086) 0.090 25.902 ( 0.887 0.000 0.506) 1.021 25.959 ( -0.899 -0.000 -1.320) 1.597 26.189 ( 3.881 0.000 0.743) 3.951 26.192 ( -1.540 -0.000 1.723) 2.311 26.610 ( -2.886 -0.000 -1.330) 3.178 26.621 ( -0.925 -0.000 -1.961) 2.168 27.127 ( 4.267 0.000 2.028) 4.725 27.848 ( -2.854 -0.000 -6.098) 6.733 28.270 ( 43.907 0.000 27.476) 51.795 28.378 ( 2.528 0.000 -5.036) 5.634 28.445 ( 8.190 0.000 4.113) 9.164 28.501 ( 7.118 0.000 -4.834) 8.604 29.147 ( -44.581 -0.000 -23.693) 50.486 29.791 ( -17.495 -0.000 9.995) 20.149 ======================= Grid point 247 (116/140) ======================= q-point: ( 0.00 0.00 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 7.23e-05 7.23e-05 7.23e-05 7.23e-05 7.23e-05 7.23e-05 7.23e-05 7.23e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 70 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.440 ( -5.637 -0.000 -14.186) 15.264 1.440 ( 5.637 0.000 14.186) 15.264 1.704 ( 20.015 0.000 -19.342) 27.834 1.704 ( -20.015 -0.000 19.342) 27.834 2.015 ( -9.242 -0.000 -6.571) 11.340 2.015 ( 9.242 0.000 6.571) 11.340 2.556 ( 3.918 0.000 -14.253) 14.781 2.556 ( -3.918 -0.000 14.253) 14.781 2.761 ( -10.552 -0.000 -17.674) 20.585 2.761 ( 10.552 0.000 17.674) 20.585 3.081 ( 5.572 0.000 -12.478) 13.666 3.081 ( -5.572 -0.000 12.478) 13.666 3.310 ( -1.145 -0.000 -8.508) 8.585 3.310 ( 1.145 0.000 8.508) 8.585 3.865 ( 0.298 0.000 -2.375) 2.394 3.865 ( -0.298 -0.000 2.375) 2.394 4.108 ( 4.400 0.000 -11.399) 12.218 4.108 ( -4.400 -0.000 11.399) 12.218 4.373 ( -0.161 -0.000 -0.148) 0.219 4.373 ( 0.161 0.000 0.148) 0.219 4.745 ( -7.455 -0.000 -1.848) 7.680 4.745 ( 7.455 0.000 1.848) 7.680 4.949 ( -2.896 -0.000 -12.797) 13.121 4.949 ( 2.896 0.000 12.797) 13.121 5.317 ( -1.884 -0.000 0.489) 1.946 5.317 ( 1.884 0.000 -0.489) 1.946 5.443 ( -3.208 -0.000 -7.333) 8.004 5.443 ( 3.208 0.000 7.333) 8.004 6.200 ( 4.077 0.000 -4.147) 5.815 6.200 ( -4.077 -0.000 4.147) 5.815 6.434 ( 3.600 0.000 -2.338) 4.292 6.434 ( -3.600 -0.000 2.338) 4.292 6.726 ( 1.764 0.000 -2.671) 3.201 6.726 ( -1.764 -0.000 2.671) 3.201 6.996 ( 11.128 0.000 -6.108) 12.694 6.996 ( -11.128 -0.000 6.108) 12.694 7.294 ( -1.794 -0.000 -4.108) 4.482 7.294 ( 1.794 0.000 4.108) 4.482 7.978 ( -2.115 -0.000 0.530) 2.180 7.978 ( 2.115 0.000 -0.530) 2.180 8.639 ( -2.030 -0.000 -5.950) 6.287 8.639 ( 2.030 0.000 5.950) 6.287 8.825 ( -1.972 -0.000 -4.302) 4.733 8.825 ( 1.972 0.000 4.302) 4.733 9.431 ( 3.285 0.000 -1.141) 3.478 9.431 ( -3.285 -0.000 1.141) 3.478 10.071 ( -6.880 -0.000 1.910) 7.140 10.071 ( 6.880 0.000 -1.910) 7.140 10.480 ( -8.446 -0.000 0.543) 8.464 10.480 ( 8.446 0.000 -0.543) 8.464 10.830 ( -2.487 -0.000 -5.300) 5.854 10.830 ( 2.487 0.000 5.300) 5.854 11.304 ( 9.933 0.000 -4.741) 11.006 11.304 ( -9.933 -0.000 4.741) 11.006 11.667 ( 0.242 0.000 -8.343) 8.346 11.667 ( -0.242 -0.000 8.343) 8.346 12.024 ( 0.212 0.000 -1.364) 1.380 12.024 ( -0.212 -0.000 1.364) 1.380 12.155 ( -6.691 -0.000 -7.024) 9.701 12.155 ( 6.691 0.000 7.024) 9.701 12.736 ( 5.912 0.000 -2.846) 6.562 12.736 ( -5.912 -0.000 2.846) 6.562 13.737 ( 10.110 0.000 -15.293) 18.332 13.737 ( -10.110 -0.000 15.293) 18.332 14.937 ( -5.334 -0.000 0.167) 5.337 14.937 ( 5.334 0.000 -0.167) 5.337 15.065 ( -4.414 -0.000 0.524) 4.445 15.065 ( 4.414 0.000 -0.524) 4.445 15.408 ( -1.989 -0.000 -4.942) 5.327 15.408 ( 1.989 0.000 4.942) 5.327 15.843 ( 10.884 0.000 -5.349) 12.127 15.843 ( -10.884 -0.000 5.349) 12.127 15.974 ( -1.630 -0.000 -2.566) 3.040 15.974 ( 1.630 0.000 2.566) 3.040 16.639 ( -14.359 -0.000 -1.286) 14.417 16.639 ( 14.359 0.000 1.286) 14.417 17.103 ( -22.810 -0.000 2.595) 22.957 17.103 ( 22.810 0.000 -2.595) 22.957 17.846 ( 8.085 0.000 -4.715) 9.360 17.846 ( -8.085 -0.000 4.715) 9.360 25.699 ( 0.444 0.000 -0.337) 0.557 25.699 ( -0.444 -0.000 0.337) 0.557 25.906 ( 1.720 0.000 -0.647) 1.837 25.906 ( -1.720 -0.000 0.647) 1.837 26.261 ( 2.042 0.000 -2.394) 3.147 26.261 ( -2.042 -0.000 2.394) 3.147 26.537 ( 1.066 0.000 -1.688) 1.996 26.537 ( -1.066 -0.000 1.688) 1.996 27.418 ( -8.850 -0.000 -10.009) 13.361 27.418 ( 8.850 0.000 10.009) 13.361 28.337 ( -6.368 -0.000 1.533) 6.550 28.337 ( 6.368 0.000 -1.533) 6.550 28.517 ( -15.001 -0.000 4.828) 15.759 28.517 ( 15.001 0.000 -4.828) 15.759 29.533 ( -36.023 -0.000 -1.168) 36.042 29.533 ( 36.023 0.000 1.168) 36.042 ======================= Grid point 249 (117/140) ======================= q-point: ( 0.11 0.00 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 7.23e-05 7.23e-05 7.23e-05 7.23e-05 7.23e-05 7.23e-05 7.23e-05 7.23e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 243 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.421 ( -3.366 -11.761 -16.217) 20.314 1.563 ( 2.030 -5.309 4.187) 7.059 1.769 ( -5.548 -8.629 12.322) 16.033 1.886 ( 17.311 -9.397 -6.241) 20.662 1.992 ( -8.805 -8.825 -5.275) 13.537 2.183 ( 6.683 -8.217 3.696) 11.218 2.466 ( -6.660 -6.352 -23.886) 25.598 2.650 ( -5.502 -10.169 6.646) 13.336 2.758 ( 1.247 -7.843 -5.736) 9.796 3.002 ( 6.629 -3.908 8.069) 11.150 3.085 ( 7.531 -1.526 -5.954) 9.721 3.119 ( -2.982 -2.780 13.885) 14.472 3.245 ( -1.269 0.620 -7.199) 7.337 3.346 ( 1.864 0.746 6.855) 7.143 3.853 ( -3.630 0.303 2.410) 4.368 3.888 ( 0.805 -1.327 3.458) 3.791 4.062 ( 0.996 3.194 -7.100) 7.849 4.119 ( 0.983 1.663 4.484) 4.882 4.323 ( -6.590 1.741 1.756) 7.039 4.388 ( 0.843 -2.027 1.015) 2.419 4.650 ( -4.407 3.757 -3.959) 7.015 4.785 ( 5.824 1.517 -2.152) 6.391 4.887 ( -2.196 -0.575 -8.171) 8.481 5.030 ( -0.841 -0.400 9.517) 9.563 5.294 ( -2.172 0.726 1.903) 2.978 5.350 ( 5.017 -0.138 1.892) 5.363 5.431 ( -0.893 -4.933 -5.758) 7.634 5.547 ( 3.385 -4.612 6.517) 8.672 6.135 ( 1.193 7.247 -5.126) 8.956 6.145 ( -1.803 4.806 3.095) 5.994 6.409 ( 0.885 2.069 -3.004) 3.754 6.432 ( 0.630 1.390 0.643) 1.656 6.679 ( -3.853 3.004 -0.704) 4.936 6.754 ( 3.444 0.079 1.556) 3.779 6.946 ( -3.025 -0.502 2.319) 3.845 6.992 ( 4.878 5.193 -3.964) 8.154 7.289 ( 0.878 -0.924 -0.940) 1.584 7.339 ( 1.431 -0.378 6.416) 6.584 7.892 ( -7.627 5.729 -0.011) 9.539 7.920 ( -2.946 3.393 -2.147) 4.980 8.664 ( -0.350 -6.557 -3.974) 7.675 8.733 ( 1.887 -6.154 4.332) 7.759 8.873 ( -1.381 -7.762 -1.753) 8.076 8.929 ( 1.040 -6.865 6.651) 9.615 9.438 ( -2.951 -2.251 1.920) 4.178 9.465 ( 1.641 -1.632 -3.082) 3.855 10.004 ( -7.750 -0.054 -1.142) 7.834 10.074 ( 0.512 2.061 -0.701) 2.237 10.441 ( -6.763 -0.989 1.821) 7.073 10.587 ( 13.779 -2.742 -3.330) 14.438 10.798 ( -1.749 -1.753 -5.786) 6.294 10.888 ( 2.949 -1.840 4.662) 5.815 11.208 ( -12.337 2.799 1.717) 12.766 11.336 ( 7.138 0.520 -4.555) 8.483 11.646 ( 1.361 -1.277 -7.735) 7.957 11.712 ( 0.699 -0.260 6.689) 6.730 12.028 ( 1.994 -0.086 -0.624) 2.091 12.037 ( 0.177 0.355 -0.109) 0.412 12.057 ( -3.818 1.707 -3.786) 5.641 12.218 ( 7.774 3.626 8.525) 12.094 12.657 ( -6.173 4.027 -1.381) 7.499 12.716 ( 0.973 3.539 -2.203) 4.281 13.657 ( -12.502 4.238 3.620) 13.688 13.700 ( -1.291 2.961 -4.375) 5.438 14.924 ( -2.546 -0.826 1.561) 3.099 14.972 ( 3.905 1.706 -0.711) 4.321 15.053 ( -3.394 -0.620 0.067) 3.451 15.146 ( 7.887 -4.664 1.390) 9.268 15.334 ( -1.371 2.703 -3.993) 5.013 15.409 ( 2.785 3.511 2.662) 5.213 15.681 ( -7.293 8.039 2.482) 11.135 15.770 ( 5.216 8.773 0.279) 10.210 15.998 ( -8.212 -3.900 -1.722) 9.253 16.103 ( 3.963 -6.371 1.295) 7.613 16.515 ( -12.343 -0.380 -4.714) 13.218 16.759 ( 5.979 -3.686 2.975) 7.627 16.979 ( -7.986 2.874 2.793) 8.935 17.290 ( 26.072 1.512 1.693) 26.171 17.819 ( -6.901 -1.153 3.612) 7.874 17.897 ( 7.102 -1.198 -3.230) 7.893 25.705 ( -0.454 -1.052 -0.078) 1.149 25.710 ( 0.567 -1.251 -0.720) 1.551 25.913 ( -1.584 -1.593 0.877) 2.412 25.934 ( 1.477 -1.683 0.398) 2.274 26.223 ( -2.254 2.568 -3.400) 4.820 26.259 ( 0.680 0.218 -0.773) 1.052 26.538 ( 1.337 0.030 1.010) 1.676 26.552 ( 1.437 -0.021 3.728) 3.995 27.289 ( -7.996 1.861 -9.752) 12.747 27.534 ( 9.655 1.297 11.724) 15.244 28.305 ( -6.878 -1.807 3.244) 7.816 28.352 ( -1.017 1.212 1.364) 2.089 28.523 ( -6.916 -8.176 0.684) 10.731 28.709 ( 13.919 -8.242 2.690) 16.398 29.189 ( -31.892 4.191 -9.063) 33.419 29.723 ( 30.359 7.430 -3.633) 31.466 ======================= Grid point 250 (118/140) ======================= q-point: ( 0.22 0.00 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 7.23e-05 7.23e-05 7.23e-05 7.23e-05 7.23e-05 7.23e-05 7.23e-05 7.23e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 243 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.608 ( 0.770 -16.014 -3.447) 16.399 1.708 ( 5.021 -8.656 -4.345) 10.910 1.959 ( 2.439 -8.342 7.088) 11.215 2.069 ( -2.391 -10.599 -9.791) 14.626 2.141 ( 4.717 -9.365 2.819) 10.858 2.355 ( -3.427 -13.406 -16.241) 21.336 2.538 ( 4.826 -10.815 -6.069) 13.308 2.819 ( -6.260 -10.090 -0.463) 11.883 2.909 ( 0.776 -6.758 3.893) 7.838 2.994 ( -2.262 -0.771 -8.885) 9.201 3.099 ( -2.211 -0.411 4.422) 4.961 3.203 ( -0.665 -2.983 -0.987) 3.212 3.309 ( -2.133 -3.084 9.182) 9.918 3.486 ( 13.615 -8.863 2.421) 16.425 3.807 ( -5.744 2.748 4.113) 7.580 3.903 ( 1.604 7.243 -2.160) 7.727 4.013 ( -1.017 -4.728 4.719) 6.757 4.125 ( 5.065 0.422 -1.393) 5.270 4.284 ( -5.740 -0.870 6.072) 8.401 4.450 ( 1.106 -1.411 0.933) 2.021 4.554 ( -2.809 -0.856 -5.164) 5.940 4.749 ( -0.882 3.371 -4.667) 5.825 4.832 ( 2.755 3.341 -6.436) 7.757 5.031 ( -3.867 0.842 4.658) 6.112 5.296 ( -1.406 -1.262 2.858) 3.426 5.378 ( 6.824 3.051 0.543) 7.495 5.564 ( 0.700 -10.711 0.996) 10.780 5.685 ( -0.346 -6.185 5.511) 8.291 5.962 ( -0.744 9.175 -5.081) 10.514 6.072 ( 1.713 4.935 3.692) 6.396 6.342 ( -0.144 3.096 -5.085) 5.955 6.412 ( 0.229 2.654 1.202) 2.922 6.609 ( -4.085 -0.128 -1.668) 4.415 6.742 ( 2.990 3.240 -3.189) 5.442 6.907 ( -0.077 2.832 -1.041) 3.018 7.021 ( 5.362 -1.853 6.467) 8.603 7.288 ( 0.190 2.393 2.370) 3.373 7.389 ( 2.669 0.392 6.080) 6.652 7.714 ( -9.176 5.680 -0.854) 10.825 7.832 ( -2.355 3.548 -2.529) 4.953 8.772 ( -0.299 -6.972 -0.765) 7.020 8.914 ( -0.258 -11.814 1.680) 11.936 8.992 ( -0.981 -7.498 0.828) 7.607 9.106 ( -1.798 -8.926 5.242) 10.507 9.439 ( -2.169 1.249 -3.509) 4.310 9.456 ( -1.707 0.025 2.691) 3.187 9.964 ( -3.530 0.051 -4.715) 5.890 10.024 ( -3.358 -0.096 -0.977) 3.499 10.421 ( -7.141 -1.123 4.219) 8.369 10.685 ( 8.960 -0.150 -7.333) 11.579 10.835 ( 4.659 -4.727 -4.780) 8.179 10.996 ( 4.740 -5.056 3.610) 7.814 11.062 ( -10.187 3.243 -0.837) 10.723 11.373 ( 4.930 -1.915 -2.613) 5.899 11.637 ( 1.572 0.467 -4.304) 4.606 11.752 ( 1.794 -1.149 1.646) 2.692 11.946 ( -4.859 2.922 -0.620) 5.703 12.060 ( 3.616 -0.490 3.252) 4.888 12.078 ( 3.293 -1.558 -3.553) 5.088 12.243 ( 8.078 5.849 9.872) 14.033 12.499 ( -4.138 6.981 -6.247) 10.241 12.646 ( -2.014 3.621 1.490) 4.403 13.460 ( -17.264 6.537 1.275) 18.504 13.567 ( -3.461 7.351 -6.447) 10.372 14.871 ( -0.572 6.761 -0.196) 6.788 14.947 ( 3.775 2.220 -2.670) 5.130 15.044 ( -7.588 -3.415 3.827) 9.159 15.277 ( 2.449 -0.274 2.441) 3.469 15.323 ( 4.148 -1.903 -1.792) 4.903 15.413 ( 5.512 -1.607 1.027) 5.833 15.543 ( -3.743 3.731 0.154) 5.287 15.687 ( 2.546 5.270 2.070) 6.208 15.940 ( -10.667 -0.055 -2.000) 10.853 16.208 ( 2.847 -2.222 0.583) 3.658 16.455 ( -5.055 -2.835 -3.151) 6.597 16.844 ( -14.445 -4.576 3.040) 15.454 16.912 ( 15.634 6.593 2.792) 17.196 17.430 ( 19.973 5.291 3.063) 20.887 17.812 ( -5.281 -1.894 2.398) 6.101 17.957 ( 5.026 -1.419 -1.410) 5.410 25.727 ( 0.197 -1.941 -0.345) 1.981 25.741 ( 0.718 -2.074 -0.329) 2.220 25.932 ( -1.492 -1.544 0.088) 2.149 25.974 ( 0.225 -1.345 1.234) 1.839 26.116 ( -2.255 4.357 -6.944) 8.502 26.262 ( 0.748 -0.162 0.079) 0.769 26.577 ( 2.071 -1.403 2.913) 3.839 26.597 ( 2.047 -0.768 7.008) 7.342 27.146 ( -6.162 2.371 -10.604) 12.492 27.611 ( 9.402 5.807 11.393) 15.872 28.283 ( -11.062 1.001 -1.484) 11.206 28.336 ( -3.967 -4.489 3.206) 6.795 28.657 ( -3.952 -11.981 -0.430) 12.623 28.787 ( -21.866 -0.952 -6.467) 22.822 29.075 ( 13.370 -6.126 3.434) 15.102 29.734 ( 22.743 12.623 -4.884) 26.466 ======================= Grid point 251 (119/140) ======================= q-point: ( 0.33 0.00 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 7.23e-05 7.23e-05 7.23e-05 7.23e-05 7.23e-05 7.23e-05 7.23e-05 7.23e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 243 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.808 ( 4.578 -5.338 -0.876) 7.086 1.942 ( 3.912 -16.334 -3.821) 17.225 2.120 ( -0.278 -4.578 8.606) 9.752 2.166 ( 2.947 -7.019 -8.015) 11.054 2.347 ( 1.291 -10.428 0.102) 10.508 2.451 ( -2.455 -10.555 -17.146) 20.284 2.718 ( 5.482 -5.823 -0.327) 8.004 2.774 ( -6.139 2.771 -6.936) 9.669 2.941 ( -3.956 0.105 2.445) 4.652 3.049 ( -0.511 -3.839 0.580) 3.916 3.135 ( 0.552 0.762 4.827) 4.918 3.261 ( -4.606 -7.784 -1.150) 9.118 3.422 ( -2.160 -8.686 5.228) 10.366 3.617 ( 2.477 6.422 -0.293) 6.890 3.725 ( -5.745 3.952 2.763) 7.501 3.870 ( 9.282 -5.117 -3.138) 11.054 4.068 ( -4.261 -0.009 4.992) 6.563 4.238 ( 4.968 -6.763 5.072) 9.806 4.316 ( 2.719 -1.462 3.924) 4.993 4.445 ( 0.867 0.371 -1.508) 1.779 4.594 ( -0.059 -4.559 -4.322) 6.283 4.627 ( -6.163 3.283 -6.097) 9.270 4.773 ( 6.941 3.184 -7.008) 10.365 5.004 ( -6.903 0.987 5.111) 8.646 5.342 ( 3.520 0.132 2.330) 4.224 5.360 ( 0.558 1.086 0.527) 1.330 5.733 ( 0.585 -4.604 1.025) 4.753 5.769 ( -1.034 -1.378 1.714) 2.430 5.847 ( -1.415 -2.046 0.013) 2.488 6.067 ( 4.590 0.518 3.287) 5.669 6.270 ( -4.128 1.147 -3.219) 5.359 6.363 ( 3.238 3.318 -1.076) 4.759 6.568 ( -5.753 0.566 -2.333) 6.233 6.740 ( 6.875 -0.724 -0.763) 6.955 6.889 ( -2.471 -0.186 3.519) 4.304 7.061 ( 1.755 4.794 2.536) 5.700 7.281 ( 0.544 -0.500 5.941) 5.987 7.406 ( 2.294 2.450 1.692) 3.759 7.590 ( -3.889 2.692 -1.033) 4.841 7.741 ( -1.442 3.636 -1.483) 4.184 8.867 ( -1.303 -5.064 0.603) 5.263 9.072 ( -3.000 -7.127 0.511) 7.749 9.132 ( 2.263 -0.718 3.464) 4.200 9.149 ( -5.503 -4.627 -2.162) 7.507 9.378 ( -3.180 1.751 -1.199) 3.823 9.533 ( 0.010 -8.848 4.698) 10.018 9.864 ( -3.665 3.615 -4.530) 6.857 10.040 ( -0.379 -2.709 -3.707) 4.606 10.393 ( -6.580 1.006 4.206) 7.874 10.691 ( 2.927 -0.178 -6.636) 7.255 10.920 ( -1.242 -5.310 -7.124) 8.972 10.967 ( 3.385 4.071 1.384) 5.473 11.154 ( 6.884 -6.096 1.419) 9.304 11.458 ( 3.235 -4.591 0.662) 5.655 11.619 ( 1.361 1.453 0.469) 2.045 11.785 ( 0.607 -1.178 -2.099) 2.483 11.881 ( -4.371 0.469 -0.337) 4.409 12.093 ( 1.881 -0.897 -7.961) 8.229 12.137 ( 4.121 -1.765 7.558) 8.788 12.254 ( 7.845 5.344 9.766) 13.619 12.353 ( 0.000 4.118 -3.270) 5.259 12.573 ( -1.204 4.746 1.488) 5.117 13.191 ( -17.116 9.000 -2.329) 19.478 13.366 ( -4.432 7.880 -6.381) 11.066 14.774 ( 0.411 3.098 -0.874) 3.245 14.935 ( 1.004 -0.411 -2.087) 2.352 15.074 ( -2.678 -2.164 3.676) 5.037 15.226 ( -2.273 5.500 1.220) 6.075 15.397 ( 3.220 -2.333 0.610) 4.023 15.472 ( -0.172 -2.373 -4.276) 4.894 15.528 ( 3.062 -0.583 3.524) 4.705 15.651 ( 1.148 2.041 0.245) 2.354 15.858 ( -5.985 0.252 -0.793) 6.042 16.233 ( 0.478 0.866 0.698) 1.211 16.476 ( -2.501 -3.311 0.363) 4.166 16.756 ( -4.372 3.792 -1.012) 5.875 16.995 ( 7.521 -0.835 4.222) 8.665 17.456 ( 11.124 6.321 1.154) 12.847 17.819 ( -3.502 -1.435 2.257) 4.406 18.003 ( 3.009 -0.961 -0.661) 3.227 25.767 ( 0.989 -2.363 -0.515) 2.613 25.786 ( 0.618 -2.423 0.666) 2.588 25.934 ( -1.190 -0.190 -1.483) 1.911 25.988 ( -0.963 0.043 1.385) 1.688 26.000 ( -1.344 3.587 -5.696) 6.864 26.275 ( 0.731 -0.392 0.625) 1.039 26.626 ( 2.301 -0.529 2.812) 3.672 26.675 ( 1.061 -2.037 8.723) 9.021 27.019 ( -3.883 1.678 -11.158) 11.932 27.597 ( 5.888 7.835 8.317) 12.854 28.154 ( -12.777 -0.711 -6.857) 14.518 28.420 ( -2.885 -5.151 6.203) 8.563 28.639 ( -8.540 -0.826 -7.437) 11.355 28.850 ( -3.604 -13.231 1.233) 13.768 29.289 ( 9.196 -3.239 5.626) 11.257 29.635 ( 15.095 12.931 -4.029) 20.280 ======================= Grid point 252 (120/140) ======================= q-point: ( 0.44 0.00 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 7.23e-05 7.23e-05 7.23e-05 7.23e-05 7.23e-05 7.23e-05 7.23e-05 7.23e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 243 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.888 ( 2.033 -1.852 -1.358) 3.067 2.147 ( 0.614 -5.603 -0.228) 5.641 2.211 ( 1.386 -2.465 0.360) 2.851 2.287 ( 3.523 -6.374 3.113) 7.920 2.415 ( -3.948 0.441 -5.852) 7.073 2.511 ( 1.921 -2.396 -4.776) 5.678 2.693 ( -2.390 -1.728 -2.191) 3.674 2.811 ( -0.513 -2.958 0.585) 3.058 2.943 ( 0.519 -1.040 1.318) 1.757 3.026 ( -0.465 4.284 -0.719) 4.368 3.133 ( 0.096 0.743 1.434) 1.618 3.377 ( -5.679 -10.041 -1.480) 11.630 3.479 ( 3.468 7.908 2.896) 9.108 3.570 ( -0.781 -3.911 0.710) 4.051 3.643 ( -2.810 2.565 2.212) 4.400 3.935 ( 1.427 0.260 -3.061) 3.387 4.115 ( -0.377 -3.143 4.405) 5.424 4.304 ( 2.839 2.292 -2.219) 4.271 4.414 ( 3.295 -2.092 2.067) 4.417 4.456 ( 1.406 0.078 2.355) 2.744 4.533 ( -5.162 -0.575 -1.028) 5.294 4.638 ( 0.733 -2.905 -4.001) 4.998 4.799 ( 9.407 -3.243 -7.683) 12.571 4.922 ( -9.838 4.206 6.029) 12.281 5.313 ( 0.887 2.119 0.223) 2.308 5.403 ( 0.677 -1.227 0.763) 1.596 5.748 ( 3.275 -0.104 0.760) 3.363 5.787 ( -3.701 -0.609 -0.215) 3.757 5.926 ( -0.076 -3.400 1.372) 3.667 6.120 ( 3.459 -0.982 -0.031) 3.596 6.199 ( -5.337 1.323 -0.184) 5.502 6.391 ( 8.668 -1.106 0.199) 8.740 6.490 ( -7.546 1.312 -1.781) 7.863 6.820 ( 4.759 -1.796 1.272) 5.243 6.889 ( -1.606 0.070 2.086) 2.633 6.968 ( -2.031 4.229 -0.402) 4.708 7.337 ( -0.268 -1.340 2.982) 3.280 7.394 ( 0.846 0.015 3.246) 3.354 7.505 ( 0.413 3.952 -5.810) 7.039 7.707 ( -0.356 0.204 1.624) 1.676 8.927 ( -1.070 -2.552 0.743) 2.866 9.035 ( -1.652 2.866 -1.775) 3.754 9.141 ( 1.799 0.010 1.528) 2.360 9.226 ( -3.329 -2.760 -0.258) 4.332 9.349 ( -1.159 -0.874 0.122) 1.457 9.710 ( -2.991 -8.729 1.472) 9.344 9.786 ( 1.993 2.887 -0.505) 3.544 10.039 ( 0.594 0.665 -3.369) 3.485 10.339 ( -3.316 1.443 1.898) 4.085 10.685 ( 0.340 -0.366 -2.280) 2.334 10.927 ( -3.611 -2.507 -2.843) 5.235 10.968 ( 5.445 2.282 0.215) 5.907 11.292 ( 4.445 -3.395 -0.307) 5.601 11.546 ( 1.369 -2.009 1.627) 2.926 11.626 ( 0.702 0.027 3.426) 3.497 11.773 ( -0.547 0.383 -4.056) 4.111 11.836 ( -3.282 0.728 -0.625) 3.419 12.091 ( 0.279 -1.867 -3.145) 3.668 12.215 ( 0.781 -1.408 1.630) 2.291 12.299 ( 1.396 -1.253 4.281) 4.674 12.336 ( 7.596 3.514 3.459) 9.056 12.497 ( 0.399 2.533 -0.102) 2.566 12.916 ( -10.494 6.411 -3.531) 12.794 13.218 ( -2.393 3.080 -2.555) 4.663 14.759 ( 0.718 -0.056 -0.270) 0.769 14.969 ( -0.488 -4.624 -1.451) 4.871 15.072 ( 1.853 5.814 0.169) 6.105 15.132 ( -3.217 0.808 2.547) 4.182 15.434 ( 0.625 -0.745 -0.216) 0.996 15.495 ( 0.110 -1.045 -1.713) 2.010 15.579 ( -0.079 -2.043 2.914) 3.560 15.619 ( 1.024 1.940 -1.902) 2.903 15.838 ( -0.926 -0.453 0.022) 1.031 16.209 ( -0.271 1.487 0.374) 1.557 16.518 ( -1.537 -2.453 1.824) 3.421 16.669 ( -0.484 2.799 -1.794) 3.360 17.068 ( 2.759 -0.818 1.688) 3.336 17.434 ( 3.428 2.668 0.144) 4.347 17.822 ( -1.373 -0.313 0.933) 1.689 18.028 ( 1.021 -0.337 -0.223) 1.098 25.808 ( 0.805 -1.515 -0.345) 1.749 25.829 ( 0.195 -1.334 1.082) 1.729 25.909 ( -0.468 0.595 -2.461) 2.575 25.934 ( -0.303 1.321 -1.307) 1.883 25.979 ( -0.890 0.525 0.856) 1.342 26.288 ( 0.312 -0.178 0.349) 0.501 26.653 ( 0.999 -0.063 1.092) 1.481 26.751 ( 0.400 -1.251 6.522) 6.653 26.926 ( -1.523 0.939 -7.543) 7.752 27.555 ( 1.712 3.289 3.089) 4.826 28.072 ( -4.873 -0.743 -3.145) 5.847 28.504 ( -0.797 -2.701 5.768) 6.419 28.576 ( -2.145 0.222 -5.761) 6.151 29.037 ( -3.149 -9.789 1.634) 10.413 29.332 ( 5.048 5.520 -0.167) 7.482 29.557 ( 4.949 3.345 -0.234) 5.978 ======================= Grid point 258 (121/140) ======================= q-point: ( 0.11 0.11 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 7.23e-05 7.23e-05 7.23e-05 7.23e-05 7.23e-05 7.23e-05 7.23e-05 7.23e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 135 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.150 ( -6.260 -0.000 -20.582) 21.512 1.525 ( 0.516 0.000 -5.961) 5.983 1.718 ( -4.584 -0.000 19.831) 20.354 1.764 ( -2.743 -0.000 -24.386) 24.540 1.963 ( 15.236 0.000 3.111) 15.551 2.199 ( 7.049 0.000 1.947) 7.313 2.249 ( 0.252 0.000 -23.552) 23.554 2.520 ( -8.059 -0.000 8.532) 11.737 2.716 ( 7.553 0.000 -5.980) 9.634 3.003 ( 0.253 0.000 -8.001) 8.005 3.131 ( -5.382 -0.000 14.593) 15.554 3.190 ( 14.337 0.000 11.949) 18.663 3.194 ( -1.742 -0.000 -8.605) 8.780 3.382 ( 0.205 0.000 3.419) 3.425 3.837 ( -4.124 -0.000 1.842) 4.517 3.902 ( -1.503 -0.000 9.054) 9.178 4.074 ( 4.703 0.000 -9.706) 10.785 4.150 ( -2.743 -0.000 7.447) 7.936 4.303 ( -7.294 -0.000 0.236) 7.297 4.343 ( -2.284 -0.000 -1.025) 2.504 4.673 ( -9.126 -0.000 -11.841) 14.949 4.690 ( 1.380 0.000 0.775) 1.583 4.950 ( 9.746 0.000 -2.300) 10.014 5.061 ( -3.335 -0.000 10.591) 11.104 5.260 ( -4.655 -0.000 -4.479) 6.459 5.351 ( 3.494 0.000 6.367) 7.262 5.449 ( 6.415 0.000 -0.217) 6.418 5.565 ( 4.170 0.000 4.020) 5.793 6.181 ( -0.158 -0.000 -6.293) 6.295 6.181 ( -1.033 -0.000 1.962) 2.218 6.420 ( -0.042 -0.000 1.786) 1.786 6.463 ( 4.162 0.000 -4.641) 6.234 6.745 ( -2.618 -0.000 5.685) 6.259 6.754 ( 3.453 0.000 -1.899) 3.941 6.884 ( -6.957 -0.000 2.098) 7.267 7.068 ( 6.313 0.000 -7.835) 10.061 7.305 ( 6.298 0.000 1.279) 6.427 7.378 ( 0.049 0.000 8.253) 8.254 7.825 ( -15.160 -0.000 -3.580) 15.577 7.913 ( -7.578 -0.000 -1.450) 7.715 8.563 ( -3.095 -0.000 -3.860) 4.947 8.736 ( 2.920 0.000 5.404) 6.143 8.783 ( -0.258 -0.000 0.525) 0.585 8.941 ( 4.791 0.000 8.431) 9.697 9.411 ( 0.826 0.000 0.407) 0.921 9.429 ( -3.564 -0.000 -1.207) 3.763 9.919 ( -11.889 -0.000 0.581) 11.903 10.084 ( 0.025 0.000 -3.618) 3.618 10.411 ( -2.027 -0.000 -1.555) 2.554 10.621 ( 7.684 0.000 -4.742) 9.029 10.743 ( -0.229 -0.000 -6.579) 6.583 10.916 ( 2.284 0.000 4.445) 4.997 11.166 ( -9.107 -0.000 4.132) 10.000 11.353 ( 5.422 0.000 -7.996) 9.661 11.600 ( 1.475 0.000 -8.279) 8.409 11.760 ( 2.107 0.000 7.474) 7.765 12.016 ( -4.675 -0.000 -3.753) 5.995 12.049 ( 2.395 0.000 -1.108) 2.639 12.052 ( 3.289 0.000 1.639) 3.674 12.361 ( 9.099 0.000 9.179) 12.925 12.627 ( -9.216 -0.000 0.790) 9.250 12.716 ( -1.903 -0.000 -9.051) 9.249 13.587 ( -26.190 -0.000 10.917) 28.374 13.671 ( 0.886 0.000 -11.864) 11.897 14.901 ( -1.141 -0.000 1.728) 2.070 14.980 ( -3.012 -0.000 0.312) 3.028 15.084 ( 3.979 0.000 2.273) 4.583 15.151 ( 8.116 0.000 -2.937) 8.631 15.361 ( 5.963 0.000 -4.518) 7.481 15.456 ( -2.231 -0.000 4.106) 4.673 15.741 ( -9.988 -0.000 7.600) 12.551 15.858 ( -5.312 -0.000 -7.769) 9.412 15.984 ( 7.098 0.000 3.070) 7.733 15.993 ( -2.446 -0.000 3.593) 4.346 16.412 ( -7.825 -0.000 -4.460) 9.007 16.671 ( -10.366 -0.000 2.373) 10.634 17.075 ( 14.178 0.000 0.133) 14.179 17.539 ( 24.183 0.000 8.855) 25.753 17.784 ( -4.061 -0.000 4.526) 6.080 17.924 ( 7.151 0.000 -4.145) 8.265 25.692 ( -0.336 -0.000 -0.077) 0.345 25.696 ( 0.519 0.000 -1.509) 1.596 25.893 ( -1.409 -0.000 1.329) 1.937 25.933 ( 1.228 0.000 0.980) 1.571 26.221 ( -3.394 -0.000 -1.499) 3.710 26.247 ( 0.747 0.000 -3.699) 3.774 26.569 ( 1.279 0.000 3.311) 3.550 26.572 ( 2.753 0.000 1.841) 3.312 27.212 ( -6.854 -0.000 -6.654) 9.552 27.664 ( 8.717 0.000 11.090) 14.106 28.252 ( -9.140 -0.000 8.360) 12.387 28.389 ( 1.421 0.000 -0.407) 1.478 28.409 ( -6.548 -0.000 4.175) 7.766 28.675 ( -16.262 -0.000 -5.581) 17.193 29.001 ( 1.573 0.000 -5.358) 5.584 29.981 ( 27.206 0.000 -9.689) 28.880 ======================= Grid point 259 (122/140) ======================= q-point: ( 0.22 0.11 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 7.23e-05 7.23e-05 7.23e-05 7.23e-05 7.23e-05 7.23e-05 7.23e-05 7.23e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 243 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.216 ( -1.965 -20.868 -13.566) 24.968 1.583 ( 2.371 -8.733 -12.018) 15.044 1.707 ( -8.042 -15.181 -20.691) 26.894 1.864 ( -0.577 -7.270 13.929) 15.722 2.140 ( 11.160 -3.863 2.744) 12.125 2.165 ( 9.755 0.522 -11.868) 15.371 2.356 ( 4.458 -11.616 -6.209) 13.906 2.607 ( -2.848 -9.203 6.275) 11.497 2.806 ( 5.476 -6.720 -3.025) 9.181 2.943 ( -3.298 0.448 -8.813) 9.420 3.100 ( -3.870 1.293 -1.677) 4.411 3.183 ( -1.743 0.742 7.298) 7.540 3.337 ( -1.475 -0.001 12.738) 12.823 3.451 ( 11.639 -6.135 -3.184) 13.536 3.802 ( -6.179 0.741 1.791) 6.476 3.961 ( 0.605 -2.371 7.866) 8.238 4.021 ( 0.897 4.337 -2.983) 5.340 4.161 ( -0.619 0.413 0.516) 0.906 4.263 ( -4.393 -0.729 6.667) 8.017 4.356 ( -1.659 -4.675 -4.802) 6.904 4.529 ( -7.365 1.918 -7.150) 10.442 4.701 ( -0.811 1.113 -0.407) 1.436 4.966 ( 8.581 4.260 -4.181) 10.453 5.054 ( -4.968 2.459 6.905) 8.855 5.246 ( -2.232 -3.546 -2.006) 4.645 5.461 ( 4.475 -4.770 7.631) 10.051 5.479 ( 5.100 1.782 0.849) 5.469 5.638 ( 3.201 -2.795 2.239) 4.803 6.080 ( -1.495 7.205 -4.217) 8.481 6.164 ( 0.673 2.702 2.496) 3.739 6.397 ( 0.409 6.785 -5.645) 8.836 6.445 ( 2.249 -0.252 1.232) 2.577 6.624 ( -2.239 4.847 -0.484) 5.361 6.806 ( 1.671 1.584 2.637) 3.501 6.938 ( 1.587 -2.775 -5.606) 6.454 7.023 ( 2.302 0.935 1.903) 3.129 7.349 ( 2.764 1.861 3.951) 5.169 7.432 ( 1.163 -0.857 7.217) 7.361 7.703 ( -12.802 0.307 -3.560) 13.291 7.792 ( -8.528 2.134 -2.939) 9.269 8.615 ( -4.518 -10.485 -2.490) 11.685 8.802 ( 2.600 -2.603 5.896) 6.950 8.855 ( -0.077 -5.965 1.908) 6.263 9.050 ( 4.828 -3.369 7.615) 9.626 9.391 ( -7.580 -0.968 -0.878) 7.692 9.448 ( 0.487 -1.721 1.952) 2.648 9.859 ( -7.141 -3.210 -3.119) 8.427 10.036 ( -1.427 3.241 -3.394) 4.905 10.372 ( -5.229 -0.052 -0.763) 5.285 10.661 ( -1.283 -4.752 -10.022) 11.165 10.732 ( 1.915 -1.811 -6.736) 7.233 10.975 ( 2.698 -3.102 3.320) 5.284 11.123 ( 2.902 4.039 5.840) 7.671 11.360 ( 4.376 -1.012 -6.959) 8.282 11.601 ( 2.212 -2.592 -6.823) 7.627 11.795 ( 1.663 1.896 5.954) 6.466 11.950 ( -3.992 1.970 -1.507) 4.700 12.065 ( 3.449 -0.674 -4.304) 5.556 12.100 ( 3.376 -0.700 5.066) 6.128 12.442 ( 8.113 3.646 7.483) 11.623 12.526 ( -5.591 3.987 -3.969) 7.931 12.633 ( -5.617 -0.048 -6.128) 8.313 13.382 ( -26.633 3.208 4.518) 27.203 13.593 ( -2.390 3.435 -8.743) 9.693 14.921 ( -0.283 -1.143 1.315) 1.765 14.961 ( -5.494 -1.628 0.645) 5.766 15.039 ( 2.483 7.404 -1.874) 8.031 15.242 ( 3.439 -3.502 -1.311) 5.081 15.377 ( 5.314 1.847 1.984) 5.966 15.470 ( 4.225 -0.173 1.543) 4.501 15.604 ( -6.292 7.476 4.121) 10.605 15.796 ( -3.272 2.023 -5.682) 6.862 15.878 ( -2.176 4.407 4.547) 6.696 16.164 ( 2.088 -5.759 2.150) 6.492 16.360 ( -2.914 -1.995 -3.205) 4.769 16.669 ( -9.953 -5.926 3.027) 11.973 17.149 ( 16.446 5.163 -0.218) 17.239 17.707 ( 9.177 1.364 12.244) 15.362 17.786 ( 5.564 4.154 2.834) 7.500 17.965 ( 5.070 -1.009 -2.499) 5.741 25.700 ( 0.537 -1.234 -0.719) 1.526 25.710 ( 0.457 -1.738 -0.703) 1.929 25.899 ( -1.509 -1.132 0.889) 2.085 25.958 ( 0.009 -1.322 1.323) 1.870 26.142 ( -2.199 4.056 -5.046) 6.837 26.247 ( -0.172 -0.954 -1.532) 1.813 26.588 ( 1.646 -0.296 2.938) 3.380 26.630 ( 2.361 -1.745 4.467) 5.345 27.102 ( -5.354 3.216 -6.943) 9.339 27.800 ( 8.876 -0.720 11.447) 14.503 28.194 ( -20.903 6.223 -6.719) 22.822 28.262 ( -6.111 -1.640 4.170) 7.578 28.477 ( -1.789 -6.946 0.111) 7.174 28.522 ( -15.837 -6.807 -6.131) 18.295 29.171 ( 20.571 -2.059 10.906) 23.374 30.047 ( 21.773 8.090 -11.883) 26.091 ======================= Grid point 260 (123/140) ======================= q-point: ( 0.33 0.11 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 7.23e-05 7.23e-05 7.23e-05 7.23e-05 7.23e-05 7.23e-05 7.23e-05 7.23e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 243 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.593 ( 2.638 -25.492 -3.113) 25.816 1.683 ( 3.001 -11.910 -18.989) 22.616 1.909 ( -2.830 -16.185 -9.536) 18.997 2.043 ( -1.370 -9.039 8.578) 12.536 2.211 ( 2.659 -0.830 3.995) 4.870 2.299 ( 14.990 -7.523 -11.265) 20.204 2.577 ( -1.665 -12.585 -2.370) 12.914 2.736 ( 1.500 -2.275 -5.153) 5.829 2.873 ( -4.677 -3.634 -3.287) 6.774 2.961 ( -1.034 -5.693 4.194) 7.146 3.106 ( 0.739 -5.826 -1.845) 6.156 3.171 ( -4.396 -0.375 5.259) 6.865 3.363 ( -2.465 0.518 9.992) 10.305 3.637 ( 6.454 -5.325 -5.457) 9.990 3.738 ( -4.805 0.880 0.344) 4.897 3.911 ( 2.983 4.951 -0.720) 5.824 4.082 ( 0.786 -0.588 6.164) 6.242 4.162 ( -2.549 -5.094 5.244) 7.743 4.319 ( 1.945 -2.638 3.619) 4.883 4.386 ( -4.050 -4.308 -8.197) 10.107 4.469 ( -3.699 -3.675 -4.235) 6.718 4.637 ( -0.161 4.222 -2.716) 5.023 4.895 ( 5.774 7.620 -4.718) 10.661 5.005 ( -4.437 2.075 4.894) 6.924 5.316 ( 1.552 -4.485 1.702) 5.042 5.457 ( 1.201 3.847 0.970) 4.145 5.639 ( 1.144 -7.939 6.300) 10.199 5.715 ( 2.628 -2.945 0.510) 3.980 5.918 ( 0.495 8.261 -1.916) 8.495 6.145 ( 3.239 2.798 3.292) 5.400 6.257 ( -3.807 3.552 -3.709) 6.393 6.444 ( 4.461 2.825 -2.068) 5.671 6.556 ( -2.890 2.867 -0.035) 4.071 6.803 ( 3.489 1.505 2.273) 4.427 6.886 ( 1.932 1.732 -1.884) 3.207 7.135 ( 1.671 -2.937 4.804) 5.873 7.324 ( -3.020 3.632 7.040) 8.478 7.426 ( -5.788 2.206 -0.651) 6.228 7.605 ( -0.044 1.282 -0.132) 1.290 7.722 ( -6.536 -0.702 -4.512) 7.973 8.759 ( -4.271 -10.065 -0.449) 10.943 8.918 ( 1.234 -5.868 5.650) 8.239 8.984 ( -1.195 -8.757 2.064) 9.076 9.170 ( 2.220 -1.411 4.577) 5.279 9.342 ( -4.762 -1.385 -2.126) 5.396 9.475 ( -1.551 -0.904 4.795) 5.119 9.872 ( -0.569 -1.549 -6.687) 6.888 9.948 ( -2.837 -0.111 -2.900) 4.058 10.340 ( -7.820 -1.900 0.747) 8.082 10.640 ( -6.861 -3.000 -9.532) 12.122 10.765 ( 2.576 -3.451 -5.757) 7.189 11.101 ( 5.306 -6.316 0.782) 8.286 11.145 ( 12.508 4.304 3.406) 13.659 11.404 ( 3.579 -4.027 -2.162) 5.805 11.638 ( 2.546 -1.889 -2.311) 3.923 11.783 ( -0.134 2.375 2.015) 3.117 11.881 ( -3.671 2.454 1.212) 4.579 12.065 ( 2.248 0.335 -7.822) 8.145 12.176 ( 2.565 -1.036 7.638) 8.124 12.374 ( -1.404 1.937 -7.599) 7.967 12.485 ( 9.427 6.545 8.013) 13.997 12.584 ( -5.414 -0.683 -1.076) 5.562 13.131 ( -23.607 4.507 -0.828) 24.048 13.425 ( -5.185 7.919 -7.348) 11.983 14.873 ( -0.342 7.878 1.781) 8.084 14.908 ( -2.157 0.283 -5.586) 5.994 15.016 ( -2.063 -3.533 3.952) 5.688 15.267 ( -0.905 1.502 -1.726) 2.460 15.396 ( 1.350 -0.872 2.988) 3.392 15.472 ( 0.293 2.898 -1.447) 3.252 15.566 ( 4.782 -0.783 2.458) 5.434 15.710 ( 0.740 3.624 -3.196) 4.889 15.836 ( -1.311 1.474 3.307) 3.851 16.226 ( -1.635 -1.225 1.961) 2.833 16.401 ( -0.683 -4.152 -0.108) 4.209 16.693 ( -7.390 -3.113 0.898) 8.069 17.173 ( 14.977 6.244 1.293) 16.278 17.719 ( 9.568 12.130 3.282) 15.794 17.785 ( -1.958 -1.699 7.250) 7.700 18.003 ( 2.541 -0.979 -1.475) 3.097 25.734 ( 1.400 -2.249 -0.858) 2.785 25.751 ( 0.530 -2.599 0.555) 2.710 25.907 ( -1.690 -0.956 -0.304) 1.966 25.980 ( -1.508 -0.949 1.294) 2.202 26.030 ( -0.174 4.233 -5.636) 7.050 26.258 ( -0.692 -1.241 -0.612) 1.547 26.624 ( 0.140 -1.220 1.876) 2.242 26.705 ( 1.824 -1.901 6.214) 6.749 26.977 ( -2.995 2.821 -7.494) 8.549 27.802 ( -4.931 10.429 -3.400) 12.027 27.984 ( -7.006 -5.496 -0.728) 8.934 28.331 ( -3.157 -5.787 7.989) 10.357 28.507 ( -5.849 -4.187 -4.189) 8.324 28.629 ( -2.450 -10.886 2.064) 11.347 29.385 ( 12.760 0.166 12.500) 17.864 29.950 ( 15.881 13.452 -11.621) 23.837 ======================= Grid point 261 (124/140) ======================= q-point: ( 0.44 0.11 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 7.23e-05 7.23e-05 7.23e-05 7.23e-05 7.23e-05 7.23e-05 7.23e-05 7.23e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 243 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.830 ( 5.454 -8.801 -10.007) 14.399 1.973 ( 6.412 -13.388 -5.118) 15.702 2.082 ( -6.340 -15.863 1.146) 17.122 2.210 ( 0.509 -7.048 -0.171) 7.068 2.257 ( -0.415 -1.996 -0.456) 2.089 2.497 ( 11.026 -6.894 -2.847) 13.312 2.644 ( -4.716 -0.780 -1.603) 5.042 2.738 ( -2.136 -4.127 -2.811) 5.431 2.899 ( -2.292 -3.072 1.021) 3.967 3.055 ( -0.731 -1.673 1.685) 2.485 3.150 ( -3.133 -5.907 -2.924) 7.298 3.248 ( 2.527 1.697 7.804) 8.377 3.419 ( -4.376 -8.562 2.190) 9.862 3.592 ( -4.045 2.819 -0.498) 4.955 3.718 ( 1.404 4.331 4.390) 6.325 3.939 ( 6.494 -1.239 -6.467) 9.248 4.087 ( -2.056 -0.917 7.695) 8.017 4.287 ( -3.860 -3.778 0.468) 5.421 4.348 ( 1.103 -3.301 -12.564) 13.037 4.437 ( -7.384 -0.507 -2.003) 7.667 4.472 ( 1.535 -8.339 3.946) 9.352 4.612 ( 7.557 0.508 -1.972) 7.827 4.810 ( 5.380 2.848 -7.362) 9.553 4.943 ( -6.183 3.805 5.631) 9.188 5.355 ( -2.099 2.711 1.534) 3.756 5.442 ( 3.434 -0.291 4.112) 5.365 5.722 ( -5.489 -2.790 -0.357) 6.168 5.809 ( 6.807 0.395 2.457) 7.247 5.849 ( 1.056 -2.657 -1.826) 3.393 6.148 ( 3.223 0.814 0.289) 3.337 6.204 ( -0.483 1.301 3.059) 3.360 6.445 ( 7.253 0.298 -1.819) 7.484 6.467 ( -5.707 3.192 0.039) 6.539 6.807 ( -4.298 -0.199 2.065) 4.772 6.921 ( 7.968 -0.252 1.961) 8.210 7.083 ( -2.828 9.019 3.448) 10.061 7.325 ( -3.579 -0.279 5.985) 6.979 7.357 ( -5.372 -3.406 -1.130) 6.460 7.568 ( 1.749 5.197 -6.232) 8.301 7.673 ( -3.839 -1.670 -2.636) 4.947 8.860 ( -4.432 -5.557 3.210) 7.799 9.039 ( 0.832 -2.682 0.496) 2.852 9.118 ( 1.114 -5.441 0.619) 5.588 9.178 ( 0.672 -0.794 3.434) 3.588 9.329 ( -1.478 0.383 -0.523) 1.614 9.565 ( -0.330 -7.482 4.863) 8.930 9.827 ( 1.774 1.399 -1.313) 2.613 9.994 ( 0.455 -4.765 -4.407) 6.507 10.304 ( -6.891 -1.039 -1.988) 7.247 10.598 ( -8.907 -3.911 -3.760) 10.430 10.824 ( 4.219 -3.137 -4.156) 6.702 11.156 ( 10.818 6.298 1.092) 12.565 11.248 ( 4.859 -5.233 -1.739) 7.349 11.523 ( 4.831 -5.114 0.006) 7.036 11.672 ( 2.298 1.621 4.250) 5.096 11.740 ( -3.035 -0.040 -1.649) 3.454 11.830 ( -2.933 1.447 2.689) 4.234 12.021 ( -0.216 -0.472 -8.931) 8.946 12.206 ( -1.511 0.269 2.541) 2.969 12.373 ( 4.538 0.988 -1.409) 4.853 12.501 ( 10.383 4.313 8.863) 14.316 12.537 ( -4.029 2.266 0.243) 4.629 12.870 ( -17.751 4.190 -5.012) 18.915 13.220 ( -6.557 5.288 -5.142) 9.869 14.790 ( 0.788 3.035 1.744) 3.588 14.877 ( -1.688 -2.188 -5.247) 5.930 15.075 ( -4.253 -3.253 4.423) 6.945 15.180 ( -1.851 5.211 -2.508) 6.072 15.434 ( -0.164 -0.026 1.436) 1.446 15.469 ( 3.023 -2.853 -1.350) 4.371 15.602 ( 2.927 1.036 0.837) 3.215 15.657 ( 2.334 2.896 -2.360) 4.405 15.839 ( 1.339 0.269 2.657) 2.987 16.217 ( -4.171 0.806 2.314) 4.838 16.465 ( -1.076 -3.678 2.908) 4.810 16.668 ( -3.402 0.258 -2.062) 3.986 17.187 ( 12.048 5.695 0.696) 13.344 17.578 ( 2.867 10.812 1.357) 11.268 17.818 ( -1.300 -0.435 4.871) 5.060 18.022 ( 0.611 -0.651 -1.433) 1.689 25.782 ( 1.398 -2.319 -0.306) 2.725 25.806 ( 0.835 -2.581 1.440) 3.072 25.898 ( -1.280 -0.001 -1.597) 2.046 25.952 ( 0.015 1.868 -2.593) 3.195 25.985 ( -0.728 0.494 0.987) 1.322 26.267 ( -1.539 -1.219 -1.219) 2.311 26.637 ( -2.000 -0.779 -0.678) 2.251 26.763 ( 0.292 -1.024 0.645) 1.245 26.915 ( 0.663 0.676 0.627) 1.136 27.579 ( -9.071 3.755 -9.375) 13.574 28.061 ( 4.670 -1.225 6.978) 8.485 28.458 ( -0.932 -5.680 7.866) 9.747 28.512 ( -2.451 -2.679 -3.724) 5.201 28.814 ( -3.704 -12.338 2.200) 13.068 29.470 ( 5.536 4.169 7.212) 10.002 29.757 ( 9.591 14.148 -9.624) 19.616 ======================= Grid point 262 (125/140) ======================= q-point: ( 0.56 0.11 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 7.23e-05 7.23e-05 7.23e-05 7.23e-05 7.23e-05 7.23e-05 7.23e-05 7.23e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 243 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.914 ( 4.196 0.159 -2.330) 4.802 2.119 ( 1.080 -6.351 -5.164) 8.256 2.228 ( -6.733 -0.683 1.404) 6.911 2.255 ( -1.870 -1.147 -6.274) 6.646 2.352 ( 2.119 -10.015 3.347) 10.770 2.574 ( 1.997 1.736 4.229) 4.988 2.709 ( 2.972 -4.906 0.732) 5.782 2.798 ( -1.024 -5.961 3.339) 6.908 2.930 ( -3.140 0.024 0.648) 3.206 3.035 ( 1.794 2.112 0.366) 2.795 3.159 ( 0.866 3.361 1.030) 3.620 3.297 ( -2.809 -7.429 -1.494) 8.082 3.508 ( -0.701 -4.233 -2.671) 5.054 3.581 ( 3.358 2.160 3.307) 5.185 3.671 ( 1.303 3.354 1.528) 3.909 3.944 ( 0.383 0.691 0.981) 1.259 4.118 ( -0.961 -0.117 -4.563) 4.665 4.238 ( -6.056 -1.389 2.595) 6.733 4.367 ( -1.634 -3.420 -10.768) 11.416 4.393 ( -6.317 -0.834 -0.439) 6.387 4.607 ( 7.684 1.493 1.169) 7.915 4.675 ( 2.102 -2.055 3.797) 4.802 4.818 ( -3.009 -0.743 -2.293) 3.855 4.867 ( 3.054 -0.728 -1.998) 3.721 5.307 ( -2.121 1.730 4.607) 5.359 5.466 ( 2.136 2.715 3.319) 4.791 5.703 ( -4.304 -1.422 -3.061) 5.470 5.847 ( 6.843 1.610 2.526) 7.470 5.903 ( -1.800 -3.476 -5.341) 6.621 6.150 ( 0.128 3.275 3.158) 4.552 6.234 ( 7.177 -1.161 1.222) 7.373 6.363 ( -7.110 3.284 0.984) 7.893 6.528 ( 7.904 -2.573 0.391) 8.322 6.777 ( -5.596 -0.676 0.080) 5.637 6.929 ( -2.964 6.314 0.191) 6.977 6.990 ( 5.666 0.559 3.457) 6.661 7.296 ( -6.963 -1.093 1.734) 7.258 7.409 ( -1.001 2.559 -3.731) 4.634 7.460 ( -0.351 -2.072 -0.201) 2.111 7.661 ( -2.116 -1.646 -5.664) 6.266 8.923 ( -4.297 -3.487 6.458) 8.505 9.040 ( 2.905 0.027 -4.027) 4.965 9.144 ( 2.964 2.488 -1.981) 4.348 9.258 ( 2.676 -2.510 2.666) 4.535 9.359 ( 2.235 -1.986 3.276) 4.435 9.702 ( -1.107 -5.894 2.258) 6.408 9.832 ( 3.475 2.264 0.058) 4.148 10.029 ( -1.286 -0.992 2.522) 3.000 10.288 ( 1.067 -3.982 -7.615) 8.659 10.598 ( -11.217 -5.479 2.405) 12.713 10.884 ( 5.424 -1.300 -3.230) 6.446 11.129 ( 8.752 6.817 4.062) 11.814 11.290 ( -3.329 0.457 -2.439) 4.153 11.588 ( 3.744 0.778 -2.630) 4.641 11.621 ( -0.520 4.080 -1.934) 4.545 11.765 ( -3.007 -2.426 5.371) 6.616 11.847 ( 2.589 -1.818 4.264) 5.309 12.016 ( -3.830 -5.022 -7.820) 10.052 12.193 ( -1.606 -0.149 -2.096) 2.645 12.328 ( 1.422 6.445 1.337) 6.734 12.435 ( -0.369 12.154 -0.513) 12.170 12.459 ( -5.927 0.905 0.763) 6.044 12.849 ( 4.645 -9.894 1.667) 11.057 13.154 ( -3.437 -4.088 -1.102) 5.453 14.773 ( -0.031 1.204 1.839) 2.198 14.918 ( -1.600 -5.996 -3.569) 7.159 15.059 ( -3.081 3.330 -0.532) 4.568 15.105 ( -1.707 -0.743 -0.043) 1.862 15.450 ( 1.060 0.025 1.390) 1.748 15.531 ( 3.785 -1.390 -0.425) 4.055 15.601 ( 0.469 0.906 0.548) 1.158 15.616 ( 2.229 2.750 -2.571) 4.375 15.861 ( 2.364 0.314 2.060) 3.151 16.176 ( -5.332 -0.086 1.790) 5.625 16.532 ( 0.097 -2.296 2.929) 3.723 16.632 ( -1.013 -0.065 -2.135) 2.364 17.157 ( 7.696 6.972 -1.703) 10.523 17.437 ( -3.235 6.058 0.602) 6.893 17.838 ( 1.072 -0.051 2.602) 2.815 18.019 ( -1.282 -0.069 -1.099) 1.690 25.819 ( 0.393 -0.467 0.661) 0.900 25.841 ( 0.373 0.395 0.147) 0.563 25.900 ( 0.494 -2.177 0.443) 2.276 25.929 ( 0.013 0.290 0.457) 0.541 25.979 ( 0.544 0.153 0.448) 0.721 26.260 ( -2.657 -1.104 -2.829) 4.035 26.621 ( -2.329 -0.438 -2.161) 3.207 26.742 ( -0.394 1.034 -6.283) 6.379 26.968 ( 2.425 -1.260 10.213) 10.573 27.451 ( -6.713 -0.972 -9.403) 11.594 28.163 ( 8.593 -0.309 8.092) 11.807 28.500 ( -0.744 -0.481 -3.399) 3.513 28.590 ( 2.381 -3.943 7.186) 8.536 28.988 ( -5.478 -10.827 1.621) 12.242 29.391 ( 2.783 10.562 0.099) 10.923 29.572 ( 0.871 7.906 -5.387) 9.606 ======================= Grid point 263 (126/140) ======================= q-point: (-0.33 0.11 0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 7.23e-05 7.23e-05 7.23e-05 7.23e-05 7.23e-05 7.23e-05 7.23e-05 7.23e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 243 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.879 ( 1.665 5.118 -1.323) 5.542 2.077 ( -5.584 6.912 -4.662) 10.034 2.194 ( -8.913 -0.163 10.485) 13.762 2.205 ( 3.315 3.257 -8.005) 9.256 2.474 ( 4.121 1.842 0.744) 4.575 2.600 ( -1.111 -0.894 7.184) 7.324 2.757 ( -2.549 1.118 3.272) 4.296 2.855 ( 0.897 2.977 3.037) 4.346 2.930 ( 6.616 -2.632 2.298) 7.482 3.060 ( 1.945 -1.448 1.932) 3.100 3.132 ( 0.763 1.053 -0.428) 1.369 3.373 ( -2.712 -3.266 -8.142) 9.182 3.508 ( 5.625 6.117 4.016) 9.230 3.565 ( 2.901 0.436 -1.581) 3.333 3.678 ( 1.641 -2.631 -1.445) 3.421 3.892 ( -10.205 3.870 -0.409) 10.922 4.090 ( 4.743 0.124 -2.477) 5.352 4.254 ( -3.002 0.172 1.176) 3.229 4.297 ( -3.264 2.794 -6.320) 7.643 4.380 ( -5.577 -4.131 -2.244) 7.294 4.637 ( 4.729 0.569 -1.305) 4.939 4.676 ( -3.331 2.862 7.403) 8.608 4.777 ( -0.517 0.850 6.946) 7.017 4.958 ( 4.138 -5.333 -10.038) 12.096 5.309 ( -1.303 0.378 6.727) 6.863 5.421 ( 1.537 4.749 -1.332) 5.166 5.708 ( -0.607 -3.306 0.072) 3.362 5.848 ( 2.321 5.064 0.926) 5.647 5.893 ( 0.476 -0.397 -5.230) 5.266 6.054 ( -4.399 5.953 -1.907) 7.644 6.298 ( -1.644 0.688 4.058) 4.432 6.325 ( 5.188 -1.855 0.248) 5.515 6.628 ( 6.510 -0.908 4.541) 7.989 6.741 ( -1.876 2.018 1.244) 3.023 6.849 ( -1.656 -0.699 -6.254) 6.507 7.014 ( -2.061 0.651 2.825) 3.557 7.252 ( -4.298 0.388 -3.283) 5.422 7.331 ( -2.098 -0.788 -4.496) 5.024 7.560 ( 2.078 -4.952 2.386) 5.877 7.664 ( -1.619 -4.080 -3.102) 5.375 8.961 ( -0.225 1.288 5.550) 5.702 9.064 ( 1.336 -2.869 -5.355) 6.220 9.148 ( 5.014 0.354 1.529) 5.253 9.273 ( 1.127 3.244 0.575) 3.482 9.407 ( 4.469 1.384 2.345) 5.234 9.648 ( -4.907 7.551 -5.321) 10.460 9.878 ( 6.641 -2.231 5.418) 8.856 10.056 ( -2.278 -1.371 3.287) 4.228 10.372 ( 8.347 -4.855 -7.896) 12.474 10.618 ( -13.347 -5.232 6.483) 15.734 10.911 ( 4.962 1.555 -1.312) 5.363 11.120 ( 9.039 5.408 7.013) 12.654 11.180 ( -7.658 4.750 -2.417) 9.330 11.506 ( -4.104 5.499 -1.780) 7.089 11.598 ( 2.628 -0.499 -1.666) 3.152 11.793 ( -3.409 -0.446 3.832) 5.149 11.914 ( 2.944 -0.911 0.714) 3.163 12.007 ( -7.966 -3.308 -8.863) 12.368 12.161 ( -1.008 2.720 1.268) 3.166 12.200 ( -1.375 6.390 0.361) 6.546 12.317 ( 1.875 -0.258 -0.730) 2.028 12.464 ( -3.098 -5.193 -1.305) 6.186 13.124 ( 10.581 -12.474 2.018) 16.481 13.267 ( -0.194 -9.354 3.110) 9.859 14.765 ( 0.296 0.578 2.290) 2.380 14.921 ( -4.942 0.525 -2.433) 5.533 15.065 ( 1.879 -3.605 -0.941) 4.173 15.129 ( -0.794 -4.529 -1.495) 4.835 15.438 ( -0.078 3.223 2.359) 3.995 15.531 ( 0.235 3.140 -3.923) 5.030 15.558 ( 2.158 3.623 1.486) 4.471 15.620 ( -0.273 -1.194 0.076) 1.227 15.903 ( 6.674 -1.016 1.494) 6.914 16.171 ( -5.775 -3.253 0.916) 6.691 16.545 ( 3.936 2.174 -1.684) 4.801 16.659 ( -4.393 -4.597 2.377) 6.788 17.070 ( 6.912 7.443 -4.065) 10.940 17.333 ( -9.321 1.249 0.653) 9.427 17.860 ( 3.392 0.627 0.669) 3.514 17.994 ( -3.080 0.616 -0.511) 3.182 25.802 ( -0.621 2.097 0.770) 2.319 25.816 ( -0.269 2.035 -0.897) 2.240 25.944 ( 0.425 -0.741 2.014) 2.188 25.967 ( 1.106 -2.983 0.458) 3.214 26.000 ( 2.383 -1.035 3.429) 4.302 26.239 ( -3.382 -1.444 -4.223) 5.599 26.598 ( -1.257 0.410 -2.052) 2.441 26.676 ( -1.009 2.364 -6.067) 6.589 27.072 ( 3.332 -2.072 11.404) 12.060 27.405 ( -5.645 -4.401 -9.584) 11.962 28.276 ( 9.102 -0.100 6.852) 11.393 28.469 ( 0.632 1.975 -4.365) 4.832 28.724 ( 8.895 -3.402 7.627) 12.201 29.053 ( -1.145 3.140 0.773) 3.431 29.249 ( -4.525 3.140 -0.003) 5.508 29.426 ( -7.952 2.902 -5.480) 10.084 ======================= Grid point 264 (127/140) ======================= q-point: (-0.22 0.11 0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 7.23e-05 7.23e-05 7.23e-05 7.23e-05 7.23e-05 7.23e-05 7.23e-05 7.23e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 243 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.773 ( 4.006 8.070 -4.369) 10.014 1.856 ( -10.290 10.100 3.388) 14.811 2.097 ( 4.475 8.728 -3.133) 10.297 2.153 ( -6.900 4.685 5.141) 9.798 2.392 ( 7.150 10.800 1.502) 13.039 2.535 ( -7.802 7.449 -0.355) 10.793 2.740 ( 3.377 3.941 10.644) 11.842 2.868 ( -1.383 -0.994 -5.826) 6.070 3.036 ( 9.829 0.523 9.395) 13.607 3.084 ( -0.407 2.115 5.816) 6.202 3.118 ( 3.103 1.662 -3.149) 4.724 3.275 ( -1.577 4.263 -7.273) 8.577 3.416 ( 2.427 10.812 -0.687) 11.103 3.525 ( -7.509 9.118 -4.195) 12.535 3.762 ( 1.910 -3.899 -3.034) 5.297 3.775 ( -2.624 -6.447 2.058) 7.259 4.092 ( 3.976 4.144 -4.436) 7.256 4.129 ( -6.629 5.617 3.402) 9.331 4.303 ( 6.506 -2.097 -4.332) 8.092 4.397 ( -6.441 -3.182 0.124) 7.185 4.622 ( -0.247 1.891 3.383) 3.884 4.661 ( -2.128 -1.150 -0.450) 2.460 4.864 ( 4.057 -2.912 10.245) 11.397 4.995 ( 0.589 -3.002 -9.262) 9.754 5.313 ( -1.459 1.575 4.033) 4.569 5.343 ( 0.447 3.174 -3.472) 4.725 5.738 ( -0.090 8.795 2.348) 9.103 5.760 ( 1.063 2.538 -3.078) 4.129 5.882 ( 1.614 -1.903 2.331) 3.415 5.957 ( -3.630 -2.798 -4.750) 6.600 6.325 ( 0.358 -1.594 4.071) 4.386 6.368 ( 0.521 -1.393 -2.262) 2.707 6.696 ( 5.767 2.423 4.983) 7.998 6.718 ( -0.012 0.356 5.193) 5.205 6.851 ( 1.831 -3.389 -7.855) 8.749 6.947 ( -10.132 0.435 -2.225) 10.383 7.252 ( 1.820 -1.968 0.223) 2.690 7.319 ( -2.935 -1.963 -4.483) 5.707 7.680 ( 5.765 -5.787 -0.456) 8.181 7.742 ( -2.966 -6.723 1.255) 7.455 8.925 ( 3.537 6.981 3.789) 8.695 9.029 ( -3.604 5.272 -5.498) 8.427 9.147 ( 5.147 6.580 2.388) 8.689 9.227 ( -0.529 4.084 -0.094) 4.119 9.431 ( 2.733 -1.038 -0.340) 2.944 9.471 ( -2.472 3.929 -1.589) 4.906 9.988 ( 5.624 -1.853 2.827) 6.562 10.057 ( -1.794 0.405 0.887) 2.042 10.467 ( 11.330 -1.386 -7.154) 13.471 10.609 ( -15.216 -2.193 7.726) 17.206 10.901 ( 3.651 3.558 2.430) 5.647 11.020 ( -6.811 5.121 -3.232) 9.114 11.169 ( 12.270 2.187 4.701) 13.320 11.369 ( -8.230 3.389 -1.682) 9.058 11.638 ( 3.127 -0.939 2.764) 4.278 11.749 ( -5.691 1.522 -1.332) 6.040 11.940 ( 1.825 -1.906 1.514) 3.043 11.999 ( -1.833 -4.398 -5.472) 7.256 12.101 ( -1.476 2.521 -0.884) 3.052 12.115 ( -3.228 2.642 -0.405) 4.191 12.435 ( 4.101 -7.269 5.034) 9.747 12.536 ( -2.276 -6.861 -4.226) 8.374 13.409 ( 9.901 -11.075 -1.754) 14.959 13.457 ( -1.096 -10.411 5.244) 11.709 14.801 ( 1.802 -2.838 2.592) 4.244 14.877 ( -4.458 -1.756 -2.053) 5.213 15.121 ( 6.869 -0.365 -3.313) 7.635 15.200 ( -5.444 -4.146 1.376) 6.980 15.374 ( -0.336 4.534 2.857) 5.370 15.431 ( -2.412 4.314 -4.487) 6.675 15.549 ( 3.018 0.846 2.622) 4.086 15.612 ( -2.225 -0.378 -1.789) 2.880 16.017 ( 11.408 -2.353 0.995) 11.691 16.174 ( -7.435 -1.959 0.494) 7.704 16.546 ( 6.364 1.343 1.122) 6.601 16.692 ( -10.150 -4.635 -1.016) 11.205 17.020 ( 13.649 4.723 -3.361) 14.829 17.238 ( -15.593 -0.401 0.642) 15.611 17.874 ( 4.896 1.519 -0.602) 5.162 17.947 ( -4.690 1.311 0.327) 4.881 25.764 ( 0.047 2.263 0.217) 2.274 25.772 ( -0.696 2.234 -0.104) 2.342 25.962 ( 0.781 0.387 1.296) 1.562 25.982 ( 0.099 0.276 -1.544) 1.572 26.103 ( 3.306 -3.804 7.241) 8.822 26.220 ( -3.293 -2.110 -4.642) 6.069 26.567 ( -0.256 1.388 -1.431) 2.010 26.596 ( -1.497 2.784 -3.960) 5.067 27.202 ( 5.379 -2.989 10.849) 12.472 27.397 ( -6.669 -5.382 -10.129) 13.268 28.353 ( 4.757 0.789 3.737) 6.100 28.408 ( 1.286 3.198 -3.969) 5.257 28.918 ( 5.919 11.140 1.141) 12.667 28.935 ( 15.380 -2.331 5.039) 16.352 29.114 ( -5.184 7.181 0.271) 8.861 29.367 ( -19.461 -10.042 -3.222) 22.135 ======================= Grid point 265 (128/140) ======================= q-point: (-0.11 0.11 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 7.23e-05 7.23e-05 7.23e-05 7.23e-05 7.23e-05 7.23e-05 7.23e-05 7.23e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 126 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.648 ( 7.876 8.853 -7.302) 13.919 1.648 ( -7.876 8.853 7.302) 13.919 1.969 ( 5.747 10.555 -9.318) 15.207 1.969 ( -5.747 10.555 9.318) 15.207 2.284 ( -8.681 12.052 -5.683) 15.903 2.284 ( 8.681 12.052 5.683) 15.903 2.736 ( -2.442 7.743 -16.104) 18.035 2.736 ( 2.442 7.743 16.104) 18.035 3.036 ( -5.442 8.772 -6.362) 12.126 3.036 ( 5.442 8.772 6.362) 12.126 3.133 ( -0.929 4.344 -14.593) 15.254 3.133 ( 0.929 4.344 14.593) 15.254 3.288 ( 0.610 2.859 -5.023) 5.811 3.288 ( -0.610 2.859 5.023) 5.811 3.859 ( 0.759 -2.949 -1.115) 3.242 3.859 ( -0.759 -2.949 1.115) 3.242 4.053 ( -4.506 -0.236 -0.185) 4.516 4.053 ( 4.506 -0.236 0.185) 4.516 4.365 ( -0.218 0.239 -5.027) 5.037 4.365 ( 0.218 0.239 5.027) 5.037 4.663 ( -3.438 -2.849 -3.869) 5.908 4.663 ( 3.438 -2.849 3.869) 5.908 4.980 ( -3.190 -0.949 -8.433) 9.065 4.980 ( 3.190 -0.949 8.433) 9.065 5.297 ( 5.023 0.284 -4.895) 7.019 5.297 ( -5.023 0.284 4.895) 7.019 5.609 ( -0.777 8.865 -7.262) 11.486 5.609 ( 0.777 8.865 7.262) 11.486 6.019 ( 0.367 -7.893 -5.337) 9.535 6.019 ( -0.367 -7.893 5.337) 9.535 6.383 ( -0.492 -2.470 -3.362) 4.201 6.383 ( 0.492 -2.470 3.362) 4.201 6.714 ( -5.073 0.730 -1.025) 5.226 6.714 ( 5.073 0.730 1.025) 5.226 6.909 ( 4.563 -3.397 -8.768) 10.452 6.909 ( -4.563 -3.397 8.768) 10.452 7.304 ( -1.238 -0.839 -3.835) 4.117 7.304 ( 1.238 -0.839 3.835) 4.117 7.829 ( -1.577 -6.521 -1.486) 6.871 7.829 ( 1.577 -6.521 1.486) 6.871 8.832 ( -2.921 9.309 -4.642) 10.804 8.832 ( 2.921 9.309 4.642) 10.804 9.054 ( -2.065 10.210 -4.733) 11.442 9.054 ( 2.065 10.210 4.733) 11.442 9.469 ( 3.706 -1.033 -4.094) 5.618 9.469 ( -3.706 -1.033 4.094) 5.618 10.041 ( -0.940 -0.381 -2.047) 2.285 10.041 ( 0.940 -0.381 2.047) 2.285 10.531 ( 7.260 1.250 -8.999) 11.630 10.531 ( -7.260 1.250 8.999) 11.630 10.886 ( -3.548 3.536 -4.789) 6.930 10.886 ( 3.548 3.536 4.789) 6.930 11.264 ( -6.526 -0.487 -3.122) 7.251 11.264 ( 6.526 -0.487 3.122) 7.251 11.686 ( 0.436 0.281 -6.208) 6.230 11.686 ( -0.436 0.281 6.208) 6.230 12.027 ( 3.880 -1.705 -6.198) 7.508 12.027 ( -3.880 -1.705 6.198) 7.508 12.069 ( -2.492 -1.559 -4.364) 5.262 12.069 ( 2.492 -1.559 4.364) 5.262 12.610 ( 0.139 -6.599 -6.987) 9.612 12.610 ( -0.139 -6.599 6.987) 9.612 13.613 ( 6.742 -7.619 -10.212) 14.415 13.613 ( -6.742 -7.619 10.212) 14.415 14.899 ( -1.948 -4.472 -0.739) 4.934 14.899 ( 1.948 -4.472 0.739) 4.934 15.148 ( -4.931 3.214 0.704) 5.928 15.148 ( 4.931 3.214 -0.704) 5.928 15.344 ( -0.024 0.989 -2.834) 3.002 15.344 ( 0.024 0.989 2.834) 3.002 15.616 ( -3.627 -4.437 -2.207) 6.142 15.616 ( 3.627 -4.437 2.207) 6.142 16.116 ( -2.090 1.371 -4.906) 5.506 16.116 ( 2.090 1.371 4.906) 5.506 16.636 ( -12.830 -1.456 -4.924) 13.819 16.636 ( 12.830 -1.456 4.924) 13.819 17.100 ( -8.089 0.591 -6.260) 10.245 17.100 ( 8.089 0.591 6.260) 10.245 17.883 ( 2.863 1.721 -5.254) 6.226 17.883 ( -2.863 1.721 5.254) 6.226 25.733 ( 0.629 1.770 -1.012) 2.134 25.733 ( -0.629 1.770 1.012) 2.134 25.954 ( -0.535 1.803 -0.855) 2.066 25.954 ( 0.535 1.803 0.855) 2.066 26.216 ( -0.240 -2.686 -6.414) 6.958 26.216 ( 0.240 -2.686 6.414) 6.958 26.540 ( 0.493 1.207 -1.041) 1.669 26.540 ( -0.493 1.207 1.041) 1.669 27.363 ( -7.990 -3.455 -11.107) 14.112 27.363 ( 7.990 -3.455 11.107) 14.112 28.359 ( 4.248 1.776 -6.481) 7.950 28.359 ( -4.248 1.776 6.481) 7.950 28.777 ( -9.277 12.250 -3.683) 15.802 28.777 ( 9.277 12.250 3.683) 15.802 29.340 ( -26.784 -9.393 -4.951) 28.812 29.340 ( 26.784 -9.393 4.951) 28.812 ======================= Grid point 269 (129/140) ======================= q-point: ( 0.22 0.22 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 7.23e-05 7.23e-05 7.23e-05 7.23e-05 7.23e-05 7.23e-05 7.23e-05 7.23e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 135 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.920 ( 0.357 0.000 -14.085) 14.089 1.389 ( -5.816 -0.000 -20.099) 20.924 1.408 ( -0.250 -0.000 -19.169) 19.171 1.899 ( 5.627 0.000 12.174) 13.411 2.195 ( 6.374 0.000 3.738) 7.389 2.213 ( -1.064 -0.000 -5.839) 5.935 2.263 ( 18.268 0.000 -12.797) 22.305 2.559 ( -1.701 -0.000 13.964) 14.067 2.788 ( 12.215 0.000 -8.728) 15.013 2.852 ( -7.097 -0.000 -11.143) 13.211 3.060 ( -3.763 -0.000 -4.284) 5.702 3.254 ( -0.294 -0.000 14.111) 14.114 3.342 ( -8.124 -0.000 6.509) 10.410 3.484 ( 13.184 0.000 -1.655) 13.287 3.764 ( -7.830 -0.000 1.623) 7.997 3.967 ( -1.132 -0.000 4.625) 4.762 4.065 ( 0.309 0.000 -0.833) 0.888 4.121 ( -4.617 -0.000 -1.186) 4.767 4.263 ( -1.802 -0.000 7.203) 7.425 4.281 ( 1.913 0.000 -10.921) 11.087 4.453 ( -7.751 -0.000 -2.055) 8.019 4.748 ( 1.048 0.000 5.186) 5.291 5.021 ( 5.022 0.000 -5.582) 7.509 5.069 ( -6.981 -0.000 6.226) 9.354 5.193 ( 0.121 0.000 1.060) 1.067 5.513 ( 4.854 0.000 7.902) 9.273 5.520 ( 2.524 0.000 -0.487) 2.570 5.660 ( 7.357 0.000 -1.762) 7.565 6.109 ( -1.847 -0.000 -2.671) 3.247 6.198 ( -0.190 -0.000 3.204) 3.209 6.457 ( 0.406 0.000 0.183) 0.445 6.473 ( 3.587 0.000 -5.462) 6.535 6.721 ( -3.353 -0.000 4.152) 5.337 6.751 ( -0.287 -0.000 -4.109) 4.119 6.886 ( 3.014 0.000 2.974) 4.235 7.090 ( 6.125 0.000 -5.535) 8.255 7.432 ( -5.382 -0.000 9.181) 10.642 7.457 ( 8.832 0.000 1.222) 8.916 7.510 ( -16.452 -0.000 -3.982) 16.927 7.755 ( -9.329 -0.000 -2.394) 9.631 8.443 ( -6.645 -0.000 -2.485) 7.095 8.837 ( 3.024 0.000 4.874) 5.736 8.858 ( 4.655 0.000 6.461) 7.964 9.107 ( 6.477 0.000 5.864) 8.737 9.305 ( -12.226 -0.000 4.678) 13.090 9.441 ( 1.677 0.000 -0.657) 1.801 9.754 ( -9.226 -0.000 -0.950) 9.275 10.046 ( 1.129 0.000 -4.852) 4.982 10.315 ( -6.476 -0.000 -5.557) 8.534 10.484 ( -10.318 -0.000 -15.056) 18.252 10.739 ( 7.660 0.000 -5.057) 9.179 10.976 ( 1.368 0.000 3.264) 3.539 11.244 ( 7.642 0.000 9.699) 12.348 11.346 ( 5.329 0.000 -9.404) 10.809 11.559 ( 2.444 0.000 -5.619) 6.128 11.860 ( 1.388 0.000 5.560) 5.731 11.931 ( -2.883 -0.000 -1.698) 3.346 12.063 ( 3.018 0.000 -4.859) 5.720 12.142 ( 2.531 0.000 6.201) 6.698 12.470 ( -7.220 -0.000 -14.663) 16.344 12.495 ( -8.034 -0.000 0.527) 8.052 12.609 ( 7.231 0.000 2.908) 7.794 13.220 ( -27.092 -0.000 6.170) 27.786 13.571 ( -0.571 -0.000 -8.732) 8.750 14.906 ( -4.315 -0.000 -1.718) 4.645 14.914 ( -0.347 -0.000 2.765) 2.787 15.134 ( 1.883 0.000 1.947) 2.708 15.241 ( 8.732 0.000 -6.152) 10.682 15.406 ( -9.980 -0.000 5.732) 11.509 15.510 ( 10.038 0.000 0.781) 10.069 15.682 ( -5.461 -0.000 -6.922) 8.817 15.704 ( -3.979 -0.000 7.409) 8.410 15.987 ( -1.944 -0.000 2.960) 3.541 16.124 ( 5.071 0.000 4.426) 6.731 16.321 ( 0.176 0.000 -3.491) 3.495 16.558 ( -6.389 -0.000 2.161) 6.744 17.323 ( 17.500 0.000 -2.056) 17.621 17.718 ( -4.454 -0.000 8.411) 9.517 17.978 ( 4.578 0.000 -3.836) 5.972 18.014 ( 10.863 0.000 14.885) 18.427 25.692 ( 0.278 0.000 0.286) 0.399 25.693 ( 1.335 0.000 -1.827) 2.263 25.882 ( -1.504 -0.000 0.711) 1.663 25.947 ( -0.984 -0.000 0.842) 1.295 26.145 ( -3.423 -0.000 -2.067) 3.999 26.226 ( 0.471 0.000 -2.654) 2.696 26.616 ( 0.829 0.000 1.869) 2.044 26.631 ( 1.746 0.000 1.890) 2.573 27.081 ( -4.236 -0.000 -2.373) 4.855 27.785 ( -10.987 -0.000 -9.004) 14.205 28.080 ( -7.863 -0.000 -11.648) 14.054 28.236 ( -6.065 -0.000 12.224) 13.646 28.364 ( -4.086 -0.000 3.076) 5.115 28.424 ( -0.009 -0.000 0.253) 0.253 29.404 ( 19.587 0.000 20.934) 28.668 30.206 ( 18.828 0.000 -16.063) 24.749 ======================= Grid point 270 (130/140) ======================= q-point: ( 0.33 0.22 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 7.23e-05 7.23e-05 7.23e-05 7.23e-05 7.23e-05 7.23e-05 7.23e-05 7.23e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 243 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.125 ( 1.468 -25.090 -5.329) 25.691 1.390 ( 7.495 -11.259 -21.195) 25.143 1.518 ( -2.117 -19.411 -8.754) 21.399 2.039 ( 6.083 -4.076 8.791) 11.442 2.212 ( 1.236 -4.049 -4.695) 6.322 2.302 ( 6.989 -1.048 3.803) 8.026 2.332 ( 3.252 -7.227 -8.967) 11.967 2.684 ( 1.401 -4.664 1.048) 4.981 2.745 ( -6.066 -3.485 -5.245) 8.744 2.887 ( 7.904 -3.390 -5.425) 10.168 3.028 ( -0.859 -1.890 -2.438) 3.202 3.226 ( -5.036 5.518 9.606) 12.169 3.377 ( -3.113 -3.440 8.053) 9.293 3.589 ( 8.709 -2.696 -5.188) 10.490 3.692 ( -7.528 0.154 -0.906) 7.584 3.992 ( -1.404 1.503 2.119) 2.953 4.040 ( -4.150 -4.727 4.144) 7.532 4.136 ( -0.313 -2.302 0.177) 2.330 4.236 ( -0.958 -0.299 -7.820) 7.884 4.317 ( 3.661 -1.679 -1.324) 4.240 4.390 ( -5.553 0.549 1.001) 5.670 4.736 ( 1.386 4.618 4.732) 6.756 5.013 ( -6.698 3.224 2.647) 7.891 5.015 ( 2.986 1.301 -4.617) 5.651 5.251 ( 1.343 -4.091 5.186) 6.740 5.511 ( 0.583 2.205 0.241) 2.293 5.593 ( 0.662 -2.443 4.963) 5.571 5.715 ( 7.774 -1.271 -5.162) 9.418 6.045 ( 0.263 5.559 0.589) 5.596 6.218 ( 1.983 0.613 5.865) 6.221 6.323 ( -1.669 8.782 -4.142) 9.852 6.489 ( 3.167 0.269 -4.316) 5.360 6.607 ( -0.636 4.961 -0.456) 5.023 6.832 ( -2.753 -0.612 2.029) 3.474 6.951 ( 5.687 -1.439 -0.253) 5.872 7.078 ( 3.100 -0.770 0.648) 3.260 7.379 ( -6.096 0.346 2.587) 6.631 7.417 ( -8.705 3.474 5.114) 10.678 7.578 ( -0.643 -5.344 -2.130) 5.789 7.644 ( -3.850 2.413 -3.003) 5.447 8.501 ( -5.274 -11.619 -1.138) 12.811 8.883 ( -0.978 -2.854 1.922) 3.578 8.950 ( 5.629 -1.493 8.514) 10.315 9.187 ( 4.831 -1.274 3.531) 6.118 9.271 ( -7.966 -1.771 6.510) 10.439 9.467 ( -0.300 -1.742 1.398) 2.253 9.727 ( -5.690 -5.606 -3.444) 8.698 9.993 ( 1.137 4.487 -4.433) 6.409 10.236 ( -8.277 -1.378 -4.233) 9.398 10.388 ( -11.392 -7.314 -16.105) 21.039 10.789 ( 9.627 0.058 -2.937) 10.066 11.042 ( 2.798 -4.590 1.633) 5.618 11.309 ( 9.365 3.061 0.195) 9.854 11.377 ( 5.538 -1.878 0.652) 5.884 11.593 ( 2.972 -3.379 -2.344) 5.074 11.851 ( -1.331 3.121 2.796) 4.397 11.897 ( -2.138 1.347 0.100) 2.529 12.056 ( 2.477 0.448 -6.922) 7.366 12.210 ( 1.869 -1.802 7.688) 8.114 12.306 ( -6.330 0.747 -13.593) 15.013 12.481 ( -6.797 -3.580 -1.516) 7.830 12.647 ( 3.767 1.945 1.174) 4.399 13.037 ( -18.452 4.542 6.540) 20.097 13.476 ( -2.444 5.606 -7.587) 9.744 14.870 ( -1.788 0.066 -3.718) 4.126 14.940 ( -2.308 -1.259 4.423) 5.145 15.068 ( 1.169 8.494 1.788) 8.759 15.275 ( 4.490 0.269 -5.062) 6.771 15.383 ( -5.971 -2.270 5.423) 8.379 15.514 ( -2.933 3.416 -4.356) 6.265 15.617 ( 4.295 1.682 4.130) 6.191 15.728 ( 1.613 0.124 -1.201) 2.015 15.929 ( 1.529 5.084 4.150) 6.739 16.201 ( -0.663 -1.680 2.276) 2.905 16.339 ( 1.748 -2.993 -0.380) 3.487 16.579 ( -4.785 -4.899 0.699) 6.883 17.397 ( 16.124 5.343 -0.818) 17.006 17.751 ( -1.871 -1.999 6.219) 6.795 17.991 ( 3.890 0.412 -3.956) 5.564 18.041 ( 0.604 9.630 13.564) 16.646 25.709 ( 1.775 -1.480 -1.304) 2.653 25.717 ( 0.624 -2.074 0.613) 2.251 25.878 ( -1.806 -0.712 0.015) 1.941 25.949 ( -2.215 -1.142 0.161) 2.497 26.076 ( -1.012 3.643 -2.614) 4.597 26.226 ( -0.955 -1.042 -1.791) 2.282 26.619 ( -0.558 0.044 0.695) 0.893 26.682 ( 0.299 -3.074 0.802) 3.191 27.002 ( -1.792 4.140 -1.230) 4.676 27.614 ( -18.226 -4.316 -22.518) 29.290 28.055 ( 8.331 2.462 6.552) 10.881 28.280 ( -3.199 -2.881 10.913) 11.731 28.390 ( -3.314 -3.831 0.132) 5.067 28.478 ( -1.093 -6.172 1.466) 6.437 29.611 ( 11.663 3.879 22.901) 25.991 30.185 ( 15.019 8.123 -17.254) 24.275 ======================= Grid point 271 (131/140) ======================= q-point: ( 0.44 0.22 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 7.23e-05 7.23e-05 7.23e-05 7.23e-05 7.23e-05 7.23e-05 7.23e-05 7.23e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 243 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.536 ( 1.468 -22.705 -9.539) 24.671 1.677 ( 9.498 -20.249 -0.095) 22.367 1.795 ( -0.073 -17.751 -9.338) 20.057 2.154 ( 6.769 0.027 -0.413) 6.781 2.282 ( -2.069 -1.503 7.363) 7.795 2.399 ( 7.684 -8.612 -6.782) 13.387 2.495 ( -4.240 -11.905 1.531) 12.729 2.639 ( -5.468 -2.593 -9.563) 11.317 2.849 ( 2.240 -1.379 -0.249) 2.642 2.955 ( -1.046 -6.948 0.102) 7.027 3.118 ( 1.450 -0.237 1.407) 2.034 3.164 ( -5.251 -6.411 5.956) 10.205 3.423 ( -0.366 2.245 5.685) 6.123 3.552 ( -8.332 0.409 -0.980) 8.399 3.761 ( 7.868 -5.032 -3.907) 10.124 3.958 ( 2.651 2.162 -0.267) 3.431 4.125 ( -4.426 -1.373 4.794) 6.667 4.175 ( -0.989 -3.237 4.365) 5.524 4.216 ( -2.077 -4.493 -13.321) 14.211 4.338 ( -7.096 -1.254 0.709) 7.241 4.383 ( 5.846 -3.552 -3.479) 7.675 4.712 ( 6.211 3.174 3.590) 7.845 4.892 ( -2.302 5.746 -2.848) 6.814 4.981 ( -2.117 2.119 0.045) 2.996 5.361 ( 0.025 -3.096 4.300) 5.299 5.472 ( -0.217 1.860 3.898) 4.324 5.634 ( -4.242 -1.928 0.932) 4.752 5.763 ( 2.949 -2.712 -8.059) 9.000 5.972 ( 5.596 5.789 3.768) 8.889 6.206 ( 3.375 3.349 -0.728) 4.810 6.264 ( 3.373 1.202 7.246) 8.083 6.482 ( 4.206 0.371 -4.316) 6.038 6.505 ( -3.448 4.867 0.248) 5.970 6.794 ( -4.572 1.856 2.022) 5.333 7.005 ( 7.888 0.615 1.776) 8.109 7.178 ( 0.806 -3.629 2.449) 4.452 7.256 ( -8.744 4.779 -1.080) 10.023 7.335 ( -6.349 2.093 6.611) 9.402 7.567 ( -5.808 -0.544 -5.736) 8.181 7.627 ( 1.724 0.362 -3.804) 4.192 8.677 ( -3.635 -12.040 0.931) 12.611 8.950 ( -4.992 -6.816 -0.962) 8.503 9.071 ( 5.904 -3.029 6.883) 9.561 9.233 ( 2.648 1.115 6.558) 7.160 9.305 ( -0.180 -2.447 1.056) 2.672 9.511 ( -0.445 -2.781 5.877) 6.517 9.807 ( 1.210 -6.843 -7.080) 9.921 9.917 ( 1.854 1.368 -1.194) 2.595 10.187 ( -8.171 -2.725 -5.943) 10.465 10.375 ( -13.051 -8.855 -7.532) 17.478 10.852 ( 9.473 0.190 -0.476) 9.487 11.164 ( 2.927 -6.143 -1.963) 7.083 11.320 ( 8.583 2.954 -2.576) 9.435 11.483 ( 6.147 -3.747 2.026) 7.478 11.665 ( 0.557 -3.030 1.115) 3.276 11.790 ( -0.858 3.890 3.354) 5.207 11.857 ( -1.977 1.959 2.677) 3.862 11.997 ( -0.086 2.806 -9.761) 10.157 12.200 ( -2.442 -0.125 -3.331) 4.132 12.355 ( 3.325 -5.911 2.598) 7.263 12.473 ( -7.649 -2.807 -1.601) 8.304 12.636 ( -1.458 -1.055 -2.354) 2.963 12.842 ( -6.950 10.531 6.345) 14.124 13.276 ( -5.530 9.720 -6.126) 12.750 14.836 ( 1.150 0.734 -5.794) 5.953 14.889 ( -2.375 6.395 4.528) 8.188 15.020 ( -1.909 -1.285 3.736) 4.388 15.222 ( -1.473 4.028 -4.373) 6.125 15.420 ( -2.496 -2.424 4.246) 5.489 15.453 ( 1.359 -0.132 -3.768) 4.008 15.638 ( 2.066 0.947 2.234) 3.187 15.715 ( 3.620 2.295 -3.392) 5.466 15.908 ( 4.123 2.936 4.107) 6.518 16.201 ( -4.365 0.220 2.284) 4.932 16.415 ( 0.622 -3.664 2.817) 4.663 16.612 ( -2.945 -2.795 -2.246) 4.640 17.406 ( 14.573 7.314 -0.434) 16.311 17.774 ( -0.102 4.373 3.146) 5.388 17.881 ( -2.308 9.409 8.622) 12.969 18.002 ( -0.014 -0.679 -2.624) 2.710 25.752 ( 1.799 -2.422 -0.588) 3.074 25.772 ( 1.065 -3.033 1.266) 3.455 25.875 ( -1.774 -0.634 -0.530) 1.958 25.944 ( -2.472 -0.577 -1.069) 2.755 26.015 ( 1.399 2.469 -0.724) 2.929 26.220 ( -2.769 -1.078 -2.494) 3.879 26.609 ( -1.767 -0.115 -0.886) 1.980 26.720 ( -1.329 -2.169 -3.397) 4.243 26.959 ( 1.656 1.281 5.105) 5.518 27.452 ( -10.947 -1.254 -16.011) 19.436 28.141 ( 7.067 -0.465 8.209) 10.842 28.394 ( -0.087 -6.102 9.114) 10.969 28.423 ( -2.449 -3.367 -1.848) 4.555 28.612 ( -2.536 -9.862 1.747) 10.331 29.670 ( 4.792 7.954 16.926) 19.306 30.014 ( 10.506 13.670 -16.167) 23.635 ======================= Grid point 272 (132/140) ======================= q-point: ( 0.56 0.22 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 7.23e-05 7.23e-05 7.23e-05 7.23e-05 7.23e-05 7.23e-05 7.23e-05 7.23e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 243 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.835 ( 3.946 -14.248 -3.551) 15.205 1.980 ( 0.817 -11.542 -6.159) 13.108 2.055 ( 1.822 -8.705 0.521) 8.909 2.201 ( 5.653 -7.887 -2.234) 9.958 2.280 ( -2.509 2.964 2.023) 4.379 2.550 ( -6.424 -6.948 -5.871) 11.136 2.630 ( 2.278 -5.512 4.898) 7.718 2.689 ( 2.126 -8.698 1.229) 9.038 2.883 ( -1.746 -3.163 3.661) 5.144 3.046 ( -0.869 -2.428 -2.663) 3.707 3.108 ( -0.265 -3.675 1.378) 3.934 3.313 ( -5.922 -0.385 -3.618) 6.950 3.380 ( 3.019 -3.728 7.036) 8.516 3.543 ( -3.156 -4.335 1.001) 5.455 3.811 ( 4.069 5.629 4.000) 8.015 3.969 ( 3.701 0.596 -3.258) 4.966 4.072 ( -3.047 1.450 -7.091) 7.853 4.192 ( -5.444 -2.909 2.369) 6.612 4.246 ( 1.669 -2.941 -8.638) 9.276 4.302 ( -7.663 -3.134 2.009) 8.519 4.569 ( 6.053 -9.938 0.857) 11.668 4.736 ( 7.303 2.978 -0.027) 7.888 4.795 ( 0.178 1.728 -4.511) 4.834 4.910 ( -3.980 3.736 2.160) 5.871 5.362 ( -0.074 2.448 5.415) 5.943 5.517 ( 0.382 -0.580 6.328) 6.366 5.610 ( -5.897 -2.107 -3.368) 7.111 5.769 ( -2.852 -3.858 -9.360) 10.518 5.980 ( 9.127 3.593 4.634) 10.849 6.222 ( 2.863 0.763 0.900) 3.096 6.288 ( 4.282 2.015 3.840) 6.094 6.403 ( -3.071 4.715 2.151) 6.024 6.531 ( 7.344 -3.029 -2.014) 8.196 6.739 ( -5.500 0.752 2.023) 5.909 7.028 ( -2.802 6.096 2.785) 7.264 7.068 ( 1.797 3.143 -0.817) 3.712 7.248 ( -5.417 0.369 3.144) 6.274 7.352 ( -1.911 -4.736 3.249) 6.052 7.466 ( -2.690 3.417 -6.189) 7.564 7.598 ( -0.973 -0.097 -6.635) 6.707 8.828 ( -2.682 -7.418 4.173) 8.924 8.983 ( -4.828 -3.618 -5.121) 7.913 9.187 ( 4.968 -2.475 3.093) 6.354 9.279 ( 2.555 1.344 1.311) 3.171 9.366 ( 5.846 -3.086 7.442) 9.954 9.612 ( -0.699 -5.465 3.562) 6.560 9.852 ( 3.261 -1.577 -1.748) 4.022 9.997 ( -0.030 -3.872 2.992) 4.894 10.156 ( -0.229 -5.660 -12.952) 14.137 10.396 ( -14.402 -7.921 1.509) 16.506 10.926 ( 9.469 -0.173 0.329) 9.476 11.229 ( -3.179 -2.410 -4.138) 5.748 11.318 ( 9.264 4.876 1.011) 10.518 11.572 ( 2.717 -2.110 -4.215) 5.441 11.707 ( -2.457 -2.408 4.063) 5.324 11.747 ( 1.045 5.948 3.324) 6.893 11.854 ( -0.734 -1.380 6.249) 6.442 11.899 ( -2.477 0.258 -10.106) 10.409 12.186 ( 1.115 -0.056 -2.279) 2.538 12.395 ( -4.543 0.704 -1.225) 4.757 12.477 ( -2.287 1.581 3.087) 4.155 12.603 ( -7.057 5.874 -3.394) 9.789 12.741 ( 9.363 -2.718 4.618) 10.788 13.070 ( -7.251 2.946 -3.597) 8.613 14.812 ( -0.416 1.925 0.496) 2.031 14.832 ( 1.285 -0.835 -1.910) 2.449 15.036 ( -4.295 -0.728 3.644) 5.680 15.119 ( -2.070 3.301 -4.110) 5.663 15.450 ( 1.414 -1.541 0.316) 2.115 15.492 ( 0.282 -3.341 -0.009) 3.353 15.641 ( 2.178 1.506 0.300) 2.665 15.681 ( 2.357 2.938 -2.171) 4.347 15.919 ( 5.271 2.095 2.511) 6.203 16.149 ( -7.395 1.577 2.165) 7.865 16.498 ( -0.048 -3.493 5.232) 6.291 16.610 ( -0.313 -0.904 -4.701) 4.798 17.363 ( 11.110 9.331 -1.547) 14.591 17.583 ( -4.205 12.865 2.256) 13.721 17.863 ( 0.548 -0.004 5.129) 5.158 17.994 ( -1.454 -0.510 -2.689) 3.100 25.806 ( 1.633 -2.187 0.463) 2.768 25.841 ( 1.627 -2.647 1.671) 3.528 25.866 ( -1.410 -0.465 -0.627) 1.611 25.928 ( -1.519 -0.192 -0.752) 1.706 26.002 ( 2.012 0.998 1.186) 2.540 26.193 ( -4.354 -1.065 -4.478) 6.336 26.598 ( -0.620 -0.250 -0.263) 0.718 26.706 ( -1.813 -0.673 -5.603) 5.927 27.017 ( 2.453 -1.029 9.924) 10.274 27.334 ( -6.300 -0.810 -11.788) 13.391 28.250 ( 6.865 -1.400 7.263) 10.092 28.447 ( -2.048 -2.672 -2.284) 4.068 28.555 ( 2.697 -6.678 7.631) 10.493 28.766 ( -4.537 -10.679 0.506) 11.614 29.599 ( 0.993 10.532 9.332) 14.106 29.759 ( 5.313 14.831 -12.649) 20.204 ======================= Grid point 273 (133/140) ======================= q-point: ( 0.67 0.22 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 7.23e-05 7.23e-05 7.23e-05 7.23e-05 7.23e-05 7.23e-05 7.23e-05 7.23e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 243 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.979 ( 6.029 1.760 -0.909) 6.346 2.082 ( -4.903 -1.098 -4.851) 6.985 2.117 ( -0.817 -5.430 4.697) 7.226 2.190 ( -2.855 0.472 -4.605) 5.439 2.447 ( 5.376 -9.332 4.126) 11.534 2.572 ( -3.900 -4.327 -3.685) 6.893 2.736 ( 0.604 -2.606 5.600) 6.206 2.821 ( -2.325 -2.783 -4.012) 5.408 2.976 ( 2.759 -4.788 12.214) 13.406 3.069 ( 2.502 -1.931 -3.561) 4.762 3.166 ( 0.758 0.286 0.716) 1.081 3.236 ( -2.777 -1.532 -3.652) 4.837 3.530 ( 4.630 -6.108 1.255) 7.767 3.619 ( -3.318 -5.049 0.450) 6.058 3.714 ( 4.944 9.136 0.834) 10.422 3.852 ( -8.950 4.538 -4.528) 11.009 4.106 ( 6.772 -2.855 -1.605) 7.523 4.222 ( -7.233 -3.719 0.339) 8.140 4.249 ( 0.201 -0.641 0.845) 1.080 4.299 ( -2.909 -0.152 -2.980) 4.167 4.702 ( 1.976 1.478 2.024) 3.191 4.721 ( 1.987 1.352 -1.389) 2.776 4.796 ( 0.363 -1.390 2.842) 3.184 4.854 ( -0.132 -1.890 -5.271) 5.601 5.374 ( 1.999 1.746 8.374) 8.785 5.482 ( -2.358 3.359 -2.830) 4.985 5.649 ( 0.886 -4.458 2.845) 5.362 5.769 ( -4.748 -4.736 -8.624) 10.924 5.998 ( 7.996 5.277 3.337) 10.145 6.134 ( -5.195 7.065 -1.567) 8.909 6.324 ( 1.395 0.390 3.452) 3.744 6.353 ( 2.173 0.988 -0.132) 2.390 6.655 ( 7.342 -3.895 0.818) 8.351 6.720 ( -2.279 -1.863 0.588) 3.002 6.899 ( 0.874 6.812 1.703) 7.076 7.021 ( -7.217 2.909 -0.665) 7.809 7.226 ( -0.819 0.463 3.304) 3.435 7.306 ( -2.571 2.213 -7.170) 7.932 7.499 ( 0.944 -4.581 4.950) 6.810 7.572 ( -1.126 -2.472 -6.504) 7.049 8.934 ( -2.335 -4.678 6.769) 8.553 8.986 ( -0.332 -3.417 -6.739) 7.563 9.242 ( 7.360 1.881 -1.519) 7.747 9.286 ( -2.054 -0.707 3.372) 4.011 9.489 ( 6.873 0.187 5.322) 8.695 9.643 ( -5.925 0.455 -3.583) 6.940 9.918 ( 5.376 -2.092 2.527) 6.298 10.011 ( -5.214 -1.931 1.969) 5.899 10.289 ( 12.221 -8.419 -10.565) 18.217 10.430 ( -15.169 -7.393 6.668) 18.144 10.997 ( 9.608 1.219 0.357) 9.692 11.160 ( -8.615 1.982 -2.961) 9.323 11.322 ( 10.340 5.578 5.661) 13.041 11.530 ( -7.120 3.984 -4.996) 9.567 11.654 ( 5.143 3.559 -0.332) 6.263 11.744 ( -6.132 -1.900 2.125) 6.762 11.880 ( 0.548 -2.416 -4.041) 4.740 11.904 ( -2.117 -2.145 0.880) 3.140 12.205 ( 4.971 0.224 0.994) 5.074 12.324 ( -7.980 3.669 -0.267) 8.787 12.372 ( 2.245 6.579 0.521) 6.971 12.417 ( -1.665 7.663 -1.667) 8.017 12.980 ( 7.020 -12.838 2.167) 14.792 13.084 ( -4.751 -9.963 -0.741) 11.063 14.799 ( 1.077 0.800 2.547) 2.879 14.857 ( -2.367 -2.029 -2.961) 4.300 15.029 ( 0.311 -0.845 0.330) 0.959 15.064 ( -2.322 -0.838 -1.344) 2.810 15.491 ( 1.605 -0.119 2.252) 2.768 15.536 ( -1.046 -1.388 -2.102) 2.727 15.624 ( 1.912 2.091 -0.087) 2.835 15.635 ( 1.112 2.894 -0.755) 3.191 15.952 ( 6.977 0.241 1.339) 7.109 16.080 ( -8.479 -0.540 0.970) 8.552 16.570 ( 0.068 -1.802 3.912) 4.308 16.603 ( 0.449 -0.823 -3.485) 3.609 17.260 ( 8.426 9.796 -2.798) 13.221 17.362 ( -7.377 8.956 1.869) 11.753 17.898 ( 2.862 -0.022 2.834) 4.028 17.970 ( -2.889 0.029 -2.079) 3.559 25.832 ( 0.144 0.912 0.953) 1.327 25.841 ( 0.093 1.486 -0.762) 1.673 25.920 ( 0.878 -3.507 0.541) 3.656 25.932 ( -0.724 -1.679 0.702) 1.958 26.028 ( 3.559 -0.441 3.874) 5.279 26.151 ( -4.913 -1.514 -6.041) 7.933 26.604 ( 0.919 0.297 1.551) 1.827 26.664 ( -1.951 0.734 -5.051) 5.465 27.114 ( 2.675 -2.002 10.752) 11.259 27.266 ( -4.076 -2.177 -10.297) 11.286 28.356 ( 5.884 -1.138 5.497) 8.132 28.452 ( -1.995 -1.062 -3.025) 3.776 28.735 ( 7.154 -6.661 6.023) 11.482 28.891 ( -7.643 -9.766 -1.018) 12.442 29.434 ( 1.493 13.064 2.844) 13.454 29.503 ( -1.212 11.905 -6.481) 13.609 ======================= Grid point 274 (134/140) ======================= q-point: (-0.22 0.22 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 7.23e-05 7.23e-05 7.23e-05 7.23e-05 7.23e-05 7.23e-05 7.23e-05 7.23e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 126 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.939 ( 3.204 7.357 -8.146) 11.434 1.939 ( -3.204 7.357 8.146) 11.434 2.187 ( 5.465 0.193 -9.834) 11.253 2.187 ( -5.465 0.193 9.834) 11.253 2.565 ( -1.795 2.061 -2.251) 3.541 2.565 ( 1.795 2.061 2.251) 3.541 2.793 ( -1.130 -1.558 -5.497) 5.824 2.793 ( 1.130 -1.558 5.497) 5.824 3.098 ( 3.010 -1.138 -4.840) 5.812 3.098 ( -3.010 -1.138 4.840) 5.812 3.200 ( -7.303 -0.571 -9.312) 11.848 3.200 ( 7.303 -0.571 9.312) 11.848 3.621 ( 1.172 4.447 -1.604) 4.871 3.621 ( -1.172 4.447 1.604) 4.871 3.689 ( -7.569 -0.646 -1.482) 7.740 3.689 ( 7.569 -0.646 1.482) 7.740 4.182 ( 3.695 2.562 -11.940) 12.758 4.182 ( -3.695 2.562 11.940) 12.758 4.279 ( 6.087 -3.119 -8.492) 10.904 4.279 ( -6.087 -3.119 8.492) 10.904 4.671 ( 5.062 2.830 -8.911) 10.632 4.671 ( -5.062 2.830 8.911) 10.632 4.878 ( -0.110 -3.767 -10.847) 11.483 4.878 ( 0.110 -3.767 10.847) 11.483 5.383 ( -0.479 3.438 -7.202) 7.995 5.383 ( 0.479 3.438 7.202) 7.995 5.765 ( -1.637 -3.164 -7.401) 8.214 5.765 ( 1.637 -3.164 7.401) 8.214 5.957 ( -4.580 6.717 -2.698) 8.565 5.957 ( 4.580 6.717 2.698) 8.565 6.343 ( -0.828 0.171 -3.885) 3.976 6.343 ( 0.828 0.171 3.885) 3.976 6.746 ( -0.572 -1.628 -8.582) 8.754 6.746 ( 0.572 -1.628 8.582) 8.754 6.869 ( -10.971 3.179 -4.449) 12.258 6.869 ( 10.971 3.179 4.449) 12.258 7.252 ( -0.424 -0.818 -4.827) 4.914 7.252 ( 0.424 -0.818 4.827) 4.914 7.612 ( -0.070 -5.668 -3.276) 6.547 7.612 ( 0.070 -5.668 3.276) 6.547 9.014 ( 1.199 -1.815 -7.202) 7.523 9.014 ( -1.199 -1.815 7.202) 7.523 9.254 ( -4.021 2.229 -0.527) 4.627 9.254 ( 4.021 2.229 0.527) 4.627 9.511 ( -4.914 5.042 -4.377) 8.290 9.511 ( 4.914 5.042 4.377) 8.290 10.011 ( -4.163 -2.055 -2.095) 5.093 10.011 ( 4.163 -2.055 2.095) 5.093 10.467 ( 12.193 -5.687 -13.343) 18.949 10.467 ( -12.193 -5.687 13.343) 18.949 11.028 ( -8.378 3.977 -1.533) 9.400 11.028 ( 8.378 3.977 1.533) 9.400 11.345 ( -10.413 4.866 -5.733) 12.844 11.345 ( 10.413 4.866 5.733) 12.844 11.693 ( -7.511 0.166 -2.930) 8.064 11.693 ( 7.511 0.166 2.930) 8.064 11.917 ( 0.822 -1.985 -2.006) 2.940 11.917 ( -0.822 -1.985 2.006) 2.940 12.181 ( 0.902 6.405 -1.306) 6.599 12.181 ( -0.902 6.405 1.306) 6.599 12.382 ( -1.264 -4.753 -4.920) 6.957 12.382 ( 1.264 -4.753 4.920) 6.957 13.251 ( 0.979 -12.834 -2.746) 13.161 13.251 ( -0.979 -12.834 2.746) 13.161 14.821 ( -3.202 0.352 -3.431) 4.706 14.821 ( 3.202 0.352 3.431) 4.706 15.095 ( -0.011 -4.578 -1.426) 4.795 15.095 ( 0.011 -4.578 1.426) 4.795 15.477 ( -0.865 4.453 -3.972) 6.030 15.477 ( 0.865 4.453 3.972) 6.030 15.605 ( -1.299 1.511 -0.728) 2.122 15.605 ( 1.299 1.511 0.728) 2.122 16.049 ( -9.118 -3.416 -0.513) 9.750 16.049 ( 9.118 -3.416 0.513) 9.750 16.601 ( 3.252 -0.390 -4.734) 5.757 16.601 ( -3.252 -0.390 4.734) 5.757 17.184 ( 2.296 5.490 -6.284) 8.654 17.184 ( -2.296 5.490 6.284) 8.654 17.929 ( 1.465 0.735 -5.646) 5.879 17.929 ( -1.465 0.735 5.646) 5.879 25.805 ( 0.388 2.251 -1.163) 2.564 25.805 ( -0.388 2.251 1.163) 2.564 25.965 ( 0.100 -1.465 -1.595) 2.168 25.965 ( -0.100 -1.465 1.595) 2.168 26.115 ( -1.065 -2.534 -9.845) 10.222 26.115 ( 1.065 -2.534 9.845) 10.222 26.608 ( -1.234 1.816 -3.119) 3.814 26.608 ( 1.234 1.816 3.119) 3.814 27.234 ( -3.890 -3.350 -10.298) 11.507 27.234 ( 3.890 -3.350 10.298) 11.507 28.417 ( 3.066 0.826 -9.837) 10.336 28.417 ( -3.066 0.826 9.837) 10.336 28.956 ( -8.183 -7.541 -4.108) 11.862 28.956 ( 8.183 -7.541 4.108) 11.862 29.261 ( -3.180 10.927 -5.354) 12.577 29.261 ( 3.180 10.927 5.354) 12.577 ======================= Grid point 280 (135/140) ======================= q-point: ( 0.33 0.33 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 7.23e-05 7.23e-05 7.23e-05 7.23e-05 7.23e-05 7.23e-05 7.23e-05 7.23e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 135 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.914 ( 8.014 0.000 -1.640) 8.180 1.256 ( -0.779 -0.000 -5.180) 5.238 1.315 ( 15.124 0.000 -11.029) 18.719 1.990 ( -2.957 -0.000 -2.159) 3.662 2.193 ( -3.485 -0.000 -7.678) 8.432 2.236 ( 9.440 0.000 2.838) 9.857 2.417 ( 9.211 0.000 -1.372) 9.313 2.555 ( -15.002 -0.000 -10.509) 18.317 2.697 ( 1.184 0.000 10.733) 10.798 2.955 ( 20.270 0.000 -11.494) 23.302 2.996 ( -0.649 -0.000 -1.826) 1.938 3.240 ( -10.292 -0.000 3.954) 11.025 3.387 ( 0.072 0.000 12.912) 12.912 3.607 ( 7.614 0.000 -7.212) 10.487 3.621 ( -10.561 -0.000 -0.009) 10.561 3.920 ( -7.483 -0.000 0.821) 7.528 4.027 ( -4.954 -0.000 1.447) 5.161 4.048 ( -1.046 -0.000 -4.558) 4.677 4.294 ( 13.042 0.000 -7.382) 14.987 4.312 ( 0.425 0.000 2.802) 2.834 4.381 ( -4.897 -0.000 4.255) 6.488 4.803 ( -3.840 -0.000 8.174) 9.031 4.974 ( -7.686 -0.000 1.145) 7.771 5.021 ( 2.269 0.000 -5.420) 5.876 5.278 ( 2.552 0.000 8.756) 9.121 5.544 ( 2.252 0.000 -0.018) 2.253 5.593 ( -0.893 -0.000 2.917) 3.051 5.722 ( 5.867 0.000 -10.265) 11.823 6.103 ( 1.268 0.000 2.639) 2.928 6.279 ( 3.488 0.000 8.993) 9.646 6.382 ( -2.779 -0.000 -7.817) 8.297 6.470 ( 3.066 0.000 -5.246) 6.076 6.687 ( -2.275 -0.000 -3.496) 4.171 6.734 ( -3.729 -0.000 3.454) 5.083 6.978 ( 3.615 0.000 3.023) 4.712 7.139 ( 6.451 0.000 -5.699) 8.608 7.326 ( -4.272 -0.000 5.871) 7.261 7.427 ( -7.408 -0.000 8.335) 11.152 7.500 ( -6.951 -0.000 0.030) 6.951 7.641 ( 2.401 0.000 -6.034) 6.494 8.368 ( -0.654 -0.000 0.624) 0.904 8.838 ( -6.734 -0.000 -2.749) 7.273 9.013 ( 3.233 0.000 10.833) 11.305 9.237 ( 6.337 0.000 -2.176) 6.700 9.262 ( -2.701 -0.000 16.016) 16.242 9.438 ( 1.382 0.000 -3.585) 3.842 9.614 ( -10.111 -0.000 3.784) 10.796 10.023 ( 1.472 0.000 -5.393) 5.590 10.139 ( -6.630 -0.000 -6.830) 9.519 10.145 ( -8.895 -0.000 -19.380) 21.324 10.858 ( 11.303 0.000 -2.877) 11.663 11.025 ( 0.698 0.000 2.858) 2.942 11.350 ( 6.628 0.000 -7.990) 10.381 11.468 ( 6.443 0.000 9.502) 11.481 11.579 ( 4.701 0.000 -0.753) 4.761 11.855 ( -5.218 -0.000 -2.194) 5.661 11.891 ( -0.894 -0.000 -0.873) 1.250 12.041 ( 0.834 0.000 -6.151) 6.208 12.211 ( -3.754 -0.000 -11.986) 12.560 12.214 ( -1.747 -0.000 4.171) 4.522 12.406 ( -4.685 -0.000 3.451) 5.819 12.621 ( -8.389 -0.000 -3.535) 9.103 13.059 ( -1.740 -0.000 10.529) 10.671 13.476 ( -1.918 -0.000 -7.284) 7.532 14.850 ( -0.052 -0.000 -1.995) 1.996 14.932 ( -1.962 -0.000 3.613) 4.112 15.196 ( 2.236 0.000 3.433) 4.097 15.293 ( 0.860 0.000 -0.802) 1.176 15.303 ( -3.532 -0.000 -0.559) 3.576 15.481 ( -4.896 -0.000 -6.282) 7.964 15.704 ( 6.087 0.000 1.246) 6.213 15.743 ( -0.382 -0.000 5.943) 5.955 16.005 ( 1.463 0.000 2.014) 2.489 16.193 ( -0.768 -0.000 2.085) 2.222 16.332 ( 3.411 0.000 -0.895) 3.526 16.497 ( -3.692 -0.000 0.466) 3.721 17.571 ( 16.971 0.000 -1.762) 17.062 17.754 ( -0.480 -0.000 7.057) 7.073 17.987 ( 1.722 0.000 -4.194) 4.534 18.175 ( -8.016 -0.000 13.491) 15.692 25.704 ( 1.979 0.000 -1.239) 2.335 25.707 ( 0.931 0.000 0.725) 1.180 25.857 ( -1.899 -0.000 -0.237) 1.914 25.917 ( -2.730 -0.000 -0.738) 2.828 26.091 ( -2.590 -0.000 1.079) 2.806 26.195 ( -0.180 -0.000 -4.754) 4.757 26.619 ( -1.159 -0.000 -0.336) 1.206 26.649 ( -0.152 -0.000 -0.737) 0.752 27.035 ( -2.112 -0.000 2.659) 3.396 27.344 ( -8.403 -0.000 -22.477) 23.996 28.155 ( 8.400 0.000 0.279) 8.405 28.281 ( -5.041 -0.000 12.506) 13.484 28.345 ( -1.501 -0.000 2.876) 3.244 28.426 ( -0.316 -0.000 0.350) 0.471 29.850 ( 4.904 0.000 28.624) 29.041 30.272 ( 13.438 0.000 -20.470) 24.487 ======================= Grid point 281 (136/140) ======================= q-point: ( 0.44 0.33 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 7.23e-05 7.23e-05 7.23e-05 7.23e-05 7.23e-05 7.23e-05 7.23e-05 7.23e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 243 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.152 ( 4.693 -18.995 2.266) 19.697 1.412 ( -0.777 -18.934 -9.321) 21.119 1.537 ( 19.764 -10.516 2.215) 22.497 2.072 ( -3.396 -12.607 1.337) 13.125 2.198 ( -4.266 -7.500 -10.959) 13.948 2.315 ( 8.175 -1.761 0.109) 8.364 2.398 ( -9.410 -0.413 -0.748) 9.449 2.468 ( -0.165 -1.984 -5.673) 6.012 2.827 ( 2.078 -6.059 8.576) 10.704 2.955 ( 7.587 6.064 -5.999) 11.416 3.021 ( 0.133 -4.027 -1.172) 4.196 3.207 ( -6.379 2.156 2.691) 7.251 3.419 ( -0.466 -1.093 6.031) 6.147 3.525 ( -4.838 2.776 -1.562) 5.792 3.688 ( 7.778 -6.971 -6.558) 12.332 3.947 ( -10.063 -9.031 2.108) 13.685 3.994 ( -1.403 0.318 2.476) 2.863 4.064 ( -0.954 -4.095 -6.756) 7.958 4.272 ( 3.199 4.723 0.195) 5.708 4.332 ( -4.720 3.518 3.658) 6.931 4.398 ( 11.474 -1.380 -2.734) 11.876 4.793 ( -6.641 -0.308 6.389) 9.220 4.895 ( -3.978 3.548 -0.187) 5.333 5.001 ( 0.710 1.740 -5.179) 5.509 5.355 ( 1.569 -1.625 9.610) 9.872 5.541 ( 1.969 2.785 2.557) 4.263 5.594 ( -2.251 -0.583 -1.378) 2.703 5.707 ( 1.926 -0.652 -10.664) 10.856 6.106 ( 3.523 3.227 4.729) 6.722 6.279 ( 0.826 3.529 -5.373) 6.481 6.355 ( 4.444 0.877 9.173) 10.230 6.477 ( 3.003 -0.556 -5.292) 6.110 6.574 ( -1.749 5.367 0.145) 5.647 6.769 ( -7.286 -2.254 0.204) 7.629 7.023 ( 2.815 -1.224 1.729) 3.523 7.167 ( 6.771 -1.415 -3.676) 7.833 7.289 ( -4.273 5.092 2.518) 7.108 7.365 ( -8.547 3.094 7.922) 12.057 7.494 ( -3.343 -2.415 0.575) 4.164 7.623 ( 1.647 0.870 -6.437) 6.701 8.479 ( 2.317 -9.940 2.134) 10.427 8.786 ( -9.151 -4.492 -3.414) 10.751 9.105 ( 2.430 -1.924 9.317) 9.819 9.257 ( 3.270 -0.925 -5.131) 6.154 9.336 ( 2.570 0.650 14.104) 14.351 9.480 ( 0.354 -3.416 1.143) 3.619 9.641 ( -3.204 -8.346 2.898) 9.398 9.972 ( 1.509 2.169 -6.490) 7.008 10.054 ( -7.193 -3.027 -13.900) 15.941 10.084 ( -8.019 -5.347 -5.165) 10.935 10.931 ( 9.475 -0.051 -0.247) 9.478 11.080 ( 0.301 -4.339 0.282) 4.359 11.373 ( 7.643 -0.285 -5.770) 9.580 11.522 ( 2.588 0.786 3.883) 4.732 11.644 ( 2.988 -1.441 2.182) 3.971 11.815 ( -1.786 -0.938 1.350) 2.427 11.876 ( -0.246 0.721 -0.834) 1.129 11.996 ( -2.547 2.059 -6.439) 7.224 12.136 ( -0.859 -0.767 -7.465) 7.553 12.256 ( -5.569 -5.938 1.455) 8.270 12.406 ( -2.760 -0.131 4.583) 5.351 12.542 ( -7.083 -0.976 -3.977) 8.181 13.057 ( 4.477 7.680 8.895) 12.576 13.360 ( -3.849 7.146 -6.631) 10.481 14.844 ( 2.685 0.677 -3.176) 4.214 14.928 ( -4.860 0.301 4.232) 6.451 15.110 ( 1.138 8.051 3.608) 8.895 15.261 ( -1.049 4.091 -4.159) 5.927 15.360 ( -1.837 -4.648 3.225) 5.948 15.424 ( -0.997 -1.067 -5.246) 5.446 15.705 ( 1.472 3.195 4.725) 5.891 15.761 ( 2.739 1.767 -2.129) 3.893 16.009 ( 4.259 2.367 3.025) 5.735 16.183 ( -3.564 0.278 0.771) 3.657 16.383 ( 2.663 -2.821 1.671) 4.224 16.515 ( -3.198 -4.152 -1.586) 5.476 17.635 ( 15.806 5.849 -1.315) 16.905 17.806 ( 0.857 -1.068 5.740) 5.901 17.977 ( 0.423 -0.239 -4.534) 4.560 18.064 ( -11.035 9.437 9.098) 17.135 25.728 ( 1.888 -1.621 -0.640) 2.569 25.739 ( 0.989 -2.276 0.851) 2.623 25.848 ( -1.622 -0.681 -0.001) 1.759 25.900 ( -2.832 -1.073 -1.456) 3.361 26.063 ( -0.131 2.060 1.498) 2.550 26.170 ( -1.779 -0.401 -4.921) 5.248 26.600 ( -0.814 0.507 -0.192) 0.978 26.658 ( -1.328 -1.691 -2.710) 3.459 27.018 ( 0.451 1.430 5.276) 5.485 27.255 ( -4.932 -4.196 -15.374) 16.682 28.213 ( 6.477 -0.214 1.705) 6.701 28.329 ( -4.098 -3.700 6.132) 8.251 28.377 ( 0.765 -2.250 4.014) 4.665 28.471 ( -1.223 -5.504 0.387) 5.651 29.936 ( -0.335 7.521 25.373) 26.466 30.194 ( 10.731 8.242 -21.037) 25.013 ======================= Grid point 282 (137/140) ======================= q-point: ( 0.56 0.33 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 7.23e-05 7.23e-05 7.23e-05 7.23e-05 7.23e-05 7.23e-05 7.23e-05 7.23e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 243 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.549 ( 3.202 -20.832 3.332) 21.338 1.668 ( -2.691 -18.250 -9.375) 20.693 1.924 ( 14.276 -14.647 7.989) 21.958 2.194 ( 0.350 -2.678 -11.032) 11.357 2.266 ( -1.350 -6.538 -0.737) 6.716 2.350 ( -9.853 -0.881 4.245) 10.765 2.496 ( 0.981 -12.626 1.834) 12.796 2.526 ( 1.457 -9.729 -4.470) 10.805 2.897 ( 3.201 2.373 2.067) 4.489 2.951 ( -0.218 -3.670 -1.241) 3.880 3.116 ( -5.365 -0.653 5.103) 7.433 3.127 ( -0.630 -6.535 -2.977) 7.209 3.449 ( 1.012 2.361 -1.123) 2.804 3.462 ( -3.550 -2.060 2.612) 4.865 3.876 ( 9.463 -7.118 -0.682) 11.861 3.990 ( 1.544 0.349 -0.005) 1.583 4.036 ( -9.395 -6.249 1.201) 11.348 4.070 ( -1.901 0.271 -6.191) 6.482 4.214 ( 5.661 1.930 -6.095) 8.540 4.254 ( -7.959 1.576 7.012) 10.723 4.526 ( 12.630 -3.672 0.979) 13.190 4.741 ( -11.089 -0.560 -2.197) 11.319 4.848 ( 5.088 2.771 2.282) 6.227 4.935 ( -2.767 2.573 -2.335) 4.442 5.425 ( 2.505 0.391 5.959) 6.476 5.528 ( -2.992 -0.033 2.445) 3.864 5.563 ( -0.597 1.385 1.861) 2.395 5.666 ( -1.329 -0.656 -10.487) 10.591 6.121 ( 6.342 2.460 5.530) 8.767 6.231 ( -0.391 0.799 -3.833) 3.935 6.389 ( 2.572 2.996 5.458) 6.737 6.454 ( -1.249 2.773 -3.085) 4.332 6.555 ( 8.136 -0.608 2.305) 8.478 6.713 ( -8.093 0.416 -0.032) 8.104 7.059 ( 0.453 -0.115 1.049) 1.148 7.123 ( -5.011 5.349 -2.707) 7.813 7.266 ( 6.331 -0.503 -1.994) 6.656 7.308 ( -5.967 0.735 7.164) 9.352 7.482 ( 0.017 1.999 1.450) 2.469 7.567 ( -2.103 1.394 -6.977) 7.419 8.693 ( 2.863 -10.105 3.408) 11.042 8.814 ( -7.138 -7.599 -3.999) 11.166 9.199 ( 2.523 -2.316 6.202) 7.085 9.274 ( 0.287 -1.792 -4.972) 5.293 9.431 ( 6.297 -1.324 9.604) 11.560 9.540 ( -2.559 -3.608 1.997) 4.853 9.814 ( 4.658 -6.537 1.551) 8.175 9.965 ( -3.963 -0.352 4.437) 5.959 9.992 ( 5.087 -6.003 -18.008) 19.652 10.127 ( -13.521 -10.168 0.249) 16.919 11.006 ( 7.895 -0.173 2.962) 8.434 11.132 ( -3.309 -3.155 -3.882) 5.998 11.423 ( 8.419 -0.346 -1.585) 8.574 11.528 ( -2.948 -1.384 -1.787) 3.715 11.696 ( 2.888 -0.313 6.245) 6.887 11.841 ( 0.797 -0.315 -4.244) 4.330 11.863 ( -3.882 1.975 1.836) 4.727 11.870 ( -1.524 3.952 -1.092) 4.374 12.167 ( 4.839 -3.349 -3.148) 6.674 12.295 ( -11.063 -4.828 -1.417) 12.153 12.442 ( 1.767 -3.322 5.143) 6.372 12.519 ( -3.093 -3.197 -4.212) 6.126 12.968 ( 6.838 11.666 6.490) 14.999 13.129 ( -6.349 11.039 -5.458) 13.855 14.833 ( 4.903 1.725 -4.864) 7.119 14.873 ( -5.594 3.167 4.885) 8.074 15.053 ( 1.697 2.786 3.786) 4.997 15.137 ( -3.489 4.298 -4.197) 6.947 15.426 ( 0.409 -2.676 0.784) 2.818 15.441 ( -0.075 -2.569 -1.217) 2.844 15.689 ( 0.720 2.065 3.461) 4.095 15.721 ( 1.387 2.354 -3.713) 4.610 16.023 ( 6.559 2.698 1.742) 7.303 16.132 ( -6.612 1.785 0.923) 6.910 16.470 ( 1.675 -3.459 4.395) 5.838 16.543 ( -1.921 -3.206 -4.382) 5.759 17.614 ( 13.800 9.686 -2.356) 17.024 17.764 ( -8.178 10.608 4.198) 14.037 17.902 ( -1.534 2.120 6.175) 6.707 17.958 ( -0.796 -0.333 -4.726) 4.804 25.779 ( 1.888 -2.746 0.050) 3.333 25.796 ( 0.031 -3.341 0.613) 3.397 25.856 ( -0.132 -0.761 0.966) 1.237 25.893 ( -2.268 -1.217 -1.717) 3.095 26.049 ( 2.267 1.449 2.174) 3.459 26.129 ( -3.549 0.057 -4.454) 5.695 26.598 ( 0.653 -0.151 1.429) 1.578 26.650 ( -1.993 -1.025 -4.069) 4.646 27.066 ( 2.229 -1.047 9.117) 9.444 27.210 ( -3.973 -2.201 -11.657) 12.510 28.289 ( 4.633 -2.122 3.561) 6.217 28.368 ( -2.927 -3.148 -1.345) 4.504 28.494 ( 2.371 -6.613 6.270) 9.416 28.574 ( -2.748 -8.358 -1.503) 8.926 29.862 ( -2.253 12.312 18.678) 22.484 29.974 ( 6.606 13.620 -18.524) 23.923 ======================= Grid point 283 (138/140) ======================= q-point: ( 0.67 0.33 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 7.23e-05 7.23e-05 7.23e-05 7.23e-05 7.23e-05 7.23e-05 7.23e-05 7.23e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 126 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.889 ( -1.650 -14.128 -5.834) 15.374 1.889 ( 1.650 -14.128 5.834) 15.374 2.173 ( -0.986 1.884 -3.519) 4.112 2.173 ( 0.986 1.884 3.519) 4.112 2.355 ( -10.994 -9.361 -1.848) 14.557 2.355 ( 10.994 -9.361 1.848) 14.557 2.698 ( -0.487 -8.202 -4.522) 9.378 2.698 ( 0.487 -8.202 4.522) 9.378 2.962 ( -0.771 -4.016 -9.806) 10.625 2.962 ( 0.771 -4.016 9.806) 10.625 3.177 ( -2.811 -2.625 -6.535) 7.583 3.177 ( 2.811 -2.625 6.535) 7.583 3.486 ( -2.719 -4.262 -3.745) 6.292 3.486 ( 2.719 -4.262 3.745) 6.292 3.905 ( -1.178 8.357 -7.574) 11.340 3.905 ( 1.178 8.357 7.574) 11.340 4.086 ( -0.465 -5.485 -4.154) 6.896 4.086 ( 0.465 -5.485 4.154) 6.896 4.247 ( 6.422 -2.116 -10.100) 12.154 4.247 ( -6.422 -2.116 10.100) 12.154 4.689 ( -4.688 -3.801 -4.188) 7.346 4.689 ( 4.688 -3.801 4.188) 7.346 4.849 ( -5.125 3.218 0.053) 6.052 4.849 ( 5.125 3.218 -0.053) 6.052 5.464 ( -4.545 1.255 -6.601) 8.112 5.464 ( 4.545 1.255 6.601) 8.112 5.626 ( -1.360 -2.896 -10.425) 10.905 5.626 ( 1.360 -2.896 10.425) 10.905 6.158 ( -7.139 3.133 -3.936) 8.734 6.158 ( 7.139 3.133 3.936) 8.734 6.376 ( -1.627 2.566 -2.796) 4.129 6.376 ( 1.627 2.566 2.796) 4.129 6.659 ( -4.200 -1.839 -1.776) 4.917 6.659 ( 4.200 -1.839 1.776) 4.917 7.022 ( 0.626 3.978 -3.955) 5.644 7.022 ( -0.626 3.978 3.955) 5.644 7.281 ( 2.354 1.280 -10.373) 10.714 7.281 ( -2.354 1.280 10.373) 10.714 7.500 ( -2.744 -0.470 -6.527) 7.096 7.500 ( 2.744 -0.470 6.527) 7.096 8.871 ( -0.924 -6.090 -6.323) 8.827 8.871 ( 0.924 -6.090 6.323) 8.827 9.270 ( 0.909 -1.050 -5.410) 5.585 9.270 ( -0.909 -1.050 5.410) 5.585 9.555 ( -5.472 -2.476 -5.646) 8.243 9.555 ( 5.472 -2.476 5.646) 8.243 9.926 ( -5.774 -2.493 -2.100) 6.631 9.926 ( 5.774 -2.493 2.100) 6.631 10.200 ( 9.134 -9.788 -11.310) 17.526 10.200 ( -9.134 -9.788 11.310) 17.526 11.090 ( -6.326 -0.124 -5.311) 8.261 11.090 ( 6.326 -0.124 5.311) 8.261 11.489 ( -8.181 1.228 -3.637) 9.037 11.489 ( 8.181 1.228 3.637) 9.037 11.728 ( 0.607 2.659 -5.525) 6.161 11.728 ( -0.607 2.659 5.525) 6.161 11.859 ( 1.505 -0.736 -0.783) 1.850 11.859 ( -1.505 -0.736 0.783) 1.850 12.255 ( -2.894 -0.996 -4.645) 5.563 12.255 ( 2.894 -0.996 4.645) 5.563 12.516 ( -0.688 2.443 -4.001) 4.738 12.516 ( 0.688 2.443 4.001) 4.738 12.919 ( -7.189 0.669 -4.191) 8.348 12.919 ( 7.189 0.669 4.191) 8.348 14.823 ( 3.274 0.661 -4.402) 5.526 14.823 ( -3.274 0.661 4.402) 5.526 15.049 ( -0.845 1.561 -4.010) 4.385 15.049 ( 0.845 1.561 4.010) 4.385 15.479 ( 0.252 -2.764 -1.593) 3.200 15.479 ( -0.252 -2.764 1.593) 3.200 15.675 ( 0.459 2.124 -2.510) 3.320 15.675 ( -0.459 2.124 2.510) 3.320 16.038 ( -5.256 2.380 -1.550) 5.974 16.038 ( 5.256 2.380 1.550) 5.974 16.556 ( 0.495 -2.481 -6.508) 6.982 16.556 ( -0.495 -2.481 6.508) 6.982 17.501 ( 1.801 12.310 -4.627) 13.274 17.501 ( -1.801 12.310 4.627) 13.274 17.931 ( 0.088 -0.388 -6.055) 6.068 17.931 ( -0.088 -0.388 6.055) 6.068 25.838 ( -1.589 -1.698 -0.460) 2.371 25.838 ( 1.589 -1.698 0.460) 2.371 25.888 ( -1.906 -1.550 -1.594) 2.929 25.888 ( 1.906 -1.550 1.594) 2.929 26.076 ( 0.271 0.070 -7.947) 7.952 26.076 ( -0.271 0.070 7.947) 7.952 26.628 ( -1.791 -0.442 -3.646) 4.086 26.628 ( 1.791 -0.442 3.646) 4.086 27.158 ( -2.774 -1.520 -10.736) 11.193 27.158 ( 2.774 -1.520 10.736) 11.193 28.381 ( 1.884 -2.604 -8.282) 8.884 28.381 ( -1.884 -2.604 8.282) 8.884 28.676 ( -3.856 -8.530 -4.663) 10.458 28.676 ( 3.856 -8.530 4.663) 10.458 29.693 ( 2.855 14.140 -12.694) 19.216 29.693 ( -2.855 14.140 12.694) 19.216 ======================= Grid point 291 (139/140) ======================= q-point: ( 0.44 0.44 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 7.23e-05 7.23e-05 7.23e-05 7.23e-05 7.23e-05 7.23e-05 7.23e-05 7.23e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 135 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.067 ( 7.256 0.000 4.553) 8.566 1.181 ( -2.127 -0.000 -4.433) 4.916 1.656 ( 23.751 0.000 9.198) 25.470 1.924 ( -2.424 -0.000 2.146) 3.237 2.021 ( -4.991 -0.000 -8.844) 10.155 2.139 ( -18.838 -0.000 -15.280) 24.256 2.432 ( 7.287 0.000 2.340) 7.654 2.495 ( 0.541 0.000 0.612) 0.817 2.849 ( 4.069 0.000 11.254) 11.967 2.981 ( 0.343 0.000 -4.568) 4.581 3.076 ( 6.862 0.000 -9.252) 11.519 3.126 ( -8.474 -0.000 3.613) 9.212 3.469 ( 0.240 0.000 5.323) 5.329 3.572 ( -0.292 -0.000 -10.193) 10.197 3.592 ( 5.826 0.000 6.296) 8.577 3.776 ( -10.641 -0.000 -1.314) 10.722 3.990 ( -1.879 -0.000 2.035) 2.770 4.001 ( 0.553 0.000 -3.886) 3.925 4.333 ( 2.664 0.000 -2.414) 3.595 4.354 ( -4.430 -0.000 4.686) 6.448 4.485 ( 15.593 0.000 -1.951) 15.715 4.704 ( -15.015 -0.000 3.711) 15.466 4.948 ( 0.226 0.000 3.476) 3.483 4.991 ( 0.396 0.000 -4.770) 4.787 5.409 ( 1.800 0.000 11.192) 11.336 5.544 ( -2.375 -0.000 -7.755) 8.110 5.603 ( 3.300 0.000 2.268) 4.004 5.670 ( -0.125 -0.000 -6.127) 6.128 6.179 ( 2.539 0.000 4.966) 5.578 6.265 ( -1.537 -0.000 -7.122) 7.286 6.436 ( 2.814 0.000 7.972) 8.454 6.478 ( 3.826 0.000 -4.180) 5.666 6.629 ( -0.999 -0.000 -2.147) 2.368 6.661 ( -6.320 -0.000 0.773) 6.368 7.066 ( 4.383 0.000 3.757) 5.773 7.153 ( 1.398 0.000 -5.745) 5.913 7.333 ( -5.277 -0.000 6.107) 8.071 7.363 ( -4.513 -0.000 -3.700) 5.836 7.483 ( 2.234 0.000 11.253) 11.472 7.606 ( 0.398 0.000 -8.880) 8.889 8.445 ( 7.218 0.000 3.908) 8.208 8.640 ( -11.256 -0.000 -4.902) 12.277 9.148 ( -0.336 -0.000 12.147) 12.152 9.239 ( 2.283 0.000 -9.655) 9.921 9.435 ( 1.843 0.000 7.509) 7.732 9.439 ( 4.376 0.000 -4.942) 6.601 9.572 ( -4.983 -0.000 19.553) 20.177 9.816 ( -5.373 -0.000 -21.546) 22.206 10.011 ( 0.722 0.000 -3.740) 3.809 10.019 ( -2.607 -0.000 -1.806) 3.171 10.989 ( 8.007 0.000 -2.709) 8.452 11.041 ( -2.614 -0.000 2.969) 3.955 11.406 ( 8.224 0.000 -3.731) 9.031 11.520 ( -6.386 -0.000 -0.273) 6.392 11.704 ( 7.960 0.000 5.895) 9.905 11.800 ( 1.531 0.000 1.427) 2.093 11.876 ( 1.891 0.000 -4.279) 4.678 11.944 ( -9.292 -0.000 -2.384) 9.593 12.104 ( 1.315 0.000 -5.346) 5.506 12.153 ( -6.549 -0.000 0.377) 6.560 12.424 ( -1.069 -0.000 6.362) 6.451 12.478 ( -2.545 -0.000 -4.058) 4.790 13.207 ( 5.811 0.000 7.836) 9.756 13.359 ( -4.417 -0.000 -6.779) 8.091 14.863 ( 3.898 0.000 -2.076) 4.417 14.911 ( -4.788 -0.000 3.055) 5.679 15.253 ( 1.681 0.000 1.118) 2.019 15.259 ( -4.982 -0.000 8.273) 9.657 15.313 ( 6.303 0.000 -8.970) 10.963 15.359 ( -4.692 -0.000 -2.201) 5.183 15.777 ( 2.680 0.000 -0.339) 2.702 15.784 ( -0.630 -0.000 3.231) 3.292 16.072 ( 4.457 0.000 1.698) 4.769 16.156 ( -4.101 -0.000 -0.799) 4.179 16.386 ( 3.300 0.000 0.692) 3.372 16.443 ( -3.244 -0.000 -0.614) 3.301 17.801 ( 13.143 0.000 -2.013) 13.297 17.828 ( 1.322 0.000 5.197) 5.362 17.962 ( 3.230 0.000 -5.718) 6.567 18.078 ( -15.702 -0.000 7.679) 17.479 25.724 ( 1.518 0.000 -0.555) 1.616 25.728 ( 0.493 0.000 0.648) 0.815 25.833 ( -0.738 -0.000 0.688) 1.009 25.861 ( -2.304 -0.000 -1.843) 2.950 26.088 ( -1.636 -0.000 4.933) 5.197 26.133 ( 0.454 0.000 -7.152) 7.166 26.604 ( -0.384 -0.000 0.939) 1.014 26.624 ( -0.652 -0.000 -2.164) 2.260 27.056 ( -1.494 -0.000 6.964) 7.122 27.130 ( 0.340 0.000 -12.361) 12.366 28.254 ( 7.032 0.000 -4.736) 8.478 28.291 ( -5.891 -0.000 7.615) 9.628 28.383 ( 0.318 0.000 4.569) 4.580 28.418 ( -0.353 -0.000 -1.293) 1.340 30.112 ( -5.537 -0.000 27.120) 27.679 30.236 ( 10.093 0.000 -23.955) 25.994 ======================= Grid point 292 (140/140) ======================= q-point: ( 0.56 0.44 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 7.23e-05 7.23e-05 7.23e-05 7.23e-05 7.23e-05 7.23e-05 7.23e-05 7.23e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 126 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.286 ( -3.545 -16.261 -9.156) 18.995 1.286 ( 3.545 -16.261 9.156) 18.995 1.923 ( -17.155 -6.237 -11.508) 21.578 1.923 ( 17.155 -6.237 11.508) 21.578 2.123 ( -5.403 -14.730 -6.606) 17.024 2.123 ( 5.403 -14.730 6.606) 17.024 2.461 ( -2.525 1.812 -1.823) 3.603 2.461 ( 2.525 1.812 1.823) 3.603 2.941 ( -2.904 -0.178 -5.267) 6.018 2.941 ( 2.904 -0.178 5.267) 6.018 3.074 ( -8.904 0.311 -0.065) 8.910 3.074 ( 8.904 0.311 0.065) 8.910 3.475 ( 0.403 2.506 -5.642) 6.187 3.475 ( -0.403 2.506 5.642) 6.187 3.790 ( -1.498 -9.853 -4.074) 10.767 3.790 ( 1.498 -9.853 4.074) 10.767 4.012 ( 0.971 -2.170 -4.816) 5.371 4.012 ( -0.971 -2.170 4.816) 5.371 4.299 ( 4.270 4.585 -5.429) 8.290 4.299 ( -4.270 4.585 5.429) 8.290 4.609 ( -15.230 -1.144 0.301) 15.275 4.609 ( 15.230 -1.144 -0.301) 15.275 4.941 ( -1.776 2.726 -4.478) 5.535 4.941 ( 1.776 2.726 4.478) 5.535 5.483 ( -2.949 -0.255 -8.974) 9.449 5.483 ( 2.949 -0.255 8.974) 9.449 5.625 ( -1.740 1.416 -5.373) 5.822 5.625 ( 1.740 1.416 5.373) 5.822 6.211 ( -2.410 1.145 -5.780) 6.366 6.211 ( 2.410 1.145 5.780) 6.366 6.465 ( 0.029 1.497 -5.055) 5.272 6.465 ( -0.029 1.497 5.055) 5.272 6.629 ( -7.121 -0.316 -2.575) 7.579 6.629 ( 7.121 -0.316 2.575) 7.579 7.112 ( -4.480 1.028 -4.317) 6.306 7.112 ( 4.480 1.028 4.317) 6.306 7.312 ( 5.299 1.642 -5.532) 7.835 7.312 ( -5.299 1.642 5.532) 7.835 7.543 ( -1.591 1.274 -8.135) 8.386 7.543 ( 1.591 1.274 8.135) 8.386 8.601 ( -8.319 -7.348 -4.216) 11.873 8.601 ( 8.319 -7.348 4.216) 11.873 9.210 ( 0.669 -1.410 -9.386) 9.515 9.210 ( -0.669 -1.410 9.386) 9.515 9.470 ( -1.382 -1.956 -2.385) 3.380 9.470 ( 1.382 -1.956 2.385) 3.380 9.755 ( -0.900 -8.519 -20.438) 22.161 9.755 ( 0.900 -8.519 20.438) 22.161 9.993 ( 1.638 0.735 -3.949) 4.338 9.993 ( -1.638 0.735 3.949) 4.338 11.046 ( -0.249 -1.985 -3.768) 4.266 11.046 ( 0.249 -1.985 3.768) 4.266 11.464 ( -7.491 -0.572 0.424) 7.524 11.464 ( 7.491 -0.572 -0.424) 7.524 11.782 ( -4.305 0.769 -9.557) 10.510 11.782 ( 4.305 0.769 9.557) 10.510 11.885 ( 2.236 -0.124 -5.413) 5.858 11.885 ( -2.236 -0.124 5.413) 5.858 12.139 ( -1.194 -3.450 -1.474) 3.937 12.139 ( 1.194 -3.450 1.474) 3.937 12.451 ( -0.401 -0.557 -5.144) 5.190 12.451 ( 0.401 -0.557 5.144) 5.190 13.220 ( -5.711 7.710 -6.789) 11.754 13.220 ( 5.711 7.710 6.789) 11.754 14.880 ( 5.325 0.919 -3.321) 6.343 14.880 ( -5.325 0.919 3.321) 6.343 15.181 ( -0.554 6.416 -6.209) 8.946 15.181 ( 0.554 6.416 6.209) 8.946 15.380 ( 3.243 -3.773 -6.789) 8.417 15.380 ( -3.243 -3.773 6.789) 8.417 15.756 ( 0.686 3.077 -4.096) 5.168 15.756 ( -0.686 3.077 4.096) 5.168 16.109 ( -3.067 0.999 -2.851) 4.305 16.109 ( 3.067 0.999 2.851) 4.305 16.447 ( -2.268 -3.314 -2.830) 4.912 16.447 ( 2.268 -3.314 2.830) 4.912 17.828 ( 8.899 3.570 -3.756) 10.297 17.828 ( -8.899 3.570 3.756) 10.297 17.957 ( 6.841 3.304 -5.981) 9.669 17.957 ( -6.841 3.304 5.981) 9.669 25.748 ( 0.159 -2.011 -0.283) 2.037 25.748 ( -0.159 -2.011 0.283) 2.037 25.849 ( -1.037 -1.044 -1.702) 2.250 25.849 ( 1.037 -1.044 1.702) 2.250 26.098 ( 1.186 0.796 -6.603) 6.756 26.098 ( -1.186 0.796 6.603) 6.756 26.612 ( -0.808 -0.199 -2.325) 2.469 26.612 ( 0.808 -0.199 2.325) 2.469 27.101 ( -0.312 -1.714 -9.907) 10.059 27.101 ( 0.312 -1.714 9.907) 10.059 28.295 ( 3.950 -1.856 -6.061) 7.469 28.295 ( -3.950 -1.856 6.061) 7.469 28.440 ( -1.121 -4.169 -3.380) 5.483 28.440 ( 1.121 -4.169 3.380) 5.483 30.113 ( 7.108 8.363 -23.747) 26.161 30.113 ( -7.108 8.363 23.747) 26.161 =================== 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 3/46656 10.0 1011.544 617.514 798.658 -0.000 -35.120 0.000 3/46656 20.0 187.317 161.269 164.197 -0.000 -0.359 0.000 3/46656 30.0 76.826 76.616 69.116 -0.000 0.395 0.000 3/46656 40.0 43.187 45.865 39.770 -0.000 0.410 0.000 3/46656 50.0 28.510 31.197 26.732 -0.000 0.356 0.000 3/46656 60.0 20.732 23.031 19.701 -0.000 0.307 0.000 3/46656 70.0 16.066 17.985 15.421 -0.000 0.267 0.000 3/46656 80.0 13.016 14.623 12.589 -0.000 0.235 0.000 3/46656 90.0 10.896 12.256 10.600 -0.000 0.208 0.000 3/46656 100.0 9.349 10.516 9.136 -0.000 0.186 0.000 3/46656 110.0 8.179 9.191 8.020 -0.000 0.168 0.000 3/46656 120.0 7.268 8.155 7.145 -0.000 0.152 0.000 3/46656 130.0 6.540 7.326 6.442 -0.000 0.139 0.000 3/46656 140.0 5.946 6.648 5.866 -0.000 0.128 0.000 3/46656 150.0 5.454 6.085 5.386 -0.000 0.118 0.000 3/46656 160.0 5.040 5.612 4.980 -0.000 0.109 0.000 3/46656 170.0 4.687 5.207 4.633 -0.000 0.102 0.000 3/46656 180.0 4.383 4.858 4.333 -0.000 0.095 0.000 3/46656 190.0 4.118 4.555 4.070 -0.000 0.089 0.000 3/46656 200.0 3.885 4.288 3.840 -0.000 0.084 0.000 3/46656 210.0 3.679 4.052 3.635 -0.000 0.080 0.000 3/46656 220.0 3.495 3.841 3.452 -0.000 0.076 0.000 3/46656 230.0 3.330 3.652 3.288 -0.000 0.073 0.000 3/46656 240.0 3.181 3.482 3.139 -0.000 0.069 0.000 3/46656 250.0 3.046 3.328 3.004 -0.000 0.067 0.000 3/46656 260.0 2.923 3.187 2.882 -0.000 0.064 0.000 3/46656 270.0 2.811 3.059 2.769 -0.000 0.062 0.000 3/46656 280.0 2.707 2.941 2.665 -0.000 0.060 0.000 3/46656 290.0 2.612 2.832 2.570 -0.000 0.058 0.000 3/46656 300.0 2.523 2.731 2.481 -0.000 0.057 0.000 3/46656 310.0 2.441 2.638 2.399 -0.000 0.055 0.000 3/46656 320.0 2.364 2.551 2.323 -0.000 0.054 0.000 3/46656 330.0 2.293 2.470 2.251 -0.000 0.053 0.000 3/46656 340.0 2.226 2.394 2.184 -0.000 0.052 0.000 3/46656 350.0 2.163 2.323 2.121 -0.000 0.050 0.000 3/46656 360.0 2.104 2.257 2.062 -0.000 0.049 0.000 3/46656 370.0 2.048 2.194 2.006 -0.000 0.048 0.000 3/46656 380.0 1.995 2.135 1.954 -0.000 0.048 0.000 3/46656 390.0 1.946 2.079 1.904 -0.000 0.047 0.000 3/46656 400.0 1.898 2.026 1.857 -0.000 0.046 0.000 3/46656 410.0 1.853 1.975 1.812 -0.000 0.045 0.000 3/46656 420.0 1.810 1.928 1.769 -0.000 0.044 0.000 3/46656 430.0 1.770 1.882 1.729 -0.000 0.044 0.000 3/46656 440.0 1.731 1.839 1.690 -0.000 0.043 0.000 3/46656 450.0 1.694 1.798 1.653 -0.000 0.042 0.000 3/46656 460.0 1.658 1.759 1.618 -0.000 0.042 0.000 3/46656 470.0 1.624 1.721 1.584 -0.000 0.041 0.000 3/46656 480.0 1.592 1.685 1.552 -0.000 0.041 0.000 3/46656 490.0 1.560 1.651 1.521 -0.000 0.040 0.000 3/46656 500.0 1.530 1.617 1.491 -0.000 0.039 0.000 3/46656 510.0 1.502 1.586 1.462 -0.000 0.039 0.000 3/46656 520.0 1.474 1.555 1.435 -0.000 0.038 0.000 3/46656 530.0 1.447 1.526 1.408 -0.000 0.038 0.000 3/46656 540.0 1.421 1.498 1.383 -0.000 0.037 0.000 3/46656 550.0 1.397 1.471 1.358 -0.000 0.037 0.000 3/46656 560.0 1.373 1.445 1.335 -0.000 0.036 0.000 3/46656 570.0 1.350 1.419 1.312 -0.000 0.036 0.000 3/46656 580.0 1.327 1.395 1.290 -0.000 0.036 0.000 3/46656 590.0 1.306 1.371 1.269 -0.000 0.035 0.000 3/46656 600.0 1.285 1.349 1.248 -0.000 0.035 0.000 3/46656 610.0 1.264 1.327 1.228 -0.000 0.034 0.000 3/46656 620.0 1.245 1.305 1.209 -0.000 0.034 0.000 3/46656 630.0 1.226 1.285 1.190 -0.000 0.033 0.000 3/46656 640.0 1.207 1.265 1.172 -0.000 0.033 0.000 3/46656 650.0 1.189 1.246 1.154 -0.000 0.033 0.000 3/46656 660.0 1.172 1.227 1.137 -0.000 0.032 0.000 3/46656 670.0 1.155 1.209 1.121 -0.000 0.032 0.000 3/46656 680.0 1.139 1.191 1.104 -0.000 0.032 0.000 3/46656 690.0 1.123 1.174 1.089 -0.000 0.031 0.000 3/46656 700.0 1.107 1.157 1.074 -0.000 0.031 0.000 3/46656 710.0 1.092 1.141 1.059 -0.000 0.031 0.000 3/46656 720.0 1.078 1.126 1.045 -0.000 0.030 0.000 3/46656 730.0 1.063 1.110 1.031 -0.000 0.030 0.000 3/46656 740.0 1.050 1.095 1.017 -0.000 0.030 0.000 3/46656 750.0 1.036 1.081 1.004 -0.000 0.029 0.000 3/46656 760.0 1.023 1.067 0.991 -0.000 0.029 0.000 3/46656 770.0 1.010 1.053 0.978 -0.000 0.029 0.000 3/46656 780.0 0.997 1.040 0.966 -0.000 0.028 0.000 3/46656 790.0 0.985 1.027 0.954 -0.000 0.028 0.000 3/46656 800.0 0.973 1.014 0.942 -0.000 0.028 0.000 3/46656 810.0 0.962 1.002 0.931 -0.000 0.028 0.000 3/46656 820.0 0.950 0.989 0.920 -0.000 0.027 0.000 3/46656 830.0 0.939 0.978 0.909 -0.000 0.027 0.000 3/46656 840.0 0.928 0.966 0.898 -0.000 0.027 0.000 3/46656 850.0 0.918 0.955 0.888 -0.000 0.026 0.000 3/46656 860.0 0.907 0.944 0.878 -0.000 0.026 0.000 3/46656 870.0 0.897 0.933 0.868 -0.000 0.026 0.000 3/46656 880.0 0.887 0.923 0.858 -0.000 0.026 0.000 3/46656 890.0 0.878 0.912 0.849 -0.000 0.025 0.000 3/46656 900.0 0.868 0.902 0.840 -0.000 0.025 0.000 3/46656 910.0 0.859 0.892 0.830 -0.000 0.025 0.000 3/46656 920.0 0.850 0.883 0.822 -0.000 0.025 0.000 3/46656 930.0 0.841 0.873 0.813 -0.000 0.025 0.000 3/46656 940.0 0.832 0.864 0.804 -0.000 0.024 0.000 3/46656 950.0 0.824 0.855 0.796 -0.000 0.024 0.000 3/46656 960.0 0.815 0.846 0.788 -0.000 0.024 0.000 3/46656 970.0 0.807 0.838 0.780 -0.000 0.024 0.000 3/46656 980.0 0.799 0.829 0.772 -0.000 0.023 0.000 3/46656 990.0 0.791 0.821 0.764 -0.000 0.023 0.000 3/46656 1000.0 0.783 0.813 0.757 -0.000 0.023 0.000 3/46656 Thermal conductivity related properties were written into "kappa-m996.hdf5". Summary of calculation was written in "phono3py.yaml". -------------------------[time 2026-01-08 12:35:00]------------------------- _ ___ _ __ __| | / _ \ '_ \ / _` | | __/ | | | (_| | \___|_| |_|\__,_|